smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CN(C)CCCNCCC(=O)NN 58862484 GAERAVMLDZLCIQ-UHFFFAOYSA-N 188.275 -1.092 50 10 AAGE C[C@H](C(=O)NN)N1CCC(O)CC1 82465920 JPRFTUKPARNZFK-ZCFIWIBFSA-N 187.243 -1.179 50 10 AAGE CC(C)(CN)C(=O)NN 167849701 UXJGRQVIHZQUFK-UHFFFAOYSA-N 131.179 -1.039 50 10 AAGE COc1cccc(B(O)O)c1N 204735250 MLMUSSPXURFNLO-UHFFFAOYSA-N 166.973 -1.043 50 10 AAGE NNC(=O)CC1CS(=O)(=O)C1 212759387 MLWJJPZBMAOGMK-UHFFFAOYSA-N 178.213 -1.589 50 10 AAGE Cc1cn(C[C@@H](O)C#N)c(=O)[nH]c1=O 238492608 QPUQMUBZOYUIHA-LURJTMIESA-N 195.178 -1.271 50 10 AAGE C[C@H]1CC[C@H]1NC(=O)C(=O)NN 306172133 FRARCMHAVVFFSJ-CRCLSJGQSA-N 171.200 -1.109 50 10 AAGE O=CNNC(=O)[C@H]1CCNC(=O)C1 306451402 WGYSYLHVRJWTRA-YFKPBYRVSA-N 185.183 -1.710 50 10 AAGE N[C@H]1CNNC(=O)[C@H]1Cl 306823921 VAWMCEQQZVMGRC-HRFVKAFMSA-N 149.581 -1.445 50 10 AAGE N#C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO 307933521 GQXJZINGMGHWDU-VANKVMQKSA-N 177.156 -3.054 50 10 AAGE COCC(=O)NN[C@@H](C)C(N)=O 308141506 HRAGPDOEARTAHY-BYPYZUCNSA-N 175.188 -1.873 50 10 AAGE NNC(=O)CCCCN1CC(O)C1 384181435 WHFJCNREJUYUBA-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE CN(N)C(=O)C[C]1C#CNN1 885194403 PMGXUNLPAPHKGA-UHFFFAOYSA-N 153.165 -1.691 50 10 AAGE C#CCCOC(=O)NCB(O)O 1887812201 RUHNAASWPAHAJI-UHFFFAOYSA-N 170.961 -1.252 50 10 AAGE CCON(C)CC(=O)NN 1928678046 LYYSKLUCRSTIII-UHFFFAOYSA-N 147.178 -1.140 50 10 AAGE Cn1ccc(C(=O)NNCCO)n1 1929832213 OJMOXYSNZOKMMK-UHFFFAOYSA-N 184.199 -1.353 50 10 AAGE N#C[C@@H](O)[C@H]1COCCN1 1953171695 OQQHMKPUEGIBTH-PHDIDXHHSA-N 142.158 -1.141 50 10 AAGE C[S@@](=O)C1CN(C(=O)NN)C1 1953327235 ZHMLZPZFACQFAM-LLVKDONJSA-N 177.229 -1.368 50 10 AAGE C[C@H](O)CCNC(=O)C#CB(O)O 2241467938 DRTRBCDUOHNQBF-LURJTMIESA-N 184.988 -2.111 50 10 AAGE C[C@H]1CN(C(=O)C#CB(O)O)C[C@@H]1F 2241468461 OUYUKISNLDGBPL-BQBZGAKWSA-N 198.990 -1.182 50 10 AAGE C#CC(=O)N1CC[C@@H](B(O)O)C1 2297009205 SWOVKRUUKPIPHS-ZCFIWIBFSA-N 166.973 -1.305 50 10 AAGE C[C@@H](CNCCCO)C(=O)NN 58844452 HPCJYINYSJCYIC-LURJTMIESA-N 175.232 -1.416 50 10 AAGE NNC(=O)OCCC[C@H](N)C(=O)O 78074025 KVWHQARMOZSAKQ-BYPYZUCNSA-N 191.187 -1.222 50 10 AAGE O=C1OC(=O)[C@H]2CNC[C@H]12 207563318 WGRNJBASWAHMQX-IMJSIDKUSA-N 141.126 -1.095 50 10 AAGE CN(C)CC(=O)NNC(N)=S 238288735 XWXLIGIQURLOLC-UHFFFAOYSA-N 176.245 -1.588 50 10 AAGE C[C@H](O)CN(C)C[C@H](C)C(=O)NN 251147018 XREQFURYKVDOJC-BQBZGAKWSA-N 189.259 -1.075 50 10 AAGE CC(=O)NNS(=O)(=O)NC(C)=O 306535011 LJKVLPAFNCMCSQ-UHFFFAOYSA-N 195.200 -1.992 50 10 AAGE NNC(=O)CN1CCOC[C@@H](O)C1 307112966 AJDXHJJIUOWIES-LURJTMIESA-N 189.215 -2.331 50 10 AAGE CN1CC[C@H](N(C)CC(=O)NN)C1 307411899 KJJMBZHQFUALOP-ZETCQYMHSA-N 186.259 -1.388 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C(CO)[C@H]2C1 1929054635 LWYOZAPCKPBCMV-WHFBIAKZSA-N 199.210 -2.327 50 10 AAGE Cn1cncc1[C@](C)(N)B(O)O 1934646531 KLDSANVNZPMDPY-LURJTMIESA-N 168.993 -1.394 50 10 AAGE CN(CCC(=O)NN)Cc1ncno1 1955508123 WOSLCUPDWKVGSV-UHFFFAOYSA-N 199.214 -1.119 50 10 AAGE CN1CCN(CCC(=O)NN)[C@H]2C[C@H]21 1956637452 OAMIOQWCJNVEBO-SFYZADRCSA-N 198.270 -1.245 50 10 AAGE C[C@@H](O)CCNC(=O)C#CB(O)O 2241467939 DRTRBCDUOHNQBF-ZCFIWIBFSA-N 184.988 -2.111 50 10 AAGE CCN(C)C(=O)C#CB(O)O 2241468179 IOGPPINTDSGLNQ-UHFFFAOYSA-N 154.962 -1.520 50 10 AAGE C#CC#CCNC(=O)C#CB(O)O 2241469047 ZDUWYOCEQSCLEB-UHFFFAOYSA-N 174.952 -2.245 50 10 AAGE C[C@]1(NC(=O)C#CB(O)O)CCOC1 2241479279 VIINMQKCQQYHKD-QMMMGPOBSA-N 196.999 -1.703 50 10 AAGE Cn1nc(B(O)O)c(C(=O)NO)n1 2241584329 MJKUQVPWONVKAW-UHFFFAOYSA-N 185.936 -3.386 50 10 AAGE NC(=O)NC(=O)c1ccc(B(O)O)o1 2241584411 NGKKBTCEDAQWRJ-UHFFFAOYSA-N 197.943 -2.232 50 10 AAGE CN(CCC#N)CC(=O)NN 58839063 AEVYUJHZLFODOC-UHFFFAOYSA-N 156.189 -1.178 50 10 AAGE NNC(=O)[C@@H](N)CCC(N)=O 113490483 IWQDDELRRMFVAF-VKHMYHEASA-N 160.177 -2.431 50 10 AAGE COC(=O)[C@H](O)/C(C)=N/NC(N)=O 143830753 KXUARSOMLKXWNB-QKNIHBTKSA-N 189.171 -1.436 50 10 AAGE C[C@H](O)C(=O)O[Si](C)(O)O 196470833 GJWAUYCSBMAJMS-VKHMYHEASA-N 166.205 -1.536 50 10 AAGE COc1nc(B(O)O)cs1 200991155 IHSTXFGBXLTTDC-UHFFFAOYSA-N 158.975 -1.169 50 10 AAGE Cc1cnc(N)cc1B(O)O 238531479 RTUQNHQNJCDRMC-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE N#Cc1cc(N)ncc1B(O)O 238606481 IXOPTCAMPJHXCD-UHFFFAOYSA-N 162.945 -1.785 50 10 AAGE CC(=O)N1CSC[C@@H]1C(=O)NN 307199028 ZBPZTSZVZDPWIS-RXMQYKEDSA-N 189.240 -1.102 50 10 AAGE CC(=O)NNS(=O)(=O)N(C)C 307755048 CEICDPWSLQVCJT-UHFFFAOYSA-N 181.217 -1.567 50 10 AAGE CN1NC[C@@H]2C(=O)N[C@@H](Cl)N[C@H]21 575626288 BKWTVDXHKNRKKM-FKZODXBYSA-N 190.634 -1.380 50 10 AAGE N#CC1=C(N2CC[C@@H](O)C2)NC#CN1 885558013 HEBJMNUAGQCYMQ-SSDOTTSWSA-N 190.206 -1.143 50 10 AAGE O=C(F)N1C[C@H](O)[C@H](O)[C@H]1CO 1877828309 ZZVRBPJOCZOBEL-MROZADKFSA-N 179.147 -1.526 50 10 AAGE NCC1(C(=O)NN)CC(O)C1 1880336829 YRYLCVAMPJSLFL-UHFFFAOYSA-N 159.189 -1.924 50 10 AAGE C[C@@H](F)CS(=O)(=O)NCB(O)O 1880685502 AVCPSCAHXPKXHX-SCSAIBSYSA-N 199.012 -1.724 50 10 AAGE CS(=O)(=O)CC(=O)NNCCO 1929832069 MLANSPWULZDZPD-UHFFFAOYSA-N 196.228 -2.356 50 10 AAGE CN(C)NC(=O)[C@@H](N)[C@@H]1CCOC1 1929928544 ZRAPHXOTRDTQEC-RQJHMYQMSA-N 187.243 -1.057 50 10 AAGE CCOC(=O)c1cn(C)c(B(O)O)n1 2241493779 QOPDVTATTIVEDE-UHFFFAOYSA-N 197.987 -1.723 50 10 AAGE O=C(CCO)NCC#CB(O)O 2241562538 PMWCSUAGFZTTAT-UHFFFAOYSA-N 170.961 -2.500 50 10 AAGE Cc1nn(C)c(B(O)O)c1C(=O)NO 2241583599 ALJXEZDICCKJID-UHFFFAOYSA-N 198.975 -2.473 50 10 AAGE NS(=O)(=O)N1CC[C@H](B(O)O)C1 2297008619 MFGKNIRJGHIGMK-BYPYZUCNSA-N 194.021 -2.261 50 10 AAGE CCNC(=O)CNC(=O)NN 36779915 OIDCIXKFOVGCJK-UHFFFAOYSA-N 160.177 -1.705 50 10 AAGE CC(=O)NNC(=O)[C@H]1CCC(=O)N1 39116948 ZAGIGEFVMRDMKG-RXMQYKEDSA-N 185.183 -1.568 50 10 AAGE C[C@H](CC(=O)NN)N(C)CCO 58839121 MQZCYQHIHWFIRG-ZCFIWIBFSA-N 175.232 -1.321 50 10 AAGE COC(=O)c1ccc(C(=O)NN)nn1 139737400 RFNCTSMWFDBQRI-UHFFFAOYSA-N 196.166 -1.133 50 10 AAGE CN(NC(=O)CC(N)=O)C(N)=O 307972998 IMMYKYGQOMLNJX-UHFFFAOYSA-N 174.160 -2.097 50 10 AAGE C[C@@H](O)[C@@H](O)/C=C\C=NNC(N)=O 687728786 SWKXUMHVDGLSRT-AZMZSWLNSA-N 187.199 -1.062 50 10 AAGE C[C@H](C(=O)NN)N(C)CC1(O)CC1 1889010681 NZBIGGMTROBBRW-ZCFIWIBFSA-N 187.243 -1.179 50 10 AAGE CN(C)CC=CC(=O)NNC=O 1923959117 ZWYYUZCBYGXNJG-UHFFFAOYSA-N 171.200 -1.119 50 10 AAGE C[C@H]([C@H](N)[C@@H](O)C#N)S(C)(=O)=O 1952838313 IWXMYGXXLJYVHT-SRQIZXRXSA-N 192.240 -1.369 50 10 AAGE NNC(=O)C(=O)N1CC(O)(CO)C1 1954070321 XOQUJMGJJKJIIY-UHFFFAOYSA-N 189.171 -3.458 50 10 AAGE CCn1ncc(C(=O)NNCCO)n1 1956951159 RDPWVPDTGSOOGL-UHFFFAOYSA-N 199.214 -1.475 50 10 AAGE CCON(C)c1ncncc1B(O)O 1956956576 ATVRXZZJSNHJAB-UHFFFAOYSA-N 197.003 -1.456 50 10 AAGE COC(=O)c1nn(C)cc1B(O)O 1962712731 KTJHPNZEVBSGHG-UHFFFAOYSA-N 183.960 -2.114 50 10 AAGE OB(O)c1nccn1C(F)F 2241336976 MIGKCXRGGKWSCM-UHFFFAOYSA-N 161.904 -1.042 50 10 AAGE C[C@H]1C[C@@H]1NC(=O)C#CB(O)O 2241468067 GUEXUTHXGZVMOT-WDSKDSINSA-N 166.973 -1.474 50 10 AAGE NCC1(O)CN(C(=O)C#CB(O)O)C1 2241468158 IKCKIMONQMAOHC-UHFFFAOYSA-N 197.987 -3.466 50 10 AAGE COc1n[nH]cc1C(=O)NCB(O)O 2241549962 QQIBVCNYPADHBC-UHFFFAOYSA-N 198.975 -1.840 50 10 AAGE N#CC1(O)CCN(C[C@H](N)CO)CC1 2241795356 DPKBWJBPZUVYGN-QMMMGPOBSA-N 199.254 -1.344 50 10 AAGE COC(=O)NNC(N)=O 14442113 PNARXUZBWHVPNP-UHFFFAOYSA-N 133.107 -1.074 50 10 AAGE Cn1nccc1C(=O)NNC(N)=O 70044675 HTZKYNTZZPEDDI-UHFFFAOYSA-N 183.171 -1.267 50 10 AAGE CC(=O)NNC(=N)CN 104640603 LHZWWAMDHAQWNW-UHFFFAOYSA-N 130.151 -1.437 50 10 AAGE O=C1O[C@H]([C@H](O)CCl)[C@@H](O)[C@@H]1O 110342651 NLGDTEKLDFSSIH-MGCNEYSASA-N 196.586 -1.767 50 10 AAGE OB(O)c1cncc(C2COC2)c1 221936920 WKRFRMIVOJXMEZ-UHFFFAOYSA-N 178.984 -1.125 50 10 AAGE NC(=O)NNC(=O)c1cc[nH]c(=O)c1 236183262 XMNXHUDCUAVCBF-UHFFFAOYSA-N 196.166 -1.312 50 10 AAGE O=CNNc1nccc(O)n1 238710622 SJAKPAJAJRXTOS-UHFFFAOYSA-N 154.129 -0.745 50 10 AAGE O=C1O[C@H]2[C@H](O[C@@H](O)[C@H]2O)[C@@H]1Cl 306298384 JVPLUSMMESVGIN-VCSGLWQLSA-N 194.570 -1.403 50 10 AAGE NNC(=O)[C@H]1CN[C@H](O)CC1=O 307353720 CUNOQZMIRMPAAO-WVZVXSGGSA-N 173.172 -2.527 50 10 AAGE NC(=O)NNCCC[C@H](N)C(=O)O 379349530 PEWZEOGLRHLMPG-BYPYZUCNSA-N 190.203 -1.649 50 10 AAGE CC1=C=C(B(O)O)N(C)N1 575624091 DGGYFSUZZFEISU-UHFFFAOYSA-N 139.951 -1.165 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]1C(N)=O 757144849 JOJOCOPLKGIEPM-VKHMYHEASA-N 186.171 -2.938 50 10 AAGE C[C@@H]1[C@H](O)CN1CCC(=O)NN 1880906880 JSRZSEQAETTZNX-PHDIDXHHSA-N 173.216 -1.569 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2C(CO)[C@H]2C1 1929055637 WUSLFPWQGCPPIB-VQVTYTSYSA-N 199.254 -1.465 50 10 AAGE OB(O)c1cccc2c(O)n[nH]c12 1951330252 PYWZSJBVOZDSSN-UHFFFAOYSA-N 177.956 -1.052 50 10 AAGE C[C@H](C(=O)NN)N1CCN(C)[C@H]2C[C@@H]21 1956635681 CSCVVKQZNSXIEO-CSMHCCOUSA-N 198.270 -1.247 50 10 AAGE C[C@@H](NC(=O)C#CB(O)O)C(C)(C)N 2241478350 COAGOHSJBRXDDJ-ZCFIWIBFSA-N 198.031 -1.756 50 10 AAGE CN(C(=O)C#CB(O)O)[C@H]1CC[C@H]1N 2241478646 JLPHDRRFGLEPKT-RQJHMYQMSA-N 196.015 -2.050 50 10 AAGE C[C@H](C(=O)NN)N1CCO[C@H](C#N)C1 86656722 YGMDGMWCCUMBHW-RNFRBKRXSA-N 198.226 -1.411 50 10 AAGE O=C(O)[C@@H](O)[C@](O)(OO)C(=O)O 103835835 DONFFNSWBSKBRF-HDEYOGFKSA-N 182.084 -2.305 50 10 AAGE OB(O)c1ccnc(-n2ccnc2)n1 198083747 LTKCLLZNJDNLOA-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE N#Cc1c(O)cncc1B(O)O 238636850 UZKZDHLDADHIFH-UHFFFAOYSA-N 163.929 -1.661 50 10 AAGE O=C(O)[C@H]1C[C@H]1B(O)O 306366506 FXMXXTMWWQHMPE-STHAYSLISA-N 129.908 -1.066 50 10 AAGE N#C/C(C=NNC(N)=O)=C(\O)NC=O 394793222 OLXINOFQLRHWRX-KDRZKBSFSA-N 197.154 -1.320 50 10 AAGE CNC1CC(C(=O)NN)C1 575494099 LXPOGTBKUFQLJA-UHFFFAOYSA-N 143.190 -1.026 50 10 AAGE NNC(=O)CCN1C(=O)COC1=O 709015506 ZMIGCYWRJYNRDV-UHFFFAOYSA-N 187.155 -1.655 50 10 AAGE N#CC1=C(N)N(Cc2c#con2)NN1 885555318 LYJSBJNFXCBSJN-UHFFFAOYSA-N 190.166 -1.249 50 10 AAGE N#C[C@H](O)[C@@H]1CNCCO1 1880121164 OSPAPYZOHAITAV-WDSKDSINSA-N 142.158 -1.141 50 10 AAGE CN(C(=O)NN)[C@H]1CCC(=O)NC1 1882577015 LAGBITYLKQACJF-YFKPBYRVSA-N 186.215 -1.220 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2COCC[C@@H]21 1890150827 JNQHQPJAOYTXPF-WDSKDSINSA-N 199.210 -1.776 50 10 AAGE C[C@@H]1[C@H](O)CCN1CCC(=O)NN 1914256322 OZIBYCNQJAIPOP-RNFRBKRXSA-N 187.243 -1.179 50 10 AAGE NNC(=O)C(=O)N1CC[C@@]12CCOC2 1915567505 JMANFNMSNJGBDR-QMMMGPOBSA-N 199.210 -1.632 50 10 AAGE C[C@H](C(=O)NN)N1CC2(CN(C)C2)C1 1932061827 ZIOXKOHRWOREPP-SSDOTTSWSA-N 198.270 -1.388 50 10 AAGE N#C[C@@H](O)[C@H](N)CO 1952792137 FYRPWEWOPQMSFW-QWWZWVQMSA-N 116.120 -1.810 50 10 AAGE CC(C)(O)[C@H](N)[C@H](O)C#N 1952793420 LMSZQJAHGFNHGB-RFZPGFLSSA-N 144.174 -1.031 50 10 AAGE NNC(=O)[C@H]1OCC[C@H]1C(=O)O 1953471939 WATIAXZLXJGAFF-DMTCNVIQSA-N 174.156 -1.534 50 10 AAGE CN(C)NC(=O)[C@@H]1CO[C@@H]2CNC[C@@H]21 1955556421 LWTBLUCNYDYZPJ-BWZBUEFSSA-N 199.254 -1.186 50 10 AAGE NCCONc1ncccc1B(O)O 2210060967 OUIHDDNZKYNFCZ-UHFFFAOYSA-N 197.003 -1.936 50 10 AAGE NC[C@@H]1C[C@@H]1NC(=O)C#CB(O)O 2241479491 ZBZWBNMEGDTTRD-WDSKDSINSA-N 181.988 -2.535 50 10 AAGE CC[C@H](NC(=O)C#CB(O)O)[C@@H](C)O 2241479513 ZNUCMCUFYJDPSY-RQJHMYQMSA-N 199.015 -1.723 50 10 AAGE O=C(O)[C@H]1C[C@@H]1C(=O)NCB(O)O 2242200549 CYAUEGNGVOOKRC-IMJSIDKUSA-N 186.960 -2.165 50 10 AAGE NNC(=O)c1cnc(N)cc1N 104569149 AWTHIAAYAYXSKF-UHFFFAOYSA-N 167.172 -1.151 50 10 AAGE CN1CCOC[C@@H]1C(=O)NN 222912988 HUMXJCCIKLSSRI-RXMQYKEDSA-N 159.189 -1.693 50 10 AAGE NNC(=O)COC[C@H]1CCCNC1 260561247 PCJQAOXMXIJYRK-ZETCQYMHSA-N 187.243 -1.008 50 10 AAGE O[C@H]1OC[C@@H](O)[C@@H](O)[C@H]1Cl 306244834 QBZSYPGANFVRKW-AIHAYLRMSA-N 168.576 -1.336 50 10 AAGE O[C@H]1OC[C@@H](O)[C@H](O)[C@@H]1Cl 306244837 QBZSYPGANFVRKW-STGXQOJASA-N 168.576 -1.336 50 10 AAGE CC(=O)NNC(=O)[C@H]1C[C@H]1[N+](=O)[O-] 307527182 SANBGVJOTCUXSG-CRCLSJGQSA-N 187.155 -1.181 50 10 AAGE O=C[C@@H](O)[C@@H](O)[C@H](O)/C=C/B(O)O 687752368 WRTNKKAVXFZOQQ-NDMCQMBCSA-N 189.960 -3.164 50 10 AAGE CN(C)NC(=O)[C@@]12CNC[C@H]1CCO2 705033351 AFJQZSSGXKVBNU-VXNVDRBHSA-N 199.254 -1.042 50 10 AAGE C[C@@H](O)C1CN(CCC(=O)NN)C1 719809208 YMXAFGUPYVGBEI-ZCFIWIBFSA-N 187.243 -1.321 50 10 AAGE CC(C)C(=O)NCC#CB(O)O 1881436491 KGECPPZYANOZBX-UHFFFAOYSA-N 168.989 -1.226 50 10 AAGE C[C@@H]1CNC(=O)CN1CC(=O)NN 1882315030 HUUXRTFFVRAFHC-RXMQYKEDSA-N 186.215 -2.203 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@]1(C)CO 1932968126 UHRWLHISLBUQJO-HTRCEHHLSA-N 187.243 -1.179 50 10 AAGE Cc1nnc(B(O)O)o1 1951330413 AXVYHISKUNIAAO-UHFFFAOYSA-N 127.896 -1.942 50 10 AAGE O=C(C#CB(O)O)NN1CCCCC1 2241468339 MACBRHFSETVQOY-UHFFFAOYSA-N 196.015 -1.481 50 10 AAGE NC[C@@H]1C[C@H]1NC(=O)C1(B(O)O)CC1 2241473042 BVIGHSMEUBAWTA-NTSWFWBYSA-N 198.031 -1.543 50 10 AAGE Cc1ccc(C(=O)NN)cc1B(O)O 2241473346 IPIQNSIMKUWOSK-UHFFFAOYSA-N 193.999 -1.722 50 10 AAGE CC1(CNC(=O)C#CB(O)O)CC1 2241475987 JIPXMSCGQMFIKZ-UHFFFAOYSA-N 181.000 -1.082 50 10 AAGE COC(=O)c1ncncc1B(O)O 2241492815 GBGLGHWGWNOEIR-UHFFFAOYSA-N 181.944 -2.057 50 10 AAGE C#CCNC(=O)C1CC(B(O)O)C1 2241494840 DWFBAUFQMAEENH-UHFFFAOYSA-N 181.000 -1.011 50 10 AAGE NNC(=O)C(=O)N1CCC[C@@H](O)C1 42472210 PJNJRFHNYYOVPM-RXMQYKEDSA-N 187.199 -2.040 50 10 AAGE O=CC1=C[C@H](O)[C@H](O)[C@H](O)C1 148533812 UZGBQMZZECVISB-XVMARJQXSA-N 158.153 -1.402 50 10 AAGE NCc1cccnc1B(O)O 196648339 YGXGJZHLIDYXHX-UHFFFAOYSA-N 151.962 -1.780 50 10 AAGE C[C@@H](CC(=O)NN)C(=O)NN 201840408 FHHKCFYYCSYEKX-VKHMYHEASA-N 160.177 -2.008 50 10 AAGE 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QVYRKKBRZGTCNX-SCSAIBSYSA-N 144.178 -2.462 50 10 AAGE COC(=O)NNCCO 142840781 QKPULEHJQKNUDX-UHFFFAOYSA-N 134.135 -1.161 50 10 AAGE N=C1N/C(=N/N)N[C@@H](Cl)N1 238552395 RBRSVVMYGOUDPQ-SFOWXEAESA-N 162.584 -1.544 50 10 AAGE NCc1cc2c(c(B(O)O)c1)OCO2 238619082 MJGVWRWOOHRJHC-UHFFFAOYSA-N 194.983 -1.446 50 10 AAGE O=[N+]([O-])c1cccc(B(O)O)c1O 250637476 GDJHCCBLZVNTLT-UHFFFAOYSA-N 182.928 -1.020 50 10 AAGE Cc1cc(O)nc(B(O)O)c1 306882020 ILOAIGBCBQFZIV-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE C[C@H]1COC[C@@H]1NC(=O)C(=O)NN 575485373 NQVDNPVUFBXBAU-WHFBIAKZSA-N 187.199 -1.873 50 10 AAGE CCN1C#CN[C-]1/C=C/B(O)O 885278573 ZEPNASHOERKOQF-ONEGZZNKSA-N 164.981 -1.112 50 10 AAGE CN1N=C=C(S(=O)(=O)N=C=O)N1 885518013 MNSOKUIUHAQOPN-UHFFFAOYSA-N 188.168 -1.472 50 10 AAGE NNC(=O)CN1C[C@@H]2COC[C@H]21 1881023987 YWKVTAYFHRXJSC-PHDIDXHHSA-N 171.200 -1.693 50 10 AAGE OB(O)c1cnn(C[C@H]2C[C@@H]2F)c1 1882861202 PFCIBNLVUDOVDN-VDTYLAMSSA-N 183.979 -1.079 50 10 AAGE CN(CCN(C)NC=O)NC=O 1923946615 SQOJQGFOHQHGEZ-UHFFFAOYSA-N 174.204 -1.828 50 10 AAGE NNC(=O)N1CC(NC(N)=O)C1 1953592388 GTKZKPKEJQAPSJ-UHFFFAOYSA-N 173.176 -2.078 50 10 AAGE C#CCONC(=O)C1(B(O)O)CC1 2241473289 HJWSTEONKMJSOB-UHFFFAOYSA-N 182.972 -1.326 50 10 AAGE OC[C@@H]1O[C@@H](O)[C@@H](O)[C@@H](Cl)[C@@H]1O 22054421 CRJLKIILIKSPDH-MDMQIMBFSA-N 198.602 -1.975 50 10 AAGE in-vitro CN1CCN(CCC(=O)NN)C1=O 82471504 WTPNPUZXABCMQH-UHFFFAOYSA-N 186.215 -1.266 50 10 AAGE OC[C@@H]1O[C@@H](O)[C@H](Cl)[C@H](O)[C@@H]1O 101185557 SNGNCYILSHZBLM-SXUWKVJYSA-N 198.602 -1.975 50 10 AAGE COc1cncc(C=O)c1B(O)O 238345442 XCRAQFLFPGVQJP-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE NNC(=O)[C@H](O)C[C@@H](O)[C@@H](O)CO 238556157 QUOAGKAVEJSDPQ-WDCZJNDASA-N 194.187 -3.559 50 10 AAGE NNC(=O)CN1CCCOC1=O 306519593 DCCVNERIVPUZHO-UHFFFAOYSA-N 173.172 -1.181 50 10 AAGE NNC(=O)C[C@@H]1CC[C@H]1C(=O)NN 306673055 MTBZOPOBEJNPET-CRCLSJGQSA-N 186.215 -1.618 50 10 AAGE C/C(=N\NC(N)=O)[C@](C)(N)CO 306743128 WQVAKYYVYQOMPV-ZTTKRAHPSA-N 174.204 -1.260 50 10 AAGE COCCn1cc(B(O)O)ccc1=O 379520660 FCIQZERPGGDAHC-UHFFFAOYSA-N 196.999 -1.826 50 10 AAGE OB(O)Cc1ccccc1CB(O)O 393656692 JOTLUNYMSDLKGP-UHFFFAOYSA-N 193.804 -1.204 50 10 AAGE CN(CC(=O)NN)[C@H]1CCC[C@H]1O 708050837 MFSBMTCQTALXOU-NKWVEPMBSA-N 187.243 -1.179 50 10 AAGE N#CC1=C(N2CC[C@@H](N)C2)NNC#C1 885540642 UXZSBMIWRZNDGY-MRVPVSSYSA-N 189.222 -1.177 50 10 AAGE NC[C@@H]1CCC[C@H](C(=O)NN)O1 1877235743 GTFVLRUQJUDGLY-NTSWFWBYSA-N 173.216 -1.127 50 10 AAGE NC(=O)CNC(=O)/C=C/C(=O)Cl 1881396422 XDPOSYMDYTXDFK-OWOJBTEDSA-N 190.586 -1.091 50 10 AAGE NNC(=O)CN1CC2(CNC(=O)N2)C1 1884975862 KUGJVIMOMHGOMY-UHFFFAOYSA-N 199.214 -2.657 50 10 AAGE C/C=C/CNC(=O)C#CB(O)O 2241467747 AIVMNBPGYFCVST-NSCUHMNNSA-N 166.973 -1.306 50 10 AAGE O=C([C@H]1C[C@@H]1B(O)O)N1CC=CCN1 2241474642 HVUGWTYYWDLMAO-BQBZGAKWSA-N 196.015 -1.248 50 10 AAGE N#CC1CN(C(=O)[C@@H]2C[C@@H]2B(O)O)C1 2241481773 VJYYIYFDJXMWLG-RQJHMYQMSA-N 193.999 -1.169 50 10 AAGE COC(=O)N[C@H](C)CNC(=O)NN 2242274106 ABLFTYNZBRCTSM-SCSAIBSYSA-N 190.203 -1.096 50 10 AAGE C[C@H](O)CCN(C)C(=O)C(=O)NN 164137711 ZZDQGLXWOYCJRZ-YFKPBYRVSA-N 189.215 -1.794 50 10 AAGE C[C@]1(CC(=O)NN)NC(=O)NC1=O 238468591 GCNILAJOASESGT-ZCFIWIBFSA-N 186.171 -2.036 50 10 AAGE O=C1O[C@@H]2[C@H](O)[C@H](O)O[C@H]2[C@@H]1Cl 306298377 JVPLUSMMESVGIN-AZLKCVHYSA-N 194.570 -1.403 50 10 AAGE CO[C@@H]1CN(C(=O)NN)C[C@H]1O 306723079 QXVNFRKYBKQIGF-RFZPGFLSSA-N 175.188 -1.739 50 10 AAGE CSCC(=O)NNC(=O)[C@H](C)O 308171416 WYLSAEVMBNJUJL-BYPYZUCNSA-N 192.240 -1.122 50 10 AAGE CC(C)(C)[C@@H](O)[C@@H](N)C(=O)NN 1881225523 WNQDEQBPDIRKIK-UHNVWZDZSA-N 175.232 -1.289 50 10 AAGE O=c1ccc(B(O)O)cn1C(F)F 1882116716 ZMVCNKIYYYBDQT-UHFFFAOYSA-N 188.926 -1.077 50 10 AAGE NC(=O)[C@H]1C(=O)NCCN1C(=O)F 1882783221 BMUCOWJOEIDTJH-VKHMYHEASA-N 189.146 -1.638 50 10 AAGE CO[C@H]1C[C@](N)(C(=O)NN)C1 1932308568 YZSAWPGKLLZQKR-SJEUGXSHSA-N 159.189 -1.517 50 10 AAGE NNC(=O)[C@@H]1C[C@H](N)[C@@H]2C[C@H]12 1951338992 AYUGSVNUXYTPAE-KCDKBNATSA-N 155.201 -1.040 50 10 AAGE COCc1nc(C=CB(O)O)n(C)n1 2209866448 IEYUSOXLCHJDPY-UHFFFAOYSA-N 197.003 -1.013 50 10 AAGE CC=CCn1cc(B(O)O)cnc1=O 2210086670 PJXFMFYVCSPYCW-UHFFFAOYSA-N 193.999 -1.501 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CC[C@H]2C[C@H]21 2241467885 COOLDGNXDRUXLN-XLPZGREQSA-N 193.011 -1.084 50 10 AAGE NS(=O)(=O)N1CC[C@@H](B(O)O)C1 2297008620 MFGKNIRJGHIGMK-SCSAIBSYSA-N 194.021 -2.261 50 10 AAGE NNC(=O)CCNC(N)=S 166591953 MQASNXWSMRDFBC-UHFFFAOYSA-N 162.218 -1.800 50 10 AAGE Cn1nc(N)c(/C=N/NC(N)=O)n1 306302095 NGKPFVMBROVJIP-KRXBUXKQSA-N 183.175 -1.601 50 10 AAGE NNC(=O)[C@H]1CCC[C@H]1C(=O)NN 306705288 GMCCMPWCCUHTKT-SYDPRGILSA-N 186.215 -1.618 50 10 AAGE CN(N)C(=O)[C@H]1CCC(=O)NC1 575556957 FEANWBZWTJSTSY-YFKPBYRVSA-N 171.200 -1.155 50 10 AAGE N[C@@]1(B(O)O)[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 1880381906 CWEDDDLIAXZOMU-ZYNSJIGGSA-N 152.990 -1.018 50 10 AAGE O=C1C[C@@H](Cn2cnnn2)C(=O)O1 1951542425 INOPGGOZYVTUQS-BYPYZUCNSA-N 182.139 -1.237 50 10 AAGE O=C(C#CB(O)O)N1CCC[C@H]1CO 2241468616 RFEJQASJIKUEIH-ZETCQYMHSA-N 196.999 -2.015 50 10 AAGE N#CNC(=O)c1ccncc1B(O)O 2241471518 JYFGNYVMYWVYFJ-UHFFFAOYSA-N 190.955 -2.028 50 10 AAGE N#CC1CN(C(=O)C2(B(O)O)CC2)C1 2241473165 FBMZGCBNXISWAB-UHFFFAOYSA-N 193.999 -1.025 50 10 AAGE O=C(N1CC[C@@H]1CO)C1(B(O)O)CC1 2241473505 LOPQGHYIBBPHEY-ZCFIWIBFSA-N 199.015 -1.413 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H](O)C1 61713356 IULFXFOJKHHRIG-SCSAIBSYSA-N 173.172 -2.431 50 10 AAGE NNC(=O)CSCCO 82472484 IDVCLBLFCJHUML-UHFFFAOYSA-N 150.203 -1.298 50 10 AAGE CN(C=O)CB(O)O 196268589 YVOPKIIZPGYXJM-UHFFFAOYSA-N 116.913 -1.913 50 10 AAGE Cn1ccc(C(=O)NNC(N)=O)n1 231927400 WXXJJGNFGPEBJP-UHFFFAOYSA-N 183.171 -1.267 50 10 AAGE CC(=O)N[C@H](C(=O)NN)[C@H](C)O 238497829 CBVHCLYCQVWDIK-UCORVYFPSA-N 175.188 -2.138 50 10 AAGE CN1CC[C@H]([C@@H](N)CC(=O)NN)C1 259017126 IGQOGBXRRFVNGG-BQBZGAKWSA-N 186.259 -1.355 50 10 AAGE CC[S@](=O)CC(=O)NN 526869875 ZDAYLZGGVFMVOH-VIFPVBQESA-N 150.203 -1.255 50 10 AAGE CO[C@H](C)Cn1cc(B(O)O)cn1 694537692 YJGZNLRADHLWHI-ZCFIWIBFSA-N 184.004 -1.402 50 10 AAGE C=C(CN1C[C@@H]2COC[C@@H]21)B(O)O 1877553176 YAAFTZZVZOKKDV-SFYZADRCSA-N 183.016 -1.115 50 10 AAGE C[C@@H](O)C(=O)N(C)N 1879942267 NFRXVCWXCNVUHB-GSVOUGTGSA-N 118.136 -1.301 50 10 AAGE O=C(NCB(O)O)[C@H]1C[C@@H]1CF 1881199599 IYEGDVQLYMYVOA-UHNVWZDZSA-N 174.968 -1.280 50 10 AAGE NNC(=O)C(=O)N[C@H]1CO[C@H]2C[C@@H]1C2 1886080133 RJFVEAQBQDUUHO-JKUQZMGJSA-N 199.210 -1.730 50 10 AAGE O=C(NCC=CB(O)O)c1cocn1 1892926136 YWFONLFFKQCXFN-UHFFFAOYSA-N 195.971 -1.027 50 10 AAGE O=C(Cn1cncn1)NNCCO 1929831958 KZWYWPAWERVUSB-UHFFFAOYSA-N 185.187 -2.109 50 10 AAGE COCC[C@](N)(COC)B(O)O 1953355366 VLPWQFNJDGRWTB-LURJTMIESA-N 177.009 -1.621 50 10 AAGE CC(C)[C@@H](O)CN(C)CC(=O)NN 1953871364 OFTRFHIRWHZSCZ-ZETCQYMHSA-N 189.259 -1.075 50 10 AAGE NNC(=O)CCN1CC[C@H]2C[C@]2(O)C1 1956824384 RDESUNVCNVBRNW-CBAPKCEASA-N 199.254 -1.177 50 10 AAGE O=C(C#CB(O)O)N1CCC1 2241468068 GURNUDPGAATCFB-UHFFFAOYSA-N 152.946 -1.766 50 10 AAGE O=C(C#CB(O)O)N[C@H]1CCONC1 2241468643 ROXTVJWASMMGDJ-LURJTMIESA-N 197.987 -2.589 50 10 AAGE NNC(=O)C1CN(C2CCNCC2)C1 2241873661 FRZDFYIGINOYIE-UHFFFAOYSA-N 198.270 -1.340 50 10 AAGE N#CC(C(N)=O)=C1NCCO1 2293641103 GYJUPLPULOMMAQ-UHFFFAOYSA-N 153.141 -1.173 50 10 AAGE CNC(=O)NNC(N)=O 1596458 VVWUIHPYJZXQRG-UHFFFAOYSA-N 132.123 -1.501 50 10 AAGE CN(CC(N)=O)C(=O)C(=O)NN 37269428 CJCSLQBPDIDBDL-UHFFFAOYSA-N 174.160 -3.080 50 10 AAGE C[C@@H](CNCCO)C(=O)NN 58855660 DXJCQQDHAQLWIS-YFKPBYRVSA-N 161.205 -1.806 50 10 AAGE C[C@@H]1CCN(CC(=O)NN)C[C@@H]1O 230356958 DWXOJVSKQZMROX-RQJHMYQMSA-N 187.243 -1.321 50 10 AAGE CN1C(=O)Cc2cc(B(O)O)ccc21 238319362 AIAZAPDHBMATGY-UHFFFAOYSA-N 190.995 -1.115 50 10 AAGE OB(O)c1cncc(OC(F)F)n1 238637021 QRHVYKWOJDUMNM-UHFFFAOYSA-N 189.914 -1.242 50 10 AAGE O=C(O)[C@@H](O)[C@@H](O)C(=O)Cl 238698582 LKCPSSDNCUYXGJ-NCGGTJAESA-N 168.532 -1.442 50 10 AAGE COC(=O)[C@H]1C[C@@H]1C(=O)NN 306163756 GPQNOOJSAQQWHO-IMJSIDKUSA-N 158.157 -1.215 50 10 AAGE CO[C@@H]1C=C[C@@](OC)(C(=O)NN)O1 306330218 OFMUTCFZNBXTOJ-FSPLSTOPSA-N 188.183 -1.122 50 10 AAGE CCN1CCOC[C@H]1C(=O)NN 306443261 QBRKUNIMLFABDW-LURJTMIESA-N 173.216 -1.303 50 10 AAGE O[C@@H]1[C@@H]2O[C@@H]2[C@@H]2O[C@H]2[C@@H](Cl)[C@@H]1O 307064022 QUESCFRWOZJUMV-NKBVIDEMSA-N 192.598 -1.136 50 10 AAGE Cn1cc(Cl)c(B(O)O)n1 584600001 NILBKBISBPBQNG-UHFFFAOYSA-N 160.369 -1.247 50 10 AAGE CCO[C@H]1C[C@@H]1C(=O)NCB(O)O 706479880 VBPZWWMJHMJMTP-WDSKDSINSA-N 187.004 -1.460 50 10 AAGE NNC(=O)C(=O)N[C@@H]1CC12CC2 715667552 JZQMDGYNICICJL-SCSAIBSYSA-N 169.184 -1.355 50 10 AAGE C[S@](=O)NCC#CB(O)O 1880099784 DGGZVVTTXVCSHV-JTQLQIEISA-N 160.991 -2.115 50 10 AAGE CO[C@@H]1CCNC[C@H]1C(=O)NN 1880974565 WHRNHCAZOSDABN-PHDIDXHHSA-N 173.216 -1.399 50 10 AAGE CC1(C)[C@H](O)C[C@]1(N)C(=O)NN 1881243621 HESJLGHJXFOYDK-FBCQKBJTSA-N 173.216 -1.535 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@H]2C[C@@H](O)[C@H]1C2 1884635097 PNAKZEPMSADYTR-LXGUWJNJSA-N 199.254 -1.180 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C[C@@H](F)C1 1893673537 OZIHWRXGIMVAAI-OLQVQODUSA-N 184.963 -1.382 50 10 AAGE CN(C)NC(=O)CCON 1935249399 KKKQGSSRSMAKPC-UHFFFAOYSA-N 147.178 -1.140 50 10 AAGE C[C@H]1CN[C@H](C(=O)NN)CO1 1953299344 BROXZZIELHTYDM-WHFBIAKZSA-N 159.189 -1.647 50 10 AAGE C#CCN(C)c1ncccc1B(O)O 2210068048 KQTTZISEMZUZGE-UHFFFAOYSA-N 190.011 -1.169 50 10 AAGE COC[C@H](C)N(C)C(=O)C#CB(O)O 2241478755 LBDHKHMJWXPZSG-ZETCQYMHSA-N 199.015 -1.505 50 10 AAGE COCCCNC(=O)C#CB(O)O 2241478930 NWBKIDZWKBJXBX-UHFFFAOYSA-N 184.988 -1.846 50 10 AAGE CNC(=O)c1ccc(B(O)O)cc1O 2241483058 OODQMXPGTNSDIE-UHFFFAOYSA-N 194.983 -1.568 50 10 AAGE NNC(=O)c1c(N)n[nH]c1N 39134007 IQRPKCYRXQJIAB-UHFFFAOYSA-N 156.149 -1.822 50 10 AAGE C[C@H]1CCN(CC(=O)NN)C[C@@H]1O 230356960 DWXOJVSKQZMROX-BQBZGAKWSA-N 187.243 -1.321 50 10 AAGE Nc1nncc2cc(B(O)O)ccc12 238707670 UTCNUXUGVGRGEH-UHFFFAOYSA-N 188.983 -1.108 50 10 AAGE N#Cc1ccc(B(O)O)c(NN)c1 306901465 GPBJARBRIUEGOB-UHFFFAOYSA-N 176.972 -1.476 50 10 AAGE CC(=O)N1CCNC[C@H]1C(=O)NN 307199530 ZXTAAWURNPGDGW-LURJTMIESA-N 186.215 -2.203 50 10 AAGE COC(=O)NNC(=O)CC(=O)O 379331044 ZLOKVABTSDMHCI-UHFFFAOYSA-N 176.128 -1.152 50 10 AAGE CCO[C@H]1C[C@H]1C(=O)NCB(O)O 706479878 VBPZWWMJHMJMTP-RITPCOANSA-N 187.004 -1.460 50 10 AAGE NNC(=O)[C@H]1C[C@@H](N)CCO1 1880408223 SWWWZXGYPKIMHZ-CRCLSJGQSA-N 159.189 -1.517 50 10 AAGE COC(=O)NCC=CB(O)O 1880424962 VGXYFRSEBBKBKB-UHFFFAOYSA-N 158.950 -1.089 50 10 AAGE NNC(=O)CN1C[C@H]2COC[C@H]21 1881023986 YWKVTAYFHRXJSC-NTSWFWBYSA-N 171.200 -1.693 50 10 AAGE CO[C@H]1C[C@@H]1NC(=O)C(=O)NN 1881077174 AKZPRFPMWHWCNY-IMJSIDKUSA-N 173.172 -2.120 50 10 AAGE C[C@H](CN1C[C@@H](O)[C@H]1C)C(=O)NN 1882448676 YZEHJCSVWMJUIB-FSDSQADBSA-N 187.243 -1.323 50 10 AAGE O=C(CCO)NNC(=O)CCF 1923814001 WXJFYURTMPKSAF-UHFFFAOYSA-N 178.163 -1.124 50 10 AAGE CN(C)NC(=O)[C@H]1CCNO1 1932846291 USSCJJAVDNMSKD-RXMQYKEDSA-N 159.189 -1.127 50 10 AAGE NNC(=O)[C@@H]1NC[C@@H]2CC[C@@H]21 1935222971 RLKBTRAWLIFOMY-HCWXCVPCSA-N 155.201 -1.026 50 10 AAGE NNC(=O)C(=O)N[C@@H]1CCC[C@@H]1F 1954272290 SFXAEUCGPHYFBU-CRCLSJGQSA-N 189.190 -1.017 50 10 AAGE 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C[C@@H]1COC[C@H](C(=O)NN)N1C 306718285 HDEDHOHEKFUXCP-PHDIDXHHSA-N 173.216 -1.305 50 10 AAGE CN(NC(=O)[C@@H]1CCO1)C(N)=O 307027333 ZYFISEFRZVNYFK-BYPYZUCNSA-N 173.172 -1.183 50 10 AAGE O=CC1=CC(=O)[C@@H]2O[C@H]2[C@H]1O 307564786 QOYPXUBTGNKJBY-ACZMJKKPSA-N 154.121 -1.177 50 10 AAGE C=CCOCn1ccc(B(O)O)n1 707475928 YXEZNXJDWYCDJF-UHFFFAOYSA-N 181.988 -1.277 50 10 AAGE CN(C)NC(=O)C1=C=C(N)N[N]1 885197018 DOWQVWPLDZXJOX-UHFFFAOYSA-N 168.180 -2.015 50 10 AAGE NNC(=O)O[C@H]1CCNC1 885235732 AXTCDNKLTMPFOE-BYPYZUCNSA-N 145.162 -1.052 50 10 AAGE OB(O)C#CC1[C@H]2COC[C@H]12 1890661712 QKKBYVVQIMJRMZ-RNFRBKRXSA-N 151.958 -1.106 50 10 AAGE C[C@@H](Cn1ncccc1=O)C(=O)NN 1912229915 VWPRYCHQNYODCL-LURJTMIESA-N 196.210 -1.131 50 10 AAGE CCNC(=O)c1ncccc1B(O)O 2241473197 FTCBUUDXCDPUDA-UHFFFAOYSA-N 193.999 -1.489 50 10 AAGE C[C@H](O)C(C)(C)NC(=O)C#CB(O)O 2241478519 GXAQBUOGIWXAPA-LURJTMIESA-N 199.015 -1.723 50 10 AAGE C=C(CS(=O)(=O)NCC)B(O)O 2241481820 WICYDBSCQNBBCD-UHFFFAOYSA-N 193.033 -1.506 50 10 AAGE 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OB(O)c1cccc2c1CNC2 1881409669 UWSLUUSJHSVAIP-UHFFFAOYSA-N 162.985 -1.030 50 10 AAGE C=C(COCCn1cncn1)B(O)O 1895170167 XOHDQHMDLLFGSE-UHFFFAOYSA-N 197.003 -1.137 50 10 AAGE NNC(=O)C1(CN2CC(O)C2)CC1 1931266149 BEYFDJKIJLOWQU-UHFFFAOYSA-N 185.227 -1.567 50 10 AAGE Cc1nc(C)c(B(O)O)c(N(C)C)n1 1956964682 HNVUCOPMLJDSAC-UHFFFAOYSA-N 195.031 -1.161 50 10 AAGE CC(=O)NNc1cc(=O)[nH]c(=O)[nH]1 39126268 BCFMTGYNWGKRRS-UHFFFAOYSA-N 184.155 -1.474 50 10 AAGE O=C1OC(=O)C(CO)=C1CO 100210943 ZZYCDYRTIFFTPI-UHFFFAOYSA-N 158.109 -1.649 50 10 AAGE NNC(=O)Nc1ccc(=O)[nH]n1 161129951 JAIAYXFYFMJUFQ-UHFFFAOYSA-N 169.144 -1.235 50 10 AAGE OB(O)c1cnn(-c2cccnc2)c1 203615389 RGGGBFSYRLGFAF-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE NNC(=O)[C@H]1CCO1 211605970 UBJJILATVVVQLJ-GSVOUGTGSA-N 116.120 -1.235 50 10 AAGE C=CC(=O)[C@@H](C#N)C(=O)NN 220149782 DNWQFOAJNTVXBZ-SCSAIBSYSA-N 153.141 -1.129 50 10 AAGE NNC(=O)CNNCC(=O)NN 224747390 QIRBTBRGYQZKFG-UHFFFAOYSA-N 176.180 -3.940 50 10 AAGE CN1CC[C@@H](COCC(=O)NN)C1 259081282 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CS(=O)(=O)[C@H]1C[C@H](C(=O)NN)C1 2241663931 KTACNMYCVGEWKU-URHBZAFASA-N 192.240 -1.201 50 10 AAGE O=C(C#CB(O)O)NCC[C@@H]1CCO1 2242543980 CTHRQIMMSBMXJZ-SSDOTTSWSA-N 196.999 -1.703 50 10 AAGE C[C@@H](C(=O)NN)N1CCNCC1 82469763 VJJKNHRDMBRKFS-LURJTMIESA-N 172.232 -1.730 50 10 AAGE Nc1ccc(B(O)O)nn1 196237866 VLBFBJABSMEOJD-UHFFFAOYSA-N 138.923 -2.261 50 10 AAGE NC(=O)c1ccc(O)c(B(O)O)c1 204046105 RNQDVUIQDMWFLT-UHFFFAOYSA-N 180.956 -1.829 50 10 AAGE Nc1c(B(O)O)ccnc1Cl 206071219 DYNSGHVXPIKPFG-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE CC1=C=S=C(/C=N/NC(=O)CO)N1 642853743 BNPFFZIPUJUMOA-KRXBUXKQSA-N 199.235 -1.148 50 10 AAGE CN(CC(=O)NN)C[C@]12COC[C@H]1C2 689277110 FYWVIFHUEGRGMP-VXNVDRBHSA-N 199.254 -1.055 50 10 AAGE NNC(=O)CN1C[C@H]2[C@H](O)C[C@H]2C1 1878213484 QSDSDAZZVWCISO-RRKCRQDMSA-N 185.227 -1.711 50 10 AAGE CN(C)NC(=O)[C@@H]1NC[C@H](O)[C@@H]1O 1883968001 VNDUIUNWIJFVAW-JKUQZMGJSA-N 189.215 -2.727 50 10 AAGE NNC(=O)[C@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)O 1914776372 SXIMZYIVKBIHNQ-ZXXMMSQZSA-N 198.178 -1.370 50 10 AAGE NC[C@]1(C(=O)NN)CCCO1 1923250216 AJWQPXHBQSJGBO-LURJTMIESA-N 159.189 -1.516 50 10 AAGE CCN(C)CCn1cc(B(O)O)cn1 1929605847 YRNYCCFQYRFAEK-UHFFFAOYSA-N 197.047 -1.485 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@@H]2C[C@@H]2C1 1932784148 MIMGFWFCZOTQGO-FMCRUOTFSA-N 183.211 -1.109 50 10 AAGE O=C(C#CB(O)O)NC[C@H]1CCO1 2241468364 MOZXGOOUFUQRBA-ZCFIWIBFSA-N 182.972 -2.093 50 10 AAGE CONC(=O)c1cocc1B(O)O 2241750489 AQIURJWQWMYZCS-UHFFFAOYSA-N 184.944 -1.749 50 10 AAGE NNC(=O)N[C@@H]1C=CS(=O)(=O)C1 40168028 DRLIMPVJADAGEU-SCSAIBSYSA-N 191.212 -1.530 50 10 AAGE NNC(=O)N1CCC(N)CC1 146174093 SJAYNEBEYULWIC-UHFFFAOYSA-N 158.205 -1.007 50 10 AAGE NNC(=O)c1ccncc1C(=O)NN 200763046 CQMYXNWQXCYOQW-UHFFFAOYSA-N 195.182 -1.711 50 10 AAGE N#CCC(=O)NN[C@H]1CC(=O)NC1=O 238628445 YCNDTLPSEINURD-BYPYZUCNSA-N 196.166 -2.064 50 10 AAGE OB(O)c1cncc(-n2cnnn2)c1 238657613 BUORTRACJHVDFU-UHFFFAOYSA-N 190.959 -2.263 50 10 AAGE OB(O)c1nc2c(s1)CCOC2 238658400 LOHUFYMPQFZUNS-UHFFFAOYSA-N 185.013 -1.104 50 10 AAGE OB(O)c1ccc([C@@H]2CCNC2)nc1 306398696 JQOFYVYCFFWBBG-SSDOTTSWSA-N 192.027 -1.162 50 10 AAGE N#C/C(N)=C(C#N)/N=C/[C@H](O)CO 306408102 HIYZPVFQXAFLGY-DUBNGHKCSA-N 180.167 -1.372 50 10 AAGE OB(O)c1nc(O)ccc1F 307271023 BGXWDDOMKUAMBM-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE O=C(NCB(O)O)c1cncc(O)c1 702017770 PBLSJQFGXWBWSS-UHFFFAOYSA-N 195.971 -1.471 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@H]2C1=O 715701795 MMXXDTMWYOHRES-RFZPGFLSSA-N 169.184 -1.545 50 10 AAGE C[C@H]1[C@H](O)CN1C(=O)C(=O)NN 1880908103 VIQTUFBMBGWWMC-IUYQGCFVSA-N 173.172 -2.432 50 10 AAGE C[C@H](C(=O)NN)N(C)[C@H]1C[C@H](O)C1 1882176918 LEQLHPWNURBZEA-FSDSQADBSA-N 187.243 -1.180 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2COC[C@H]21 1882699112 RGCHARAPLCAFDS-FSDSQADBSA-N 185.227 -1.305 50 10 AAGE CN(C[C@@H]1CCO1)C(=O)C(=O)NN 1889749836 HJIHTZPJCNAYJF-YFKPBYRVSA-N 187.199 -1.776 50 10 AAGE CCN(OC)C(=O)C(=O)NN 1928668822 VRPPURUOXCGNLK-UHFFFAOYSA-N 161.161 -1.614 50 10 AAGE N#CCNC(=O)C(=O)NN 1953176684 CGNAGBKNBVFWKJ-UHFFFAOYSA-N 142.118 -2.384 50 10 AAGE O=C(C#CB(O)O)N[C@H]1[C@H]2OCC[C@@H]21 2241479060 QQVRGVUXMZUHMD-NJUXHZRNSA-N 194.983 -2.095 50 10 AAGE C[C@@H](CO)N(C)CCC(=O)NN 123715154 SPCZDIKKVXWDDY-LURJTMIESA-N 175.232 -1.321 50 10 AAGE C[C@@]1(O)CCN(C(=O)C(=O)NN)C1 235410484 DZBSXCIVOFZOFW-SSDOTTSWSA-N 187.199 -2.040 50 10 AAGE N[C@H](CO)C(=O)OC(=O)[C@H](N)CO 238687442 YXYFUYYLTGYWTL-QWWZWVQMSA-N 192.171 -3.305 50 10 AAGE CC[S@](C)(=O)=NC(=O)C(=O)NN 307336291 HHAKPLJAJZYNEL-LBPRGKRZSA-N 193.228 -1.379 50 10 AAGE N#C/C=C/[C@H](O)[C@H](O)[C@@H](O)CO 393328865 YCBYRDXNEGJSQS-GNLOUJNQSA-N 173.168 -1.859 50 10 AAGE CCOCCCn1ccc(B(O)O)n1 694271179 PUZIUJVDPQWVDB-UHFFFAOYSA-N 198.031 -1.011 50 10 AAGE CC(=O)NNC(=O)C1(C(N)=O)CCC1 1290392047 QNYMFSNDTGNMDV-UHFFFAOYSA-N 199.210 -1.191 50 10 AAGE CC[C@@H](O)C(=O)NCC=CB(O)O 1888707542 JDDJRCLVSJHVJS-ZCFIWIBFSA-N 187.004 -1.558 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@H]2[C@H]1CO 1896395155 JHTGQTIKKUEPFZ-XLPZGREQSA-N 199.254 -1.321 50 10 AAGE NNC(=O)[C@@H]1OCC[C@@H]1C(=O)O 1953471941 WATIAXZLXJGAFF-IUYQGCFVSA-N 174.156 -1.534 50 10 AAGE NOCCNc1cc(B(O)O)ccn1 2210059919 DVYUBRZFIPXBIS-UHFFFAOYSA-N 197.003 -1.936 50 10 AAGE C[C@H](CO)Nc1ncccc1B(O)O 2210060980 OXLQNKXBPQWEIA-ZCFIWIBFSA-N 196.015 -1.446 50 10 AAGE NC1CN(c2cc(B(O)O)ccn2)C1 2210067980 JNVRUTYQSSBFMD-UHFFFAOYSA-N 193.015 -2.091 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CC[C@@H]2C[C@H]21 2241467884 COOLDGNXDRUXLN-BWZBUEFSSA-N 193.011 -1.084 50 10 AAGE N#CNC(=O)c1coc(B(O)O)c1 2241471286 IASCENPKLCXBII-UHFFFAOYSA-N 179.928 -1.830 50 10 AAGE NNC(=O)c1c[nH]c(=O)[nH]c1=O 1669622 DNTNUMKNOCHZEQ-UHFFFAOYSA-N 170.128 -2.333 50 10 AAGE C[C@H](NC(N)=O)C(=O)NN 37387902 FQVPGPALWFJMMG-REOHCLBHSA-N 146.150 -1.967 50 10 AAGE NNC(=O)NCCNC(=O)C1CC1 135158271 WPGWTQHGCMTFPA-UHFFFAOYSA-N 186.215 -1.315 50 10 AAGE COc1cc(B(O)O)cc([N+](=O)[O-])n1 206086224 YRPFUYXEPLOXCZ-UHFFFAOYSA-N 197.943 -1.322 50 10 AAGE O=Cc1cc(B(O)O)cc([N+](=O)[O-])n1 206086252 KUZCSDVDOLVACQ-UHFFFAOYSA-N 195.927 -1.518 50 10 AAGE C[C@@H](C(=O)NN)[C@H](O)C(=O)NN 238422097 VWUUBBVNWAWOJK-GBXIJSLDSA-N 176.176 -3.037 50 10 AAGE N[C@]12C[C@H](C(=O)O)C[C@@H]1C(=O)OC2=O 238600551 UINIVQDXAXSOQB-TTWOZLTLSA-N 199.162 -1.122 50 10 AAGE OB(O)[C@@H]1CNCCO1 238609104 QWBTXAJUCOPYBQ-BYPYZUCNSA-N 130.940 -2.013 50 10 AAGE N#CC1=CC(C(N)=O)=NS1(=O)=O 260010432 DHMVFGSFJMBHIM-UHFFFAOYSA-N 185.164 -1.336 50 10 AAGE Cn1nncc1/C=C/B(O)O 300742334 BCYXBUWLKRXYNA-NSCUHMNNSA-N 152.950 -1.160 50 10 AAGE CNC(=O)C(=O)NNC(=O)CCO 308506883 ZQPBNSHOZQEPJI-UHFFFAOYSA-N 189.171 -2.738 50 10 AAGE OB(O)c1ccn([C@H]2CCCOC2)n1 575461711 ATIAUFHMXBDWPD-ZETCQYMHSA-N 196.015 -1.086 50 10 AAGE COCCOc1ncccc1B(O)O 714029357 RDJMINHGVKPJSH-UHFFFAOYSA-N 196.999 -1.213 50 10 AAGE O=C(NNCCO)c1cnco1 1929852975 NELRKTYMOYJPSG-UHFFFAOYSA-N 171.156 -1.099 50 10 AAGE Cn1nncc1[C@H](N)[C@H](O)C#N 1953065869 DDCZUPTWMOFZQT-RITPCOANSA-N 167.172 -1.301 50 10 AAGE NCCNc1ncccc1B(O)O 2209385832 BKJANJZOZXRTBJ-UHFFFAOYSA-N 181.004 -1.868 50 10 AAGE C[C@H](C(=O)NN)N1CC=C[C@]1(C)CO 2209890916 QXEGDTSHYNUVSE-VXNVDRBHSA-N 199.254 -1.012 50 10 AAGE NCCNC(=O)C1(B(O)O)CCC1 2241472790 XUFDQDDLOWPFCS-UHFFFAOYSA-N 186.020 -1.542 50 10 AAGE O=C(N=c1cc[nH][nH]1)[C@H]1C[C@@H]1B(O)O 2241495854 NQPMTJRFSAYRJF-WHFBIAKZSA-N 194.987 -1.367 50 10 AAGE N#CNC(=O)[C@@H]1C[C@@H]1B(O)O 2241497077 ZSGNZLGYRKIQIW-DMTCNVIQSA-N 153.934 -1.553 50 10 AAGE CN(C)c1cccc(B(O)O)n1 169968739 ZDKXOTJOOAFCFY-UHFFFAOYSA-N 165.989 -1.173 50 10 AAGE Cc1cnc(CN)c(B(O)O)c1 238519614 DTIBPQGBQSTWPR-UHFFFAOYSA-N 165.989 -1.471 50 10 AAGE OC[C@H](O)Cn1cc(B(O)O)cn1 238709733 KCXQTZHRPTTXKR-ZCFIWIBFSA-N 185.976 -3.084 50 10 AAGE O=C1CN[C@H]2C(=O)OC(=O)[C@H]2N1 306553894 BUKFNJDLQOBOSU-DMTCNVIQSA-N 170.124 -2.474 50 10 AAGE NNC(=O)N[C@@H]1CCCCNC1=O 306757879 TUUKZTUCFCDUKL-RXMQYKEDSA-N 186.215 -1.172 50 10 AAGE OB(O)c1cncc([C@@H]2CCNC2)c1 307118632 QVSWJOZUQRAXDI-SSDOTTSWSA-N 192.027 -1.162 50 10 AAGE O=C(CCO)NN=C1COC1 307281823 HQLZKFKZMJKZII-UHFFFAOYSA-N 158.157 -1.129 50 10 AAGE NNC(=O)C(=O)N1CC2(COC2)C1 606259138 QVBSPDSMSPMVQA-UHFFFAOYSA-N 185.183 -2.165 50 10 AAGE C[C@@H](O)CN(C)NC(=O)CC(N)=O 1332174454 DETJMAAPWSHDNI-RXMQYKEDSA-N 189.215 -1.794 50 10 AAGE OB(O)c1ccn(C[C@H]2CCO2)n1 1888422993 QILHZPNTICHLDL-ZCFIWIBFSA-N 181.988 -1.648 50 10 AAGE COC[C@@H](C)NCB(O)O 1923403080 PEZOUZJNVZMKDM-RXMQYKEDSA-N 146.983 -1.377 50 10 AAGE NNC(=O)[C@H]1C[C@H]1CN1CCC1=O 1928994034 KWTJMDUDACXKJR-WDSKDSINSA-N 183.211 -1.155 50 10 AAGE NNC(=O)NC[C@H]1COCCCO1 1933311499 RFWPGIUDDWBYQS-LURJTMIESA-N 189.215 -1.035 50 10 AAGE CS(=O)(=O)CC[C@@H](O)[C@@H](O)C#N 1951367735 ORKSJRLFXYGVHE-RITPCOANSA-N 193.224 -1.334 50 10 AAGE CN(C)NC(=O)[C@@H]1NCCNC1=O 1953981472 QADWCWQLUHYSSC-RXMQYKEDSA-N 186.215 -2.333 50 10 AAGE NC(=S)NNC(=O)CC(=O)O 1950532 YWOVQAZGEWUOIX-UHFFFAOYSA-N 177.185 -1.675 50 10 AAGE CNC(=O)COCC(=O)NN 58851254 QSAVVGQPNOVXQF-UHFFFAOYSA-N 161.161 -2.261 50 10 AAGE COC(=O)/C(C#N)=C(/NN)C(=O)O 75576791 KRVYGSNFAXXNCQ-ONEGZZNKSA-N 185.139 -1.515 50 10 AAGE N[C@H]1CC(=O)N[C@@H](Cl)N1 225354131 GJBRQZGSKYESRB-FONMRSAGSA-N 149.581 -1.097 50 10 AAGE OB(O)c1ccc2nccnc2n1 238649242 CCVROPVXHJIUOT-UHFFFAOYSA-N 174.956 -1.295 50 10 AAGE CNC(=O)NC(C)(C)C(=O)NN 306624102 FKIRWQSDQKNNNE-UHFFFAOYSA-N 174.204 -1.316 50 10 AAGE C[C@H](CCB(O)O)CB(O)O 307875616 MMRNWWXAUXZWKK-RXMQYKEDSA-N 159.787 -1.042 50 10 AAGE CC(C)(O)C(=O)NNC(=O)CCO 379412625 KMPVAAHRGGNKRA-UHFFFAOYSA-N 190.199 -1.713 50 10 AAGE N#C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO 388066094 GQXJZINGMGHWDU-SLPGGIOYSA-N 177.156 -3.054 50 10 AAGE OB(O)c1ccccc1C1NNNN1 585664086 KXJRIVOBDKVYHV-UHFFFAOYSA-N 194.003 -2.518 50 10 AAGE NNC(=O)N1CC(n2cncn2)C1 606256104 ONCLEKHGBDJYPN-UHFFFAOYSA-N 182.187 -1.282 50 10 AAGE COCCCn1ccc(B(O)O)n1 694274788 DFPHYDBXROGOGB-UHFFFAOYSA-N 184.004 -1.401 50 10 AAGE CN(C1=C(C#N)C#CNN1)C1CNC1 885542836 BLWKVPJCRAJADH-UHFFFAOYSA-N 189.222 -1.306 50 10 AAGE CNC(=O)OC(=O)[C@@H](N)CO 1615167253 XAJPKGZNCQXMPA-VKHMYHEASA-N 162.145 -1.811 50 10 AAGE O=C(NCB(O)O)[C@H]1O[C@H]2CC[C@H]1C2 1893712917 ZCEHTMYZNVXMJW-ACZMJKKPSA-N 199.015 -1.318 50 10 AAGE COCc1c(B(O)O)nnn1C 1926225647 HKCGTGKHFYIPLH-UHFFFAOYSA-N 170.965 -2.359 50 10 AAGE C[C@H]1CCN(C(=O)NN)[C@H]1C(N)=O 1928670810 CXTUJJMNPGIOAT-CRCLSJGQSA-N 186.215 -1.235 50 10 AAGE CN(N)C(=O)CCn1cnnn1 1928829029 QQIQLZLXTDNXPS-UHFFFAOYSA-N 170.176 -1.605 50 10 AAGE NNC(=O)C[C@H]1CNC[C@H]1O 1953343096 XXHDCJVKDMLHKW-CRCLSJGQSA-N 159.189 -2.053 50 10 AAGE N[C@H](B(O)O)[C@H]1CC1(F)F 2208931999 REBZXIVDXPABCA-GBXIJSLDSA-N 150.921 -1.019 50 10 AAGE CCc1cnnc(B(O)O)c1 2242125886 VGPFTOVAHKLQBO-UHFFFAOYSA-N 151.962 -1.281 50 10 AAGE CCNNC(=O)C(=O)NNCC 2008694 VMVNTBWTFQFSGG-UHFFFAOYSA-N 174.204 -1.732 50 10 AAGE C[C@](O)(C#N)C(N)=O 104654649 HVJKFEFFRBWBJV-BYPYZUCNSA-N 114.104 -1.254 50 10 AAGE [C-]#[N+][C@]1(O)C=C[C@](O)([C@@H](C)O)[C@@H]1O 238442190 YDESHCUKJUUXAP-KVPKETBZSA-N 185.179 -1.363 50 10 AAGE CN(N)C(=O)[C@H]1CCC(=O)N1 575558840 URIIPPBCDYRRBI-SCSAIBSYSA-N 157.173 -1.403 50 10 AAGE C[C@H](C(N)=O)N(C)[C@H](C)C(=O)NN 711133943 AVBFEGNMFIEWMI-RFZPGFLSSA-N 188.231 -1.830 50 10 AAGE NNC(=O)N1CCS[C@H](CO)C1 720071320 WPNCWFCPXWMMEY-YFKPBYRVSA-N 191.256 -1.021 50 10 AAGE NNC(=O)[C@]12CC[C@H]1CNC2 1353591510 OFPPCLYGIFUWML-FSPLSTOPSA-N 155.201 -1.024 50 10 AAGE C=C=CCC(=O)NCB(O)O 1880249046 PPTQHPAURKKAPB-UHFFFAOYSA-N 154.962 -1.154 50 10 AAGE N#C[C@H](O)[C@H](N)[C@H](O)CO 1952888441 SZGJJTTWESSGOD-LMVFSUKVSA-N 146.146 -2.449 50 10 AAGE NC(=O)NNC(=O)c1ncc[nH]c1=O 1956427839 MSROPUKOCBBAPZ-UHFFFAOYSA-N 197.154 -1.917 50 10 AAGE CN=c1[nH]ccc(B(O)O)c1F 2209094477 SRAULKRRMRQETB-UHFFFAOYSA-N 169.952 -1.636 50 10 AAGE Cc1cccc(B(O)O)c1C(=O)NO 2241584900 VEDBLKRGNHTAOL-UHFFFAOYSA-N 194.983 -1.206 50 10 AAGE CN(C)C(=O)CCC(=O)NN 58839136 KSGRAJFYGUFNQU-UHFFFAOYSA-N 159.189 -1.155 50 10 AAGE C[C@@H]1CNC[C@@H](C)N1CC(=O)NN 77002863 ICGLBBPGXAHKSX-RNFRBKRXSA-N 186.259 -1.342 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2CC[C@H](C1)O2 85542475 NHQDCXZKGZSJEY-OLQVQODUSA-N 199.210 -1.634 50 10 AAGE CC1CC(=O)N(CC(=O)NN)C(=O)C1 86456651 NXBHMQGSKLWYOR-UHFFFAOYSA-N 199.210 -1.239 50 10 AAGE NNC(=O)[C@@H]1CSCCN1 116320513 KKXFIMLDHBXEIN-BYPYZUCNSA-N 161.230 -1.319 50 10 AAGE OC/C=C/B(O)O 195915915 VKTVCKMJDVZYSO-OWOJBTEDSA-N 101.898 -1.453 50 10 AAGE O=Cc1ccc(B(O)O)c(O)n1 238621982 ANGVLVNKGOHZMD-UHFFFAOYSA-N 166.929 -1.721 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1Cl 306313007 UDOJFSFHKNQOHC-ZSNZIGRDSA-N 198.602 -1.975 50 10 AAGE [C-]#[N+][C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1O 306387864 UJALVCFSKOLTHI-IBISWUOJSA-N 189.167 -2.294 50 10 AAGE C[C@H](CO)NC(=O)NNC(N)=O 306864704 KYVIRYXIFNNGLE-GSVOUGTGSA-N 176.176 -1.750 50 10 AAGE O=C[C@H](O)[C@H](O)[C@H](Cl)[C@@H](O)CO 701708441 KWXIWFADURXYFY-AZGQCCRYSA-N 198.602 -2.132 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@@H]2[C@@H]1CO 1877582642 JAVIRFTZKSAMOT-ACZMJKKPSA-N 185.227 -1.711 50 10 AAGE C=C(CN1C[C@H]2C[C@H]1CN2C)B(O)O 1895213388 ZLPQOBDBXAPSSV-BDAKNGLRSA-N 196.059 -1.057 50 10 AAGE N#C[C@]1(O)CCOC[C@H]1N 1929561844 QNOGZYJSXWKCOD-PHDIDXHHSA-N 142.158 -1.011 50 10 AAGE NNC(=O)CN1Cc2conc2C1 1954473111 NYKTYPJMKOYZKW-UHFFFAOYSA-N 182.183 -1.020 50 10 AAGE NNC(=O)[C@H](N)[C@H](O)C(F)(F)F 2241349094 FXOYSHAEKIVQPM-NCGGTJAESA-N 187.121 -1.773 50 10 AAGE NNC(=O)c1c[nH]c(=O)nc1N 1604993 CJDOAUOHTNDZLM-UHFFFAOYSA-N 169.144 -2.044 50 10 AAGE NN/C(=N\CC(=O)O)NNC(N)=O 28246058 CDCXFRFBOIIECV-UHFFFAOYSA-N 190.163 -2.937 50 10 AAGE CC[C@@H](C(=O)NN)N(C)CCNC 78577915 UQEOJBQMSNJBLO-ZETCQYMHSA-N 188.275 -1.094 50 10 AAGE C[C@H]1CCN(CC(=O)NN)[C@@H]1CO 227214532 OAKIORFSJXAQBB-NKWVEPMBSA-N 187.243 -1.321 50 10 AAGE CC(=O)C(=O)NNC(N)=S 238045033 SKEWBGJBHJTNSD-UHFFFAOYSA-N 161.186 -1.560 50 10 AAGE CC(=O)NNC(=O)NC[C@@H](C)O 306545418 FUEYLBFJHRROFS-SCSAIBSYSA-N 175.188 -1.283 50 10 AAGE O=C(CO)NNC(=O)NCCO 308070182 BGUJCZIERDGTDS-UHFFFAOYSA-N 177.160 -2.699 50 10 AAGE NC(=O)C(N=C=S)C(N)=O 575453939 SDECYWURDCDFBS-UHFFFAOYSA-N 159.170 -1.572 50 10 AAGE CO[C@@]1(C(=O)NN)CCNC1 575549653 LILHAEWFBDICPW-LURJTMIESA-N 159.189 -1.645 50 10 AAGE NNC(=O)C1(O)CCNCC1 1880296968 YPSMTDQHCNBFBU-UHFFFAOYSA-N 159.189 -1.909 50 10 AAGE CO[C@H]1C[C@@H]1Cn1cc(B(O)O)cn1 1887362412 YIGUTVRYDFXMMB-SVRRBLITSA-N 196.015 -1.402 50 10 AAGE CC[C@@H](O)C(=O)NCB(O)O 1888693792 NMBSSMQGQMWZBJ-SCSAIBSYSA-N 160.966 -2.115 50 10 AAGE NNC(=O)CCN1C[C@@H]2C(CO)[C@H]2C1 1929055354 SZBUEYRJJZPIAC-BQBZGAKWSA-N 199.254 -1.464 50 10 AAGE CN(CCO)CC1(C(=O)NN)CC1 1931265729 UOJXHXGTZQNESP-UHFFFAOYSA-N 187.243 -1.319 50 10 AAGE O=C(C#CB(O)O)NC1[C@@H]2CC[C@@H]12 2241478236 AWJRJWFTRDWEDV-PHDIDXHHSA-N 178.984 -1.474 50 10 AAGE CONC(=O)c1cc(B(O)O)n[nH]1 2241479538 ZZUSMFCHMUTGSO-UHFFFAOYSA-N 184.948 -2.619 50 10 AAGE O=C(NC[C@@H]1CCN1)C1(B(O)O)CC1 2241481586 UEAVLMNJDNYPRU-LURJTMIESA-N 198.031 -1.529 50 10 AAGE NNC(=O)c1n[nH]nc1C(=O)NN 5541504 YFGFXLNOZXMDSD-UHFFFAOYSA-N 185.147 -2.988 50 10 AAGE O[C@@H]1[C@H](O)O[C@H](CCl)[C@H](O)[C@H]1O 29309364 QMWDIHPSUCUMFU-FDROIEKHSA-N 198.602 -1.975 50 10 AAGE C#CCOCC(=O)NN 196483499 IXRQIVBUZACPRO-UHFFFAOYSA-N 128.131 -1.374 50 10 AAGE OB(O)c1cnc(-n2ccnc2)cn1 198083566 WJFVDBKSHBLIHT-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE C[S@](=O)CCNC(=O)NN 229268405 KUJYJPGXKLDEOV-JTQLQIEISA-N 165.218 -1.462 50 10 AAGE NCC[S@](=O)S(=O)(=O)O 238565739 JMQRKHAJDRRVSC-MRVPVSSYSA-N 173.215 -1.503 50 10 AAGE N=C(N)SCB(O)O 306684705 INSCMFPOCXEGFT-UHFFFAOYSA-N 133.969 -1.375 50 10 AAGE O=C(NN[C@@H]1CNC[C@H]1O)C1CC1 306695723 VILAIRSPLLDMPG-RNFRBKRXSA-N 185.227 -1.650 50 10 AAGE COC(=O)NCCNC(=O)NN 308381229 UUCBZRJVODTMAF-UHFFFAOYSA-N 176.176 -1.485 50 10 AAGE NNC(=O)CN1CC[C@H]2COC[C@H]2C1 690715880 ZMLZDDBJWHKIKE-JGVFFNPUSA-N 199.254 -1.055 50 10 AAGE CNC(=O)NNC(=O)c1ncc[nH]1 1597340539 HTVXSFVROMCYAG-UHFFFAOYSA-N 183.171 -1.017 50 10 AAGE NNC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1CO 1877582527 HKJULZFSKFSUQO-ZLUOBGJFSA-N 171.200 -1.118 50 10 AAGE NCC[C@H](F)C(=O)NN 1953140350 ZOYBKJHXZHZLEX-VKHMYHEASA-N 135.142 -1.337 50 10 AAGE CO[C@@H](C)[C@@H](N)CC(=O)NN 1953299963 JFZHCUFDWJCWIM-WHFBIAKZSA-N 161.205 -1.271 50 10 AAGE CN(C(=O)C#CB(O)O)[C@H]1C[C@@H](O)C1 2241468579 QSTCGTDGOSOBRP-KNVOCYPGSA-N 196.999 -2.017 50 10 AAGE O=C(NCC1(O)CC1)C1(B(O)O)CC1 2241481621 UPRSIPDEIKXMMM-UHFFFAOYSA-N 199.015 -1.366 50 10 AAGE CCNC(=O)c1cocc1B(O)O 2241752881 XSYVFLNWLJWQOH-UHFFFAOYSA-N 182.972 -1.291 50 10 AAGE NNC(=O)NC[C@@H]1CCC(=O)N1 70681460 GUHCNAKRTKKNTF-BYPYZUCNSA-N 172.188 -1.562 50 10 AAGE COC(=O)N(N)CCO 139074293 KPDMSVSTIVFLOG-UHFFFAOYSA-N 134.135 -1.079 50 10 AAGE COCCNC(=O)CNC(=O)NN 161530634 XLCLRMTUYAONIT-UHFFFAOYSA-N 190.203 -2.078 50 10 AAGE NCc1cn(CC(=O)NN)nn1 169070222 NERBAGUQZUMZCN-UHFFFAOYSA-N 170.176 -2.273 50 10 AAGE OB(O)CCCB(O)O 197481273 ZWAPPKQZVVWKRB-UHFFFAOYSA-N 131.733 -1.678 50 10 AAGE CN(C=O)Cc1ccc(B(O)O)cc1 208613317 JCQCAGCMYCWKMB-UHFFFAOYSA-N 193.011 -1.045 50 10 AAGE NC(=O)NNC(=S)C(N)=O 238590192 FXFMHVYVVHMBON-UHFFFAOYSA-N 162.174 -2.028 50 10 AAGE CN1CC[C@H]([C@H](N)C(=O)N(C)N)C1 259015396 ICHMJGPKRKKROG-BQBZGAKWSA-N 186.259 -1.403 50 10 AAGE N#C[C@@H]1C(=O)N[C@H](N)N[C@H]1Cl 306371127 IXYQRNOIJKOMGK-GDGKWOGESA-N 174.591 -1.347 50 10 AAGE CC(C)(F)C(=O)NNC(=O)CO 306383787 QLMRXNMNEUHBGJ-UHFFFAOYSA-N 178.163 -1.126 50 10 AAGE NC(=O)NN=C(CC(=O)O)C(=O)O 308018805 NJHFHDDCZGTLMC-UHFFFAOYSA-N 189.127 -1.430 50 10 AAGE CN(CCC(N)=O)CC(=O)NN 382056898 AUBZXEFGXLFGCU-UHFFFAOYSA-N 174.204 -2.217 50 10 AAGE COC(=O)NNC(=O)NC[C@H](C)O 393547280 IZBYNEOEDSGNEU-BYPYZUCNSA-N 191.187 -1.063 50 10 AAGE COCCN(CCF)CC(=O)NN 697057247 XYZNBBKRZBALEH-UHFFFAOYSA-N 193.222 -1.106 50 10 AAGE CN(C(=O)NN)C1CC(C(N)=O)C1 703506660 XQMWPHMZKSPIPY-UHFFFAOYSA-N 186.215 -1.235 50 10 AAGE N#CC1=C(O[C@@H]2CNOC2)NNC#C1 885589563 MPWKOMKCYAMANE-SSDOTTSWSA-N 192.178 -1.290 50 10 AAGE CN1C[C@H]2CC[C@H]1CN2CC(=O)NN 1886887248 SCIAVQUKOMDQQE-JGVFFNPUSA-N 198.270 -1.245 50 10 AAGE CNC(=O)CC(=O)NCB(O)O 1923855308 LGPXHFQVQUICGF-UHFFFAOYSA-N 173.965 -2.749 50 10 AAGE C[C@@H](N)COc1ccc(B(O)O)cn1 2210065653 PRHXWWPQRLNZOS-ZCFIWIBFSA-N 196.015 -1.513 50 10 AAGE O=C(C#CB(O)O)N1C[C@H]2C[C@H]2C1=O 2241478838 MAHRCQFEBSTEDX-PHDIDXHHSA-N 192.967 -1.993 50 10 AAGE O=C(C#CB(O)O)NC[C@H]1CCNC1 2241479525 ZQQJPLLEYZHNDL-ZETCQYMHSA-N 196.015 -2.273 50 10 AAGE C=CC(=O)Nc1cc(B(O)O)ccn1 2241554757 GJXTYTDKXJMICA-UHFFFAOYSA-N 191.983 -1.114 50 10 AAGE CCS(=O)(=O)N[C@H](C)C(=O)NN 34204391 KEJZGYYEXRYCIY-SCSAIBSYSA-N 195.244 -1.696 50 10 AAGE NNC(=O)c1nnc2cccnn12 75848688 JIPRJEXMTDVHEX-UHFFFAOYSA-N 178.155 -1.272 50 10 AAGE CNCC(=O)NN(C)C 143823805 YJYVXTBKJKUTNE-UHFFFAOYSA-N 131.179 -1.201 50 10 AAGE CN(C)NC(=O)c1nnn[nH]1 149806233 CRBAWTVVTPDWEY-UHFFFAOYSA-N 156.149 -1.594 50 10 AAGE NCCNCc1ccccc1B(O)O 201360765 OOJWBGHKIBUUCA-UHFFFAOYSA-N 194.043 -1.585 50 10 AAGE Nc1cc(B(O)O)cnc1C(=O)O 206076254 AFDFHSHAJVFTNX-UHFFFAOYSA-N 181.944 -1.958 50 10 AAGE COc1ccc(B(O)O)c(O)n1 238429967 CIJHOZGIEHZAGJ-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE O=CNNC(=O)[C@@H]1CCCO1 307296492 QVPGSPNLPMHWMY-YFKPBYRVSA-N 158.157 -1.057 50 10 AAGE NNC(=O)NCC(=O)NCC(F)F 393710275 HQQPMSXVOWUCCB-UHFFFAOYSA-N 196.157 -1.459 50 10 AAGE CC(=O)NNC(=O)C[S@](C)=O 526870127 ADXUQLPIMZJSTI-NSHDSACASA-N 178.213 -1.468 50 10 AAGE O=C(NCB(O)O)N1C[C@H]2C[C@@H]2C1 885449168 KIFGMHLPDNYAOR-PHDIDXHHSA-N 184.004 -1.340 50 10 AAGE Cn1nc(B(O)O)cc1F 1880050836 IIWXSBPCMJSOIJ-UHFFFAOYSA-N 143.914 -1.761 50 10 AAGE C[C@H](O)[C@@H]1CCCN1CC(=O)NN 1883278839 OGDWUHHVACHPOP-BQBZGAKWSA-N 187.243 -1.179 50 10 AAGE CCN(C)C(=O)NCC#CB(O)O 1883738653 KIYBLZYWZGUCMV-UHFFFAOYSA-N 184.004 -1.337 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@@H](C1)C2 1883764686 ORFBVKXAMRNJHB-OLQVQODUSA-N 183.211 -1.155 50 10 AAGE OB(O)[C@H]1CCN(Cc2nn[nH]n2)C1 1891560473 SKAVMJWQELGJKY-YFKPBYRVSA-N 197.007 -1.752 50 10 AAGE O=C(NCC#CB(O)O)C1[C@@H]2CC[C@@H]12 1895048676 CFQIPNNGDVHHTC-RNFRBKRXSA-N 193.011 -1.226 50 10 AAGE NNC(=O)NC[C@@H]1COCCCO1 1933311500 RFWPGIUDDWBYQS-ZCFIWIBFSA-N 189.215 -1.035 50 10 AAGE CONC(=O)c1ccc(B(O)O)o1 2241468159 IKLJJKGRSICIPV-UHFFFAOYSA-N 184.944 -1.749 50 10 AAGE O=C(C#CB(O)O)N1CC[C@@H](CO)C1 2241478306 BWAPEUXVZUOMMH-SSDOTTSWSA-N 196.999 -2.157 50 10 AAGE O=C(C#CB(O)O)NC1[C@@H]2COC[C@@H]12 2241478482 GETVHUZLGZAKLV-PHDIDXHHSA-N 194.983 -2.237 50 10 AAGE OB(O)c1nncn1C1CCC1 2297005901 GDHBWRDCCALTOX-UHFFFAOYSA-N 166.977 -1.317 50 10 AAGE CC(=O)N[C@H](C#N)C(=O)NN 1667242 UWUZBFUNEVIYRZ-SCSAIBSYSA-N 156.145 -1.995 50 10 AAGE O=C1OCc2ncc(B(O)O)cc21 238655252 WQXZXLYMYIPEJO-UHFFFAOYSA-N 178.940 -1.568 50 10 AAGE N#C[C@H](O)Cn1cnnn1 260409170 BZXMTPHRNDMACD-BYPYZUCNSA-N 139.118 -1.442 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@H](O)C[C@H]1C2 710474326 DMQYWMSPZDDJLC-PRJMDXOYSA-N 199.254 -1.179 50 10 AAGE O=C(CCOC1CC1)NCB(O)O 716964429 OCZXYCWATIXQQC-UHFFFAOYSA-N 187.004 -1.316 50 10 AAGE O=C(NNCCO)c1cocn1 1929851524 XAODDBWZKHETPY-UHFFFAOYSA-N 171.156 -1.099 50 10 AAGE C[C@@H]1[C@H](NC(=O)C(=O)NN)C1(F)F 1933128710 YTNRORVSVLYPBT-GBXIJSLDSA-N 193.153 -1.254 50 10 AAGE CS(=O)(=O)C[C@@H](O)C#N 1951361311 QPMHJUFBQSEQOQ-BYPYZUCNSA-N 149.171 -1.085 50 10 AAGE NNC(=O)c1cc(C(=O)O)on1 1953471945 WERWDEAOGDYWHE-UHFFFAOYSA-N 171.112 -1.024 50 10 AAGE CO[C@H]1C[C@H](NC(=O)C#CB(O)O)C1 2241468371 MSROQTALCFJTPQ-LJGSYFOKSA-N 196.999 -1.705 50 10 AAGE NC(=O)c1ncsc1B(O)O 2241468546 QESLLYOTYAODKF-UHFFFAOYSA-N 171.974 -2.078 50 10 AAGE O=C(NCCCO)[C@H]1C[C@@H]1B(O)O 2241495148 HDJJAGZDPSZEKM-WDSKDSINSA-N 187.004 -1.652 50 10 AAGE NNC(=O)C(=O)NC[C@@H]1CCOC1 61148291 KITILKQUPRSLQA-YFKPBYRVSA-N 187.199 -1.871 50 10 AAGE CN(CCO)CCCC(=O)NN 82468852 GOTTYALFHYGBAP-UHFFFAOYSA-N 175.232 -1.319 50 10 AAGE O=C(O)C[C@H](CB(O)O)C(=O)O 196426078 IUSBDGABCMSTTM-GSVOUGTGSA-N 175.933 -1.365 50 10 AAGE Cc1nn2c(c1B(O)O)N(C)CCC2 238294435 WBKFETSFLDOENS-UHFFFAOYSA-N 195.031 -1.289 50 10 AAGE NC(=O)CNC=C(C=O)C=O 238546152 PSUDMODLZSMPKO-UHFFFAOYSA-N 156.141 -1.657 50 10 AAGE NNC(=O)[C@@H]1CC[C@@H]1CO 306404989 USMCIMXWDIRHSU-RFZPGFLSSA-N 144.174 -1.005 50 10 AAGE O=C1CN[C@H]2C(=O)OC(=O)[C@@H]2N1 306553897 BUKFNJDLQOBOSU-QWWZWVQMSA-N 170.124 -2.474 50 10 AAGE C[C@@]1(C(=O)NN)C[C@H](O)CN1 1521508497 VJQAOITWVCXQGU-NJGYIYPDSA-N 159.189 -1.911 50 10 AAGE C[C@H]1[C@@H](C)[C@@H]1NC(=O)C(=O)NN 1880589103 RKTYMRDVQITIQE-SCDXWVJYSA-N 171.200 -1.253 50 10 AAGE CNNC(=O)N[C@@H](C)S(C)(=O)=O 1881558871 YIQXCDXJEBMPFB-SCSAIBSYSA-N 195.244 -1.189 50 10 AAGE NNC(=O)N1CCC[C@H]1[C@H](O)CO 1882226062 IDQHLZWMBOXODD-NTSWFWBYSA-N 189.215 -1.613 50 10 AAGE NC[C@H]1C[C@H]1CC(=O)NN 1886689519 SKNDOUMHLFLANC-CRCLSJGQSA-N 143.190 -1.039 50 10 AAGE NNC(=O)[C@]12CC[C@@H]1CNC2 1931427836 OFPPCLYGIFUWML-VDTYLAMSSA-N 155.201 -1.024 50 10 AAGE N[C@H](B(O)O)[C@@H]1C[C@H]2CC[C@H]1O2 1953416714 CUIKLNIGZMORKE-GBNDHIKLSA-N 171.005 -1.107 50 10 AAGE C[C@H](CN1CC=C[C@H](O)C1)C(=O)NN 1956307673 SKSZNOQRQZJYML-SFYZADRCSA-N 199.254 -1.155 50 10 AAGE CO[C@@H]1CCN(C(=O)C#CB(O)O)C1 2241468557 QIPDICNDEUJKKM-SSDOTTSWSA-N 196.999 -1.751 50 10 AAGE C[C@@H]1[C@@H](O)CN1C(=O)C1(B(O)O)CC1 2241481394 RXHSIPBDUFGYJA-RITPCOANSA-N 199.015 -1.415 50 10 AAGE NC(=O)C1CC(B(O)O)C1 2241497007 YQOGFRRNHNKBMS-UHFFFAOYSA-N 142.951 -1.275 50 10 AAGE CN(C)NC(=O)CN[C@@H]1CCOC1 2242085536 RCTLLUNBCWUVNZ-SSDOTTSWSA-N 187.243 -1.042 50 10 AAGE C[C@@H]1C[C@@H]1NC(=O)C(=O)NN 52298214 JMVIIAHMQOFZJR-DMTCNVIQSA-N 157.173 -1.499 50 10 AAGE C[C@H](CNCCN(C)C)C(=O)NN 58851099 XYHWVKGVLNWHQA-SSDOTTSWSA-N 188.275 -1.236 50 10 AAGE C[C@H](CC(=O)NN)N(C)CC(N)=O 82467342 AOHNHRKDOOAIGI-RXMQYKEDSA-N 188.231 -1.828 50 10 AAGE CN(C)NC(=O)C[C@@H]1COCCN1 147249474 OSNNWCYPAWNNMO-SSDOTTSWSA-N 187.243 -1.042 50 10 AAGE CC(=O)N(NN)NN 238143722 LRXBYLHTHONHGI-UHFFFAOYSA-N 119.128 -2.409 50 10 AAGE C[C@H](O)[C@@H]1C[C@H](C(=O)NN)CO1 306484115 HJFGLNGTOQXTOX-ZLUOBGJFSA-N 174.200 -1.238 50 10 AAGE NNC(=O)C(=O)N1CC(C(N)=O)C1 307359559 DKZFGNMETIXLDG-UHFFFAOYSA-N 186.171 -3.080 50 10 AAGE NNC(=O)N1CCC(CO)(CO)C1 694642729 MLVSPELDZBVFCD-UHFFFAOYSA-N 189.215 -1.754 50 10 AAGE CCC[S@](=O)NCB(O)O 701949139 HPARYLJKBDKLSF-JTQLQIEISA-N 165.023 -1.338 50 10 AAGE C[C@@H]1CC[C@H](C(=O)NCB(O)O)O1 702017088 HDWVVKUUZMYERK-PHDIDXHHSA-N 187.004 -1.318 50 10 AAGE NNC(=O)[C@@H]1[C@@H]2CCNC[C@H]21 721098921 HZQSXKOOFQVEFI-HSUXUTPPSA-N 155.201 -1.168 50 10 AAGE Cc1nc(B(O)O)n2c1CCC2 1880718659 OFFTUWKOKSFFHZ-UHFFFAOYSA-N 165.989 -1.182 50 10 AAGE OC[C@@H]1[C@@H](O)[C@H](O)CN1CCCl 1881523927 CYCWGDLKJGISRK-FSDSQADBSA-N 195.646 -1.377 50 10 AAGE COc1cc(B(O)O)ccc1CO 1882336335 NCNKHXUSLJHAGR-UHFFFAOYSA-N 181.984 -1.133 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@]2(CO)C1 1899623121 UNOYXMNUMRBIJR-YLWLKBPMSA-N 199.210 -2.183 50 10 AAGE CC(C)NNC(=O)C[C@@H](O)CN 1923696061 JTFOSMZDYXYFDE-ZCFIWIBFSA-N 175.232 -1.275 50 10 AAGE OB(O)c1ncnc2cccnc12 1930355469 RUZSXDMEBOMCDJ-UHFFFAOYSA-N 174.956 -1.295 50 10 AAGE N#C[C@H](O)[C@@H](N)CN1CCCC1=O 1952793663 MDUKVXFWTKKTGR-BQBZGAKWSA-N 183.211 -1.179 50 10 AAGE C[C@@H](C(=O)NN)N1CC2(CCO2)C1 1954053292 ZMOQHXYXUHREBY-LURJTMIESA-N 185.227 -1.161 50 10 AAGE NC(=O)NNC(=O)[C@H]1C[C@@H]1C(N)=O 2241522774 MHOGNFITKQXQJZ-HRFVKAFMSA-N 186.171 -2.193 50 10 AAGE 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C=C(CN1C[C@@H]2COC[C@H]21)B(O)O 1883745239 YAAFTZZVZOKKDV-HTQZYQBOSA-N 183.016 -1.115 50 10 AAGE CC1(CO)CN(CCC(=O)NN)C1 1935359875 YWNURCILZCQBOF-UHFFFAOYSA-N 187.243 -1.319 50 10 AAGE N#C[C@@H](O)[C@@H](N)CCn1cncn1 1952902831 WVBWCHRMMIPNCN-NKWVEPMBSA-N 181.199 -1.120 50 10 AAGE CCc1ccc(=O)n(CC(=O)NN)n1 71773364 STWWXTFTBQJWAN-UHFFFAOYSA-N 196.210 -1.204 50 10 AAGE CC(=O)N[C@H](CO)C(=O)NN 148522220 XQOALYMFXVKGPW-SCSAIBSYSA-N 161.161 -2.527 50 10 AAGE CC(=O)NC(=O)[C@](O)(C#N)NO 238067391 CHGRQLPQMFSWIY-RXMQYKEDSA-N 173.128 -2.160 50 10 AAGE Cc1nc2cc(B(O)O)cnc2n1C 238493423 XDCIHMXVJFVYFJ-UHFFFAOYSA-N 190.999 -1.043 50 10 AAGE C[C@@H]1OCCN[C@@H]1C(=O)NN(C)C 306277805 OLAYIDQOUHRIRW-BQBZGAKWSA-N 187.243 -1.044 50 10 AAGE CC(=O)N/C=C/B(O)O 306388458 OBNFLEUWNGCBNT-NSCUHMNNSA-N 128.924 -1.352 50 10 AAGE CC(=O)Nc1ncc(B(O)O)s1 404914471 MWABFEVYLVOHDB-UHFFFAOYSA-N 186.001 -1.219 50 10 AAGE C[C@]1(C(=O)NN)C[C@H](O)CN1 1521508499 VJQAOITWVCXQGU-UJURSFKZSA-N 159.189 -1.911 50 10 AAGE NNC(=O)CN1CC[C@@H]2[C@@H](CO)[C@@H]2C1 1877949405 FTURQRHSZNYVMI-XLPZGREQSA-N 199.254 -1.464 50 10 AAGE C[C@@H](C(=O)NCB(O)O)N(C)C 1923929415 VBBUHKYKHNTDFT-YFKPBYRVSA-N 174.009 -1.935 50 10 AAGE O=C(NCB(O)O)C1[C@@H]2CC[C@@H]12 1953499853 LHWVQUDMPQOLDT-RFZPGFLSSA-N 168.989 -1.229 50 10 AAGE CC1(O)CC(NC(=O)C#CB(O)O)C1 2241478362 CWFNGJZQARRMMY-UHFFFAOYSA-N 196.999 -1.969 50 10 AAGE O=C(NO)c1ccccc1B(O)O 2241584488 OOIBOONJIFNXPV-UHFFFAOYSA-N 180.956 -1.515 50 10 AAGE CC1=C(C(=O)NN)COC1=O 39065095 CUJHHVMSIMNWFJ-UHFFFAOYSA-N 156.141 -1.150 50 10 AAGE NNC(=O)Cn1cc(F)ccc1=O 71516189 PKDIJZKSEGNJEC-UHFFFAOYSA-N 185.158 -1.023 50 10 AAGE CN1C[C@@H](NC(=O)NN)CCC1=O 82757285 HFCWIVJMUCONLB-YFKPBYRVSA-N 186.215 -1.220 50 10 AAGE C[C@@H](C(=O)NN)S(C)(=O)=O 156917237 NLKMVXRTTNXCJR-VKHMYHEASA-N 166.202 -1.591 50 10 AAGE NC(=O)N[C@H](CB(O)O)C(=O)O 195029474 RMUZQPHRHCHJFW-UWTATZPHSA-N 175.937 -2.419 50 10 AAGE CS(=O)(=O)NCB(O)O 195381687 KWSHBBHFFIUNKT-UHFFFAOYSA-N 152.968 -2.452 50 10 AAGE N#Cc1ccc(B(O)O)cc1N 231392781 PESNKDFKWXYVMU-UHFFFAOYSA-N 161.957 -1.180 50 10 AAGE Nc1nc(CC(=O)O)ccc1B(O)O 238646074 HEOCXLCUTGSNHK-UHFFFAOYSA-N 195.971 -2.029 50 10 AAGE O=C1C[C@@](O)(C(=O)O)[C@H](Cl)C1=O 238677073 MFJVJGSAEJIZEH-XINAWCOVSA-N 192.554 -1.049 50 10 AAGE OB(O)c1ccnc([C@H]2CCNC2)c1 306535658 LULYHDVGFUFIBN-ZETCQYMHSA-N 192.027 -1.162 50 10 AAGE CO[C@@H]1COCC[C@H]1NC(=O)NN 306758409 USRHMEPYNWUTFP-PHDIDXHHSA-N 189.215 -1.037 50 10 AAGE N#C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO 307975549 GQXJZINGMGHWDU-BGPJRJDNSA-N 177.156 -3.054 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2COC[C@@H]21 1882697304 GOXZBPHJLNGTOK-UHNVWZDZSA-N 185.183 -2.167 50 10 AAGE O=C(F)N1CC2(C1)OC[C@H](O)[C@H]2O 1882778092 OPUVEFYHMBHIMW-CRCLSJGQSA-N 191.158 -1.118 50 10 AAGE C=C1CN(C(=O)C#CB(O)O)C1 2241468575 QQXOMBWYHBSOSG-UHFFFAOYSA-N 164.957 -1.600 50 10 AAGE O=C(C#CB(O)O)N1CC(CO)C1 2241476723 YGUFRJPXJPQLNA-UHFFFAOYSA-N 182.972 -2.548 50 10 AAGE C[C@@]1(NC(=O)C#CB(O)O)CCOC1 2241479278 VIINMQKCQQYHKD-MRVPVSSYSA-N 196.999 -1.703 50 10 AAGE CNC(=O)c1cc(B(O)O)cn1C 2241480185 FRDCMQUDLRYPTH-UHFFFAOYSA-N 181.988 -1.936 50 10 AAGE NNC(=O)CSc1n[nH]c(N)n1 82472941 HNDYDOADFIGUGV-UHFFFAOYSA-N 188.216 -1.531 50 10 AAGE COc1cc(B(O)O)ccc1N 199732091 CBHFQROGRLFSMS-UHFFFAOYSA-N 166.973 -1.043 50 10 AAGE OCc1ccc(B(O)O)c(CO)c1 204738927 PXPXDNOONGAAAQ-UHFFFAOYSA-N 181.984 -1.649 50 10 AAGE CC(=O)n1ccc(B(O)O)c1 206160289 URMMMUBZLRYRMV-UHFFFAOYSA-N 152.946 -1.172 50 10 AAGE NNC(=O)CC(O)CC(=O)NN 220452765 XIJFSGRONLDHBO-UHFFFAOYSA-N 176.176 -2.893 50 10 AAGE CN1CCc2c(B(O)O)ccnc21 238312254 ZLKNAEASNLUECL-UHFFFAOYSA-N 178.000 -1.246 50 10 AAGE CN1C(=O)Cc2c(B(O)O)cccc21 238319313 LYUCNUZPMQAXMR-UHFFFAOYSA-N 190.995 -1.115 50 10 AAGE C[C@H](O)[C@@H]1C[C@@H](C(=O)NN)CO1 238475440 HJFGLNGTOQXTOX-JKUQZMGJSA-N 174.200 -1.238 50 10 AAGE NNC(=O)O[C@@H](O)CO 238662844 AALKQNNBGRWCOP-UWTATZPHSA-N 136.107 -2.103 50 10 AAGE NNC(=O)[C@@H](N)Cc1cc[nH]c1 258955871 FVTBOEHVQGWDII-LURJTMIESA-N 168.200 -1.126 50 10 AAGE Cn1cc(/C=N/NC(=O)CO)nn1 307704598 SWYLZXPPMHDECW-FARCUNLSSA-N 183.171 -1.743 50 10 AAGE Cn1nnc(/C=C\B(O)O)n1 382398052 QHZZQCDHYCXUQB-IHWYPQMZSA-N 153.938 -1.765 50 10 AAGE C[C@@]1(C(=O)NN)CNCCO1 710696443 DSVCZJBLNQVEQF-LURJTMIESA-N 159.189 -1.645 50 10 AAGE COc1nscc1B(O)O 711831331 CUKOBQFSVPSXTI-UHFFFAOYSA-N 158.975 -1.169 50 10 AAGE NNC(=O)[C@H]1C[C@@H]1CN1C#CNN1 885390062 HDGCQNBNGUSHAZ-RITPCOANSA-N 181.199 -2.144 50 10 AAGE CO[C@H](C)n1ccc(B(O)O)n1 953036028 GQXXDNBUMOMYDH-RXMQYKEDSA-N 169.977 -1.272 50 10 AAGE NNC(=O)C1(O)CC(N)C1 1880054593 RIWITUIOXXSVGE-UHFFFAOYSA-N 145.162 -2.172 50 10 AAGE C=CC[C@H](O)[C@H]1CCN1CC(=O)NN 1886738690 PHMNQUSCWHTZHC-SFYZADRCSA-N 199.254 -1.012 50 10 AAGE CN(CC(=O)NN)[C@@H]1CCNC1=O 1916203075 VCGPHVVUKSFZEL-RXMQYKEDSA-N 186.215 -2.203 50 10 AAGE CC12CC(C(=O)NCB(O)O)(CO1)C2 1935034713 QZNHYWSIGYKIOZ-UHFFFAOYSA-N 199.015 -1.316 50 10 AAGE NNC(=O)[C@@H](N)C1COC1 1953189035 LGKOZTPEWYFTOC-BYPYZUCNSA-N 145.162 -2.050 50 10 AAGE NNC(=O)C(=O)NC1CC(CF)C1 1954667442 FDLDJVCPHMVXJI-UHFFFAOYSA-N 189.190 -1.159 50 10 AAGE COc1ncc(F)c(B(O)O)n1 2241471922 NHGAZLOMZVLENT-UHFFFAOYSA-N 171.924 -1.696 50 10 AAGE Cc1nc(NC(=O)C#CB(O)O)n[nH]1 2241476396 RKAGOWREAHRGJA-UHFFFAOYSA-N 193.959 -1.933 50 10 AAGE CCCN(OC)C(=O)C#CB(O)O 2241479129 RUSPNSGSPOVZHV-UHFFFAOYSA-N 184.988 -1.198 50 10 AAGE CCN(CCF)C(=O)C#CB(O)O 2241479320 WAJYLQUFGKOAEI-UHFFFAOYSA-N 186.979 -1.180 50 10 AAGE O=CN1CCc2cc(B(O)O)ccc21 2241556515 YTIIHDDRKVPFJI-UHFFFAOYSA-N 190.995 -1.115 50 10 AAGE O=C(NC1CC1)c1cocc1B(O)O 2241750862 BXTZDILBDNNDJQ-UHFFFAOYSA-N 194.983 -1.148 50 10 AAGE C[C@@H](CO)N(C)[C@@H](C)C(=O)NN 123714632 IHUORQHNIIYKKJ-WDSKDSINSA-N 175.232 -1.323 50 10 AAGE CN(CC(=O)O)NC(=O)[C@H](O)CN 238318586 MMVMMDJXAGNJEN-SCSAIBSYSA-N 191.187 -2.646 50 10 AAGE NNC(=O)COCC1CCNCC1 260421229 GNXJYHMKNJXOCT-UHFFFAOYSA-N 187.243 -1.008 50 10 AAGE NC(=O)N/N=C1\C=CC(=O)N1 306661705 OPMZGBKXXOWCJL-UHFFFAOYSA-N 154.129 -1.346 50 10 AAGE NNC(=O)C/C=C/CC(=O)NN 318681101 NIHWQGADAVFOFQ-OWOJBTEDSA-N 172.188 -1.697 50 10 AAGE COC[C@@](C)(CO)N(C)C(=O)NN 689776038 RWUMXQIAJJZNMB-SSDOTTSWSA-N 191.231 -1.101 50 10 AAGE CN(CC(=O)NN)[C@@H]1COC[C@H]1O 708110430 CMRGALRSRFARHO-PHDIDXHHSA-N 189.215 -2.332 50 10 AAGE CN(CCS(N)(=O)=O)C(=O)NN 719701050 BSERVFRJBGHEST-UHFFFAOYSA-N 196.232 -2.210 50 10 AAGE N#Cc1cnn2cc(B(O)O)cnc12 1885314224 NROLXDDGNUISIQ-UHFFFAOYSA-N 187.955 -1.719 50 10 AAGE C[C@H](O)C(=O)N1CC[C@@H](B(O)O)C1 1891515999 CNORMAZPEUYDBX-NTSWFWBYSA-N 187.004 -1.558 50 10 AAGE O=C(CCn1cccn1)NNCCO 1929834221 XTKFUSUTKAZKKQ-UHFFFAOYSA-N 198.226 -1.114 50 10 AAGE C[C@@]12CCO[C@@H]1[C@@](N)(B(O)O)C2 1933397702 KMJOXVWHLMBRFO-LYFYHCNISA-N 171.005 -1.105 50 10 AAGE CN(C)NC(=O)[C@@H]1C[C@H]1N 1953152227 DRJUUFXXWUBVKP-RFZPGFLSSA-N 143.190 -1.074 50 10 AAGE NNC(=O)NC[C@@H]1CCNC(=O)C1 1954563296 AUVRXLHOBZMBFU-RXMQYKEDSA-N 186.215 -1.315 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@]2(O)C[C@H]2C1 2241326760 MNXJGXICYCBLKL-FJXKBIBVSA-N 199.254 -1.179 50 10 AAGE O=C(NCCO)C1(B(O)O)CC1 2241481735 VAMASSWRXCEIHH-UHFFFAOYSA-N 172.977 -1.898 50 10 AAGE C=CCOC[C@H](O)CNNC(N)=O 33611370 QYOYLWSRBFQKOD-ZCFIWIBFSA-N 189.215 -1.277 50 10 AAGE CN[C@@H](C)CC(=O)NN 58847786 JGMVBFDNHFSHAR-BYPYZUCNSA-N 131.179 -1.026 50 10 AAGE C[C@@H](C(=O)NN)N1CCC(N)CC1 82470841 ZLNQPDCFZXSJJU-LURJTMIESA-N 186.259 -1.212 50 10 AAGE O=C1C[C@@H](O)C(=O)O1 85565635 KPYCVQASEGGKEG-UWTATZPHSA-N 116.072 -1.179 50 10 AAGE CN(C(=O)C(=O)NN)C(C)(C)CO 123098568 UAJLXDUSGONVRJ-UHFFFAOYSA-N 189.215 -1.794 50 10 AAGE OB(O)c1cncc(N2CCCC2)n1 198083110 RPPBFWSTXYQXOH-UHFFFAOYSA-N 193.015 -1.243 50 10 AAGE C[C@@H](NS(C)(=O)=O)B(O)O 220160848 LBALBDULCPLUSS-GSVOUGTGSA-N 166.995 -2.064 50 10 AAGE NNC(=O)[C@H](N)C1CCOCC1 259006040 NNTQJCVWIXWUAY-ZCFIWIBFSA-N 173.216 -1.270 50 10 AAGE N[C@H]1NC[C@@H](Br)NC1=O 306328864 NXESRPNCRGFHCV-HRFVKAFMSA-N 194.032 -1.288 50 10 AAGE C[C@H](O)[C@H](O)[C@@H](O)C=NNC(N)=O 308050798 GNSOSMKGZQXBHQ-YUPRTTJUSA-N 191.187 -2.257 50 10 AAGE C[C@H](C(=O)NN)N(C)C(CO)CO 308159434 VUXGEBPLYFBQIN-RXMQYKEDSA-N 191.231 -2.350 50 10 AAGE C[C@@H]1C[C@@]1(C)NC(=O)C(=O)NN 606252646 SJZSAVIJYZGZIY-CLZZGJSISA-N 171.200 -1.109 50 10 AAGE CCN1C#CN(CC(=O)NN)[C-]1O 885449576 LCZFSOVADJCUHX-UHFFFAOYSA-N 183.191 -1.648 50 10 AAGE N=NNCC1=C=NC(C(=O)NN)=[S+]1 885892282 ZCUHWLPXMLCIHF-UHFFFAOYSA-O 199.219 -1.708 50 10 AAGE NNC(=O)N1C[C@@H](F)[C@H](CO)C1 1880610551 REDMWEZAWWTSST-CRCLSJGQSA-N 177.179 -1.168 50 10 AAGE C[C@@H](OCC1CN(C)C1)C(=O)NN 1886370073 HMVFZYXEUANMHW-ZCFIWIBFSA-N 187.243 -1.057 50 10 AAGE Cn1nnc2c(B(O)O)ncnc21 1929059009 JCCKGECBTWDMQA-UHFFFAOYSA-N 178.948 -2.562 50 10 AAGE OB(O)c1csc(-n2cncn2)n1 1954093689 OPPORRMKPCTVEL-UHFFFAOYSA-N 196.000 -1.596 50 10 AAGE C#CCN(OC)C(=O)[C@H]1C[C@@H]1B(O)O 2241780122 HJOJDACRVKYXHD-BQBZGAKWSA-N 196.999 -1.128 50 10 AAGE NC(=O)CNC(=O)NC(=O)CCl 36905989 RUVDYUSWTWRFTI-UHFFFAOYSA-N 193.590 -1.464 50 10 AAGE CNC(=O)[C@H]1CCCN1C(=O)NN 42397782 QYNUCNODVPNMTO-RXMQYKEDSA-N 186.215 -1.220 50 10 AAGE NNC(=O)COCC(=O)O 104734942 KPKZDIBAXMVAOT-UHFFFAOYSA-N 148.118 -1.923 50 10 AAGE Cc1nc2ccc(B(O)O)cn2n1 206062101 DXCSRWGZMBSWDG-UHFFFAOYSA-N 176.972 -1.282 50 10 AAGE CN(C)C(=O)[C@](C)(O)NNC(N)=O 238313428 UWLOHBOZBNQZDM-LURJTMIESA-N 190.203 -2.044 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@H]2C1 307541308 XMPWFBUQTSJFOA-WDSKDSINSA-N 155.201 -1.072 50 10 AAGE COC(=O)C(=O)N/N=C/C(=O)O 307859347 JBTWZUVPGUUSRC-QHHAFSJGSA-N 174.112 -1.654 50 10 AAGE O=C(CO)N/N=C/[C-]1NC#CS1 642844258 QRXZDYHXFFLSBW-FPYGCLRLSA-N 184.200 -1.175 50 10 AAGE CN(CC(=O)NN)[C@@H]1CCC[C@@H]1O 708050842 MFSBMTCQTALXOU-RQJHMYQMSA-N 187.243 -1.179 50 10 AAGE C[C@@H]1OCC(=NNC(=O)C(N)=O)[C@@H]1C 844565201 POTIJORZSKWHDA-UHNVWZDZSA-N 199.210 -1.001 50 10 AAGE CNNC(=O)C1=C=[N+](C)NN1 885250486 ZHDYMWBKIMIOHO-UHFFFAOYSA-O 156.169 -2.544 50 10 AAGE C=CC1(O)CN([C@H](CC)C(=O)NN)C1 1891961128 SVMSXMWKQVGIHE-SSDOTTSWSA-N 199.254 -1.012 50 10 AAGE NNC(=O)C(N)(CO)CO 1892583135 CCYWNHFFTNFNDA-UHFFFAOYSA-N 149.150 -3.342 50 10 AAGE NNC(=O)C(=O)N[C@H]1C[C@H](F)C1 1893683294 CCQKFPUAJGWCGR-JPYJGEKTSA-N 175.163 -1.407 50 10 AAGE CO[C@H]1C[C@H]1C(=O)NNCCO 1929835682 WNEMRQRXKMMUEX-RITPCOANSA-N 174.200 -1.366 50 10 AAGE NNC(=O)[C@]1(CO)CCCN1 1953304420 PRQNPLMZLNYODN-ZCFIWIBFSA-N 159.189 -1.909 50 10 AAGE OB(O)c1cccnc1NC1COC1 2210060518 LDNLCXGWSZEGEV-UHFFFAOYSA-N 193.999 -1.428 50 10 AAGE NC(=O)c1cc(B(O)O)sn1 2241495593 LDIWCDMANUNBJN-UHFFFAOYSA-N 171.974 -2.078 50 10 AAGE O=C(NO)c1ccc(B(O)O)o1 2241584789 TXTWQYKUAVJXSN-UHFFFAOYSA-N 170.917 -1.922 50 10 AAGE NNC(=O)CNCCN1CCCC1 58862010 HQGUDXMSKIFVIV-UHFFFAOYSA-N 186.259 -1.338 50 10 AAGE NNC(=O)[C@@H](CCO)NO 238663048 CWAGFOPGJFHSCC-GSVOUGTGSA-N 149.150 -2.294 50 10 AAGE O=C(Cl)[C@@H](O)[C@@H](O)C(=O)O 238716856 LKCPSSDNCUYXGJ-NHYDCYSISA-N 168.532 -1.442 50 10 AAGE O[C@H]1[C@H](O)CN[C@H](CCl)[C@H]1O 306724234 UJTPCYUIJJZFFA-KAZBKCHUSA-N 181.619 -1.720 50 10 AAGE N#CC1=C=N[C-](N)NC1=O 642878589 IKCNFRQTLCEAOR-UHFFFAOYSA-N 135.106 -1.358 50 10 AAGE CN(C)NC(=O)C#CCN 717426520 DKDSNWNYVYWYKV-UHFFFAOYSA-N 141.174 -1.459 50 10 AAGE NNC(=O)CSC1CNC1 1880017676 HMSCFQXCYXOPHE-UHFFFAOYSA-N 161.230 -1.319 50 10 AAGE NNC(=O)[C@H]1C[C@@H]2OCCN[C@@H]2C1 1883851419 SGZDLMMRUOVMHH-QYNIQEEDSA-N 185.227 -1.257 50 10 AAGE C[S@](=O)N1CC[C@H](B(O)O)C1 1891606628 GTLDCXADGUKTAV-DYEAUMGKSA-N 177.034 -1.171 50 10 AAGE CN(C)C(=O)CC(=O)NNC=O 1923945916 JMPPTQVYENZUQV-UHFFFAOYSA-N 173.172 -1.758 50 10 AAGE OB(O)c1ccnc2ccnn12 1934734700 BJEAEHYOEXOECY-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE CN1CCC[C@](N)(B(O)O)C1 1953252816 WLHWPKMZPQHWKG-ZCFIWIBFSA-N 158.010 -1.579 50 10 AAGE CN(C(=O)C#CB(O)O)C1CC1 2241478508 GTUUEOPIRAYYDX-UHFFFAOYSA-N 166.973 -1.377 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CCNC1 2241479083 RALNGMGAUOTXLI-ZCFIWIBFSA-N 181.988 -2.520 50 10 AAGE NNC(=O)CN1C(=O)CNC1=O 37388040 AGMTZYFCYBHKKY-UHFFFAOYSA-N 172.144 -2.472 50 10 AAGE OC(O)[C@@H](O)CCl 104689413 DMHHQIBDZZWDEJ-REOHCLBHSA-N 126.539 -1.103 50 10 AAGE O=c1cc(B(O)O)cc(O)[nH]1 206086807 POQUWDHLSBLIAK-UHFFFAOYSA-N 154.918 -2.240 50 10 AAGE C[C@@H](C[S@@](C)=O)NC(=O)NN 229034898 AGVYQVGURXBSAC-AQPAIEDISA-N 179.245 -1.074 50 10 AAGE CC(C)NNC(=O)[C@H](N)[C@H](C)O 238197294 SIDGJGKJWHMEIW-NTSWFWBYSA-N 175.232 -1.276 50 10 AAGE Cc1cc(C#N)c(B(O)O)cn1 238476565 JNGLCAZZAVOGNK-UHFFFAOYSA-N 161.957 -1.059 50 10 AAGE NNC(=O)[C@@H]1CNCC1(F)F 575593974 VIZMARFDMXFGQV-VKHMYHEASA-N 165.143 -1.169 50 10 AAGE COCCn1nc(C)c(B(O)O)c1C 694307410 HVKNAJTZAUIUQJ-UHFFFAOYSA-N 198.031 -1.174 50 10 AAGE OB(O)c1ncnn2cccc12 1934734844 FHRCKANNMHSTKL-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE CO[C@@H]1C[C@@]2(C(=O)NCB(O)O)C[C@@H]12 1935498575 BOVXCJCKIVVYCD-BBVRLYRLSA-N 199.015 -1.460 50 10 AAGE C[C@@H](O)CNc1cc(B(O)O)ccn1 2210060301 IQOJVKQDZIJXJO-ZCFIWIBFSA-N 196.015 -1.446 50 10 AAGE O=C(C#CB(O)O)N1CCO[C@@H]2C[C@H]21 2241476192 NHAYKYJEVQBRBF-RNFRBKRXSA-N 194.983 -1.999 50 10 AAGE COC(=O)c1ncc(C)cc1B(O)O 2241494081 UDYFNPZULKWUJT-UHFFFAOYSA-N 194.983 -1.144 50 10 AAGE NNC(=O)NCCCS(N)(=O)=O 45091571 KGVDEQRQPTUUJF-UHFFFAOYSA-N 196.232 -2.162 50 10 AAGE Cc1cc(C)n(CC(=O)NN)c(=O)n1 82468334 NIVSUFRVNQCXTP-UHFFFAOYSA-N 196.210 -1.150 50 10 AAGE O=P(O)(O)CB(O)O 194905169 SSXSWDUJXWSCEA-UHFFFAOYSA-N 139.840 -1.824 50 10 AAGE OB(O)CCB(O)O 196001621 GPAWSMHQQSHLOL-UHFFFAOYSA-N 117.706 -2.068 50 10 AAGE Nc1ncc2cc(B(O)O)ccc2n1 202463160 MPARUIYWLANLDG-UHFFFAOYSA-N 188.983 -1.108 50 10 AAGE Cc1cnc(B(O)O)cc1N 307018961 RKDORGWEOXCYPD-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE NNc1ccccc1B(O)O 307657355 RLCKIHXUAAYLLT-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE CN(N)C(=O)[C@H]1CCS(=O)(=O)C1 606265072 ADFPMYUGPBFTCU-YFKPBYRVSA-N 192.240 -1.247 50 10 AAGE CN1NNN/C1=C1/N=C=C=C=C1C=O 885535252 JROFPWUCJNGCAI-FPLPWBNLSA-N 189.178 -1.267 50 10 AAGE CCN(C)NC(=O)CNC(N)=O 1923512170 KFOZWQOJEUYCEH-UHFFFAOYSA-N 174.204 -1.362 50 10 AAGE CCO[C@H]1CN[C@@H](C(=O)NN)C1 1923557380 VBYNEPXBWFWRPM-PHDIDXHHSA-N 173.216 -1.257 50 10 AAGE OB(O)CNc1ncccn1 1923813322 WZQMVSRGJQYNGQ-UHFFFAOYSA-N 152.950 -1.100 50 10 AAGE O=C(NNCCO)[C@]12COC[C@H]1C2 1929836105 CYHSBYNUJCWHNP-HTRCEHHLSA-N 186.211 -1.364 50 10 AAGE CC1(C)C(=O)NC[C@@H]1NC(=O)NN 2241450669 VDCMQFLISIFXJE-BYPYZUCNSA-N 186.215 -1.316 50 10 AAGE CNC1CN(C(=O)[C@H]2C[C@@H]2B(O)O)C1 2241496085 PKBBXJXDKHCFIN-BQBZGAKWSA-N 198.031 -1.721 50 10 AAGE C#CC(CO)(CO)NC(=O)CCl 2242272708 IRRJMSMSQSQSTJ-UHFFFAOYSA-N 191.614 -1.302 50 10 AAGE OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](Cl)[C@@H]1O 22054424 CRJLKIILIKSPDH-FDROIEKHSA-N 198.602 -1.975 50 10 AAGE in-vitro C[C@H](CNCCO)C(=O)NN 58855663 DXJCQQDHAQLWIS-RXMQYKEDSA-N 161.205 -1.806 50 10 AAGE N#C[C@H](O)C(=O)O 104715571 GWHLWTNIZGVOBE-REOHCLBHSA-N 101.061 -1.045 50 10 AAGE N#C[C@H](O)[C@H](O)CO 141346526 YDXGXFDEPLKGAQ-IUYQGCFVSA-N 117.104 -1.776 50 10 AAGE COc1cc(B(O)O)cc(C=O)n1 198023972 YOOTYCOQBZFFRZ-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE O=CNc1ccccc1B(O)O 200291247 XCXAWFJETQQGQA-UHFFFAOYSA-N 164.957 -1.065 50 10 AAGE CCc1nn(C)cc1B(O)O 203561595 JUWFSFFDQROUTJ-UHFFFAOYSA-N 153.978 -1.338 50 10 AAGE NNC(=O)[C@@H](O)[C@H](O)CO 222423471 DABFVTGKRSUBNK-GBXIJSLDSA-N 150.134 -3.310 50 10 AAGE Nc1ccc(B(O)O)cc1CC(=O)O 238573709 PPGGJHPITRBEFX-UHFFFAOYSA-N 194.983 -1.424 50 10 AAGE NC(=O)C(=O)N/N=C/[C@H]1CCOC1 306684082 YPEMMTKNLVYVIQ-YRQANVMGSA-N 185.183 -1.390 50 10 AAGE C[C@@H]1C[C@@H]1C(=O)NCB(O)O 575452334 WYWIAAUQGKFUOJ-UHNVWZDZSA-N 156.978 -1.229 50 10 AAGE N#CC(C#N)=C(N)NC=O 1615950271 WGSYWJQHPFWMAB-UHFFFAOYSA-N 136.114 -1.050 50 10 AAGE CO[C@H]1C[C@@H]1C(=O)NCC#CB(O)O 1895148188 GPVXOCDHLKTFCA-BQBZGAKWSA-N 196.999 -1.847 50 10 AAGE CN(C)NC(=O)C[C@H]1CNC[C@H]1O 1954193879 GDGSUGDUVDAYGO-NKWVEPMBSA-N 187.243 -1.450 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H]2C[C@]2(O)C1 1956822726 YKBDVSJOXSAPSD-XRGYYRRGSA-N 199.210 -2.040 50 10 AAGE O=C(C#CB(O)O)N1C[C@H]2C=C[C@H]1C2 2241468329 LVCNVXZIUYUAAI-YUMQZZPRSA-N 190.995 -1.211 50 10 AAGE C[C@H]1C[C@H](N)CN1C(=O)C#CB(O)O 2241479084 RATZOZIWVKIEJQ-BQBZGAKWSA-N 196.015 -2.050 50 10 AAGE N#CC1(F)CN(CC(=O)NN)C1 2297005921 GNKBMRGEILHJCO-UHFFFAOYSA-N 172.163 -1.476 50 10 AAGE NNC(=O)[C@H]1CCCN1 34213765 CMCFIGZTTYAYIZ-SCSAIBSYSA-N 129.163 -1.272 50 10 AAGE C[C@H]1CN(CC(=O)NN)CCN1C 82485310 IGGJKSQFJXPZAD-ZETCQYMHSA-N 186.259 -1.388 50 10 AAGE O=C(O)Cc1ccc(B(O)O)c(O)n1 238622316 ZXIFYOVZBRKLTP-UHFFFAOYSA-N 196.955 -1.906 50 10 AAGE OB(O)c1ccc(O)nc1O 238624717 ZHVGLQZYLYOPGJ-UHFFFAOYSA-N 154.918 -1.827 50 10 AAGE O=C/C(O)=C(\O)[C@@H](O)[C@H](O)CO 238708738 ADGXMKSOBBXKBS-UQNSWBRFSA-N 178.140 -1.773 50 10 AAGE C[C@H]1COC[C@H]1N(C)CC(=O)NN 688148931 VSWRGSKDKGKMES-NKWVEPMBSA-N 187.243 -1.057 50 10 AAGE COCCOc1cccc(B(O)O)n1 714028824 NYCGNRCVPKCAGB-UHFFFAOYSA-N 196.999 -1.213 50 10 AAGE Cn1nnc(CNCB(O)O)n1 1923931342 OLBJRRRIQFMZAZ-UHFFFAOYSA-N 170.969 -2.688 50 10 AAGE CN(N)C(=O)[C@@H]1COCCN1C 1934628058 QUBGKYCQNJKNHP-LURJTMIESA-N 173.216 -1.351 50 10 AAGE N#C[C@@H](O)Cc1nn[nH]n1 1951360503 DYYRRSIVGBFEPG-VKHMYHEASA-N 139.118 -1.373 50 10 AAGE NNC(=O)CN1CC(O)(CO)C1 1953706721 XWJWWOQPUHMTBP-UHFFFAOYSA-N 175.188 -2.985 50 10 AAGE C[C@@H]1C[C@H]1Oc1ncncc1B(O)O 1956971313 WNFRTKNPDDOFKC-IYSWYEEDSA-N 193.999 -1.056 50 10 AAGE NCCNC(=O)c1ccoc1B(O)O 2241478272 BGSRGLDJADHMTD-UHFFFAOYSA-N 197.987 -2.352 50 10 AAGE O=C(Nc1nc[nH]n1)[C@H]1C[C@@H]1B(O)O 2241494932 FSXKZMNJFBYLLN-IMJSIDKUSA-N 195.975 -1.394 50 10 AAGE C[C@H]1CNCCN1CC(=O)NN 77004669 ZIRTWUZBOALSFD-LURJTMIESA-N 172.232 -1.730 50 10 AAGE NNC(=O)CCSC[C@H](O)CO 86661861 SEQWWUDGZMVOIQ-RXMQYKEDSA-N 194.256 -1.547 50 10 AAGE C[C@@H](SC[C@H](O)CO)C(=O)NN 86661864 YKRPCZNNDJLRGW-RFZPGFLSSA-N 194.256 -1.549 50 10 AAGE NC(=S)NNC(=O)c1ccnnc1 132678335 SCOMHQCTTKESIU-UHFFFAOYSA-N 197.223 -1.045 50 10 AAGE Nc1cc(CO)cc(B(O)O)c1 204739525 FPOPIWVDXBBXOU-UHFFFAOYSA-N 166.973 -1.559 50 10 AAGE NC(=O)[C@H](O)CNC(=O)CCCl 228652404 BHWHMEXXSKXPFC-SCSAIBSYSA-N 194.618 -1.422 50 10 AAGE COc1nc(O)ccc1B(O)O 238395774 LGCMIWPAVWSRTP-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE OC[C@@H]1O[C@H](CCl)[C@H](O)[C@H]1O 307490159 AFEGDRDJPMKARR-VANKVMQKSA-N 182.603 -1.293 50 10 AAGE CNCC(=O)NNC(=O)c1ccc[nH]1 389950396 RXJIUXUXRFIIRI-UHFFFAOYSA-N 196.210 -1.005 50 10 AAGE Cn1nccc1[C@H](N)C(=O)NN 402748581 ARWMBIFFCSYKFN-YFKPBYRVSA-N 169.188 -1.590 50 10 AAGE N#C[C@H](O)C1=C=S=NN1 642817478 DUPMPPSPZLIRDW-BYPYZUCNSA-N 141.155 -1.060 50 10 AAGE O=C(NCB(O)O)c1cnc[nH]1 706439824 SLOVGSNEDJDFHO-UHFFFAOYSA-N 168.949 -1.849 50 10 AAGE O=C[C@@H](O)C(=O)NCCCl 1866087724 ZLSONGQZELOQJA-SCSAIBSYSA-N 165.576 -1.099 50 10 AAGE CCC[S@](=O)NCC#CB(O)O 1881440070 LLWOBOBAYQXUGH-LBPRGKRZSA-N 189.045 -1.335 50 10 AAGE CC(C)NC(=O)NCC#CB(O)O 1883739744 XSIJFJIZOVGBDL-UHFFFAOYSA-N 184.004 -1.291 50 10 AAGE N[C@H](B(O)O)[C@@H]1[C@@H]2COC[C@@H]21 1891251128 VKLBACOZFOGQHX-FSIIMWSLSA-N 156.978 -1.782 50 10 AAGE O=C1NCC[C@@H]1N1CC[C@H](B(O)O)C1 1891490545 DXZKTTKQNDJWFX-BQBZGAKWSA-N 198.031 -1.576 50 10 AAGE C[C@H](N)CNC(=O)C#CB(O)O 2241478937 NWYBXNRCBAZTSO-YFKPBYRVSA-N 169.977 -2.535 50 10 AAGE C[C@H](NC(=O)C#CB(O)O)C1CNC1 2241479172 SPNCLJRJDQXHHR-LURJTMIESA-N 196.015 -2.274 50 10 AAGE 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188.183 -1.370 50 10 AAGE CCCOCC(=O)NCC#CB(O)O 1895239353 MLFZSGRRRPFFPS-UHFFFAOYSA-N 199.015 -1.455 50 10 AAGE Cn1cc(B(O)O)c(Cl)n1 1916437030 QVSKKXLTPBDKFF-UHFFFAOYSA-N 160.369 -1.247 50 10 AAGE CC(=O)NC[C@H](N)[C@H](O)C#N 1952895405 HSUVJVYSVIHSTK-NTSWFWBYSA-N 157.173 -1.666 50 10 AAGE CN(C)NC(=O)[C@H]1CO[C@@H]2CNC[C@@H]21 1955556422 LWTBLUCNYDYZPJ-GJMOJQLCSA-N 199.254 -1.186 50 10 AAGE N[C@H]1C[C@H]1Nc1cc(B(O)O)ccn1 2210067546 AJICMSWFPIZTNM-NKWVEPMBSA-N 193.015 -1.727 50 10 AAGE C[C@H](CO)N(C)C(=O)C#CB(O)O 2241468813 VJCLGFCGKPHJHN-ZCFIWIBFSA-N 184.988 -2.159 50 10 AAGE Cc1oc(B(O)O)cc1C(=O)N(C)C 2241470812 CGNZIFBXFLGYGK-UHFFFAOYSA-N 196.999 -1.030 50 10 AAGE NNC(=O)CN1[C@H]2CC[C@H](C2)[C@H]1CO 2297086852 CPUVLLRHMVTGNQ-GJMOJQLCSA-N 199.254 -1.179 50 10 AAGE NNC(=O)C1(C(=O)O)CCNCC1 142974034 SHHHTTWBZAEZNW-UHFFFAOYSA-N 187.199 -1.569 50 10 AAGE Cc1nn(C)c2ncc(B(O)O)cc12 238516351 FGQISARMTLBFNI-UHFFFAOYSA-N 190.999 -1.043 50 10 AAGE CNC(=O)CC(=O)NNC(C)=O 306166474 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NNC(=O)c1cnc(N)cn1 307750467 KEXXJAYDTCJSSK-UHFFFAOYSA-N 153.145 -1.338 50 10 AAGE CO[C@H]1CNC[C@H]1C(=O)NN(C)C 690132431 YWNURDYYCHDRAU-RQJHMYQMSA-N 187.243 -1.186 50 10 AAGE COCC(=O)NCB(O)O 702023389 OWSSFMOSHCQSAQ-UHFFFAOYSA-N 146.939 -2.239 50 10 AAGE NNC(=O)C(=O)N1CC2(CC[C@@H]2O)C1 1885319395 YYCYCPDGHXSLNH-YFKPBYRVSA-N 199.210 -2.040 50 10 AAGE COC1(CF)CN(CC(=O)NN)C1 1953951992 VNXMRSGBFHQTTG-UHFFFAOYSA-N 191.206 -1.353 50 10 AAGE O=C(C#CB(O)O)NC[C@H]1CCCO1 2241468475 PAOJVFQPNHMMKL-SSDOTTSWSA-N 196.999 -1.703 50 10 AAGE O=C(NCC1CNC1)[C@H]1C[C@@H]1B(O)O 2241479952 CCXHSYDJZJLNFR-BQBZGAKWSA-N 198.031 -1.815 50 10 AAGE COCC[C@@H](N)C(=O)NN 69635653 IZATWBCUUPFFNS-SCSAIBSYSA-N 147.178 -1.660 50 10 AAGE NNC(=O)CN1C[C@@H]2CC[C@@H](O)[C@H]2C1 125784285 ZNRYQNPVKNSERG-BIIVOSGPSA-N 199.254 -1.321 50 10 AAGE CC(=O)/C(=N/O)C(=O)NN 142478537 XAEKGYISSCGIGK-CLTKARDFSA-N 145.118 -1.605 50 10 AAGE NC1(c2cnc(B(O)O)cn2)CC1 199206134 HKDDSZBFOHFMNL-UHFFFAOYSA-N 178.988 -1.896 50 10 AAGE Nc1ncc(Cl)cc1B(O)O 238690551 CAAALXDCLUFWPE-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE NNC(=O)[C@H](N)C(F)(F)F 306245711 WGFIHCAIVVBGOV-SFOWXEAESA-N 157.095 -1.134 50 10 AAGE CNC(=O)C[C@@H]1NC(=O)OC1=O 306471771 BGPBAFJKMIYLKS-VKHMYHEASA-N 172.140 -1.243 50 10 AAGE Cc1ccc(NN)cc1B(O)O 306580702 OAQMQTUCIXKJFU-UHFFFAOYSA-N 165.989 -1.040 50 10 AAGE CN(N)C(=O)Cn1ccnn1 707492778 VJLFSPKGIGBHDZ-UHFFFAOYSA-N 155.161 -1.390 50 10 AAGE O=C(NNCCO)[C@H]1[C@H]2OCC[C@@H]21 1881756460 KXEZXIQVYWDLAJ-QYNIQEEDSA-N 186.211 -1.366 50 10 AAGE COc1ccc(B(O)O)nc1OC 1881938473 RAROQDAGBUNHRG-UHFFFAOYSA-N 182.972 -1.221 50 10 AAGE N#CNCc1ccc(B(O)O)cc1 1884169900 IGMIBIYOYCPMPG-UHFFFAOYSA-N 175.984 -1.063 50 10 AAGE N[C@@H](B(O)O)[C@@H]1[C@@H]2COC[C@@H]21 1891251129 VKLBACOZFOGQHX-JGWLITMVSA-N 156.978 -1.782 50 10 AAGE C[C@@H]1C[C@@H]1Oc1ncc(B(O)O)cn1 1956954979 QWTHYNZWTUDFSK-VDTYLAMSSA-N 193.999 -1.056 50 10 AAGE O=C(C#CB(O)O)NCC#CCCO 2241468267 KNNAKCKXLXMZCD-UHFFFAOYSA-N 194.983 -2.496 50 10 AAGE COC(=O)[C@@H](C)NC(=O)C#CB(O)O 2241471939 NPFWJPSXHCGUAA-RXMQYKEDSA-N 198.971 -2.321 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C[C@H]1C(=O)O 2241582711 LALXWETZEOUHAS-UHNVWZDZSA-N 196.955 -2.409 50 10 AAGE CN(CC(=O)NN)CC(=O)N(C)C 82467353 VEKLBMLPPGOUNV-UHFFFAOYSA-N 188.231 -2.004 50 10 AAGE C[C@@H](SC[C@@H](O)CO)C(=O)NN 86661866 YKRPCZNNDJLRGW-UHNVWZDZSA-N 194.256 -1.549 50 10 AAGE C[C@@H](CO)N(C)C(=O)C(=O)NN 124499417 WYAMEHBXWGGUCY-BYPYZUCNSA-N 175.188 -2.185 50 10 AAGE C[C@H](O)[C@@H]1CCN(CC(=O)NN)C1 159484830 NEAMEWTVPSIXQM-NKWVEPMBSA-N 187.243 -1.321 50 10 AAGE Cc1nc(N(C)C)nc(C)c1B(O)O 221555304 JANDMZAYCAFRQM-UHFFFAOYSA-N 195.031 -1.161 50 10 AAGE CCS(=O)(=O)CCNC(=O)NN 233805319 VKPFKTOKQVYOCS-UHFFFAOYSA-N 195.244 -1.406 50 10 AAGE [C-]#[N+]C1=C[C@](O)([C@H](C)O)[C@@H](O)[C@@H]1O 238480261 IGGOWFZBVPRSMG-UCVXFZOQSA-N 185.179 -1.363 50 10 AAGE O=C1O[C@](O)(C(=O)O)[C@H](Cl)[C@@H]1O 250643308 IIWZHTBAZWRJHP-DYYAUYFMSA-N 196.542 -1.715 50 10 AAGE COc1nc(CN)ncc1B(O)O 306148899 CYBOSYCNQRVDNZ-UHFFFAOYSA-N 182.976 -2.376 50 10 AAGE O[C@@H]1[C@H](O)[C@@H](Cl)[C@@H](O)[C@@H]1O 306477697 AZRSXIZEFAVCBM-DCTUXMIOSA-N 168.576 -1.949 50 10 AAGE C[C@H]1OCC[C@H]1C(=O)NCB(O)O 706525762 CBNCUAUKRQQMTF-PHDIDXHHSA-N 187.004 -1.460 50 10 AAGE NC(=O)c1ccc(B(O)O)[nH]1 716783994 KRSLCYPRNNCTOT-UHFFFAOYSA-N 153.934 -2.207 50 10 AAGE CC(C)NNC(=O)CON 1923417039 IILYVGZUHKZITM-UHFFFAOYSA-N 147.178 -1.094 50 10 AAGE C[C@H](C(=O)O)C(=O)NCB(O)O 1923715317 HBIMTEKGOHQPSK-VKHMYHEASA-N 174.949 -2.165 50 10 AAGE COC1(CO)CN(CC(=O)NN)C1 1935359626 WMWJIRRBXBHXIP-UHFFFAOYSA-N 189.215 -2.331 50 10 AAGE C#CC(=O)N[C@@H](CB(O)O)C(=O)O 1954525486 RUSOFKNVSGXCCE-BYPYZUCNSA-N 184.944 -2.338 50 10 AAGE CC(C)[C@@H](CO)NC(=O)C#CB(O)O 2241471548 KFHDYVMUGJENJJ-SSDOTTSWSA-N 199.015 -1.865 50 10 AAGE CC[C@@H](NC(=O)C#CB(O)O)[C@@H](C)O 2241479512 ZNUCMCUFYJDPSY-RNFRBKRXSA-N 199.015 -1.723 50 10 AAGE NNC(=O)[C@@H]1C[C@@]12C[C@@H]2N 2241528251 HLBYSXOKOFNMOO-RVJQKOHUSA-N 141.174 -1.286 50 10 AAGE C#CC(=O)Nc1cc(B(O)O)ccn1 2241556518 YXGMQPMULTVTEQ-UHFFFAOYSA-N 189.967 -1.667 50 10 AAGE C[C@@](O)(NNC(N)=O)C(N)=O 39136044 QGWVPTGECXGCMZ-BYPYZUCNSA-N 162.149 -2.647 50 10 AAGE OC[C@@H](O)[C@@H](O)Cl 113142799 URWVQQSVEPXYET-PWNYCUMCSA-N 126.539 -1.103 50 10 AAGE [O-][n+]1cc(F)cc(B(O)O)c1 170001209 JOOHQVKRRAJIEC-UHFFFAOYSA-N 156.909 -1.861 50 10 AAGE O=C(O)[C@@H](CS)NCCB(O)O 196898563 ZJRRKMRJXGTIDU-SCSAIBSYSA-N 193.033 -1.568 50 10 AAGE O=[S@](CCO)[S@](=O)CCO 238680447 FEHVOPHHWSDWPK-UWVGGRQHSA-N 186.254 -1.617 50 10 AAGE N#C[C@H](O)Cn1ccc(=O)[nH]c1=O 238714217 WCQGVYVABYIEDR-YFKPBYRVSA-N 181.151 -1.579 50 10 AAGE C[C@H](CCC(=O)NN)CC(=O)NN 388597220 DFUWBAKRJQJKMC-RXMQYKEDSA-N 188.231 -1.227 50 10 AAGE COCC(COC)C(=O)NN 1880474700 OLNYNHFQHQWQOD-UHFFFAOYSA-N 162.189 -1.115 50 10 AAGE C#CCN=c1cc(B(O)O)c(F)c[nH]1 1892556437 CZJKGEHJGXCOGV-UHFFFAOYSA-N 193.974 -1.633 50 10 AAGE COC1(C(=O)NCC=CB(O)O)CC1 1892920181 PHGHWMJBWNNGJP-UHFFFAOYSA-N 199.015 -1.150 50 10 AAGE OB(O)c1cnccc1N1CCC1 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NNC(=O)[C@H]1C[C@H]1CN1CC(O)C1 885473206 QXOMOVSRUDJONO-FSPLSTOPSA-N 185.227 -1.711 50 10 AAGE CCc1ncc(B(O)O)[nH]1 1880029791 GZSCSYDYQOHPEB-UHFFFAOYSA-N 139.951 -1.348 50 10 AAGE NC(=S)NNC(=O)C1COC1 1880148671 ZJLOXYJJWHRLOP-UHFFFAOYSA-N 175.213 -1.503 50 10 AAGE NNC(=O)CN1C[C@H]2COC[C@@H]21 1881023989 YWKVTAYFHRXJSC-WDSKDSINSA-N 171.200 -1.693 50 10 AAGE O=C(F)N1CC2(C1)OC[C@@H](O)[C@@H]2O 1882778094 OPUVEFYHMBHIMW-UHNVWZDZSA-N 191.158 -1.118 50 10 AAGE CO[C@H](C)C(=O)NNCCO 1929830613 NQDUZOBMWLBJNR-RXMQYKEDSA-N 162.189 -1.366 50 10 AAGE COCCONC(=O)C#CB(O)O 2241468460 OURVYUPSPHDXCC-UHFFFAOYSA-N 186.960 -2.304 50 10 AAGE O=C(N1CCNCC1)C1(B(O)O)CC1 2241474109 WQLQZOOORVWLOV-UHFFFAOYSA-N 198.031 -1.575 50 10 AAGE CCCN(C)C(=O)C#CB(O)O 2241476745 YRKMKAVVDVJGRX-UHFFFAOYSA-N 168.989 -1.130 50 10 AAGE NNC(=O)N[C@H]1C=CS(=O)(=O)C1 40168030 DRLIMPVJADAGEU-BYPYZUCNSA-N 191.212 -1.530 50 10 AAGE CN(C)C(=O)COCC(=O)NN 58862260 LRYXXYXXTNXELB-UHFFFAOYSA-N 175.188 -1.919 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@@H](O)C1 216311149 NEXCQCLHJBHROB-NTSWFWBYSA-N 173.216 -1.569 50 10 AAGE CC(=O)NCCNNC(C)=O 219673619 QUJLVKWCNRNNFJ-UHFFFAOYSA-N 159.189 -1.237 50 10 AAGE OB(O)c1cncc(-n2cncn2)c1 238657583 FNBQGQDZGGCLEL-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE O=CC1=C[C@H](O)[C@@H](O)[C@@H](O)C1 238723608 UZGBQMZZECVISB-LYFYHCNISA-N 158.153 -1.402 50 10 AAGE C[C@@H]1C[C@H]1C(=O)NCC(=O)NN 306631746 OCRDTJRNEVCZNF-RFZPGFLSSA-N 171.200 -1.252 50 10 AAGE Cn1cncc1CNC(=O)C(=O)NN 307486835 VIPVYAATLYERRU-UHFFFAOYSA-N 197.198 -1.974 50 10 AAGE O=C[C@H](Cl)[C@H](O)[C@@H](O)[C@H](O)CO 307906593 RBEGMPAFDRYYIG-FSIIMWSLSA-N 198.602 -2.132 50 10 AAGE C[C@H](C(N)=O)[S@](=O)CC(=O)NN 526910989 ORTFNSRQCCFNOS-GJJZLTNQSA-N 193.228 -2.401 50 10 AAGE Cc1nccc(C(=O)NCB(O)O)n1 702030757 REVKLVOVVJFFDT-UHFFFAOYSA-N 194.987 -1.473 50 10 AAGE NNC(=O)CN1CC2(CC[C@@H]2O)C1 1882207676 JTANEIQYADDXTF-LURJTMIESA-N 185.227 -1.567 50 10 AAGE C[C@@H]1Cn2nc(B(O)O)cc2CO1 1887069612 HUDVVHBSBPDGMF-RXMQYKEDSA-N 181.988 -1.518 50 10 AAGE C[C@H](O)C(=O)N1CC[C@H](B(O)O)C1 1891516000 CNORMAZPEUYDBX-WDSKDSINSA-N 187.004 -1.558 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2C[C@@H](O)[C@H]2C1 1931412486 JEVUDIYIMUOKIR-VGRMVHKJSA-N 199.254 -1.323 50 10 AAGE C[C@@H](C(=O)NNCCO)N(C)C 1931436742 CIROFHWZOQEJKH-LURJTMIESA-N 175.232 -1.450 50 10 AAGE O=C(CCl)N1CC(O)(CO)C1 1953326314 LAQAFLSANKELEQ-UHFFFAOYSA-N 179.603 -1.209 50 10 AAGE C[C@@H](N)CNc1ncccc1B(O)O 2210068290 PKDKEAFCEBQBQY-ZCFIWIBFSA-N 195.031 -1.480 50 10 AAGE O=C(C#CB(O)O)N1CCOCC1 2241478320 CBZYUNAQEUKXTN-UHFFFAOYSA-N 182.972 -2.139 50 10 AAGE COC[C@H](N)C(=O)NN 88004449 NIKRDIJQAWZRTE-VKHMYHEASA-N 133.151 -2.050 50 10 AAGE C[C@@H](CO)C(=O)NN 200267386 KYDRUBOGWMQXPM-VKHMYHEASA-N 118.136 -1.395 50 10 AAGE CC[C@H](N)C(=O)N(C)[C@H](C)B(O)O 222268523 XLDOIPBSVVFRIC-RITPCOANSA-N 188.036 -1.417 50 10 AAGE NC[C@@H](O)C[C@H](N)CC(=O)NN 238625757 OYCSBHNCMBEVDU-WHFBIAKZSA-N 176.220 -2.597 50 10 AAGE O=CC1=C[C@@H](O)[C@H](O)CO1 238674554 SOWXNHCSGHGSDY-PHDIDXHHSA-N 144.126 -1.179 50 10 AAGE C[C@@H](C(=O)NN)N1CCC[C@H]1CO 251546624 LIKBWTYINCSSDW-BQBZGAKWSA-N 187.243 -1.179 50 10 AAGE CN(CCO)C1=C(C#N)C#CNN1 642849888 APOWFWQEMRLYCC-UHFFFAOYSA-N 178.195 -1.286 50 10 AAGE NNC(=O)[C@@H]1CCC[C@H](CO)O1 1877235850 IPWCREDYSCBYEH-RITPCOANSA-N 174.200 -1.094 50 10 AAGE C[C@@H]1C[C@]1(F)C(=O)NCC#CB(O)O 1905733276 UTYRQNAHSBFGCL-HTRCEHHLSA-N 198.990 -1.134 50 10 AAGE C[C@@H](CC(N)=O)N(C)C(=O)NN 1931395873 JGGYTOILRNXVFD-BYPYZUCNSA-N 174.204 -1.235 50 10 AAGE C[C@@H]1C[C@@H]1S(=O)(=O)NCB(O)O 1953599543 GXTHVNZRSJPVGS-UHNVWZDZSA-N 193.033 -1.674 50 10 AAGE NC(=O)NNC(=O)c1cc(O)ncn1 1956393839 PNPDQTBWWXZAEG-UHFFFAOYSA-N 197.154 -1.505 50 10 AAGE CCN(OC)c1ncncc1B(O)O 1956957911 VVGXAICDEFLMHD-UHFFFAOYSA-N 197.003 -1.456 50 10 AAGE NCC1CN(C(=O)C2(B(O)O)CC2)C1 2241473009 BKEBWEHFPMROIW-UHFFFAOYSA-N 198.031 -1.590 50 10 AAGE O=CNCc1ccccc1B(O)O 2241556504 YQDGDDKKUPOLQU-UHFFFAOYSA-N 178.984 -1.388 50 10 AAGE N[C@@H](CO)C(=O)OC(=O)[C@@H](N)CO 118188556 YXYFUYYLTGYWTL-IMJSIDKUSA-N 192.171 -3.305 50 10 AAGE C[C@@H](B(O)O)N1CC[C@@H](N)C1=O 195465388 LNNSDUKNRSVWPP-CRCLSJGQSA-N 171.993 -2.054 50 10 AAGE CCCCC(=O)NNC(=O)C(N)=O 196434090 MGUPIAHPOBCLRT-UHFFFAOYSA-N 187.199 -1.191 50 10 AAGE N#CCCNCc1ccc(B(O)O)o1 204075869 IQKWXNHPHARNCJ-UHFFFAOYSA-N 193.999 -1.037 50 10 AAGE CCCC(=O)N/N=C(/N)C(=O)NN 220099987 IUPUIPSVVHRJOQ-UHFFFAOYSA-N 187.203 -1.835 50 10 AAGE NNc1cc(S)ccc1B(O)O 306650340 HKJCXJNNVBFHDB-UHFFFAOYSA-N 184.029 -1.059 50 10 AAGE OB(O)c1c(O)ccc2nc[nH]c12 306701526 KYWOAKDMQRTAAN-UHFFFAOYSA-N 177.956 -1.052 50 10 AAGE NNC(=O)[C@H](O)C[C@@H](O)[C@H](O)CO 308123030 QUOAGKAVEJSDPQ-UOWFLXDJSA-N 194.187 -3.559 50 10 AAGE C[C@H]1CN(CC(=O)NN)C(=O)O1 606252030 HARKVSVOZMBKHK-BYPYZUCNSA-N 173.172 -1.183 50 10 AAGE COC(C)(C)Cn1cc(B(O)O)cn1 694530314 DEWPCOCJCVMOIM-UHFFFAOYSA-N 198.031 -1.012 50 10 AAGE O=C(C[C@@H]1CCOC1)NCB(O)O 701961286 UUEMAPUBZGHLEA-LURJTMIESA-N 187.004 -1.459 50 10 AAGE NNC(=O)NC[C@H]1CCO1 1880067321 UMQLSSOKCGRNPU-SCSAIBSYSA-N 145.162 -1.052 50 10 AAGE N[C@@]1(B(O)O)[C@H]2[C@H]3C[C@@H]1C[C@H]32 1880381904 CWEDDDLIAXZOMU-IBISWUOJSA-N 152.990 -1.018 50 10 AAGE C=C1C[C@@H]1C(=O)NCB(O)O 1890910662 HJKHHZJSDDUUJE-YFKPBYRVSA-N 154.962 -1.309 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2C[C@@]2(CO)C1 1899605582 KXBANBPEDVATIR-FJXKBIBVSA-N 199.254 -1.321 50 10 AAGE O=S(=O)(NCB(O)O)N1CCC1 1929939587 QTMKYYQAVBNROT-UHFFFAOYSA-N 194.021 -2.462 50 10 AAGE NNC(=O)[C@@H]1[C@H]2NCCO[C@@H]21 1929947284 UVEDMMJVATUIFM-UOWFLXDJSA-N 157.173 -2.037 50 10 AAGE NNC(=O)N1C[C@@H]2C[C@@H](O)[C@H]2C1 1931412679 KQDQPAHJLYZOEK-HCWXCVPCSA-N 171.200 -1.118 50 10 AAGE C[C@@H]1CC(=O)N1C(=O)[C@H]1C[C@H]1B(O)O 2241481098 OPAMEPGVUOXKRI-NGJCXOISSA-N 196.999 -1.003 50 10 AAGE OC[C@@H]1O[C@H](Cl)[C@H](O)[C@@H]1O 145672306 ZKHGIPARYPCVPA-RSJOWCBRSA-N 168.576 -1.336 50 10 AAGE NC[C@H](CO)SS(=O)(=O)O 238805515 SSJCFCJPNINAMV-GSVOUGTGSA-N 187.242 -1.158 50 10 AAGE NNC(=O)CN1CCOC[C@H](O)C1 307112967 AJDXHJJIUOWIES-ZCFIWIBFSA-N 189.215 -2.331 50 10 AAGE C[C@@H]1NC(=O)CC[C@@H]1NC(=O)NN 307599099 QIVUFWAYOOAIPO-WHFBIAKZSA-N 186.215 -1.174 50 10 AAGE CNNC(=O)Cn1cccnc1=O 704632665 TXCDPYWPSRYPPQ-UHFFFAOYSA-N 182.183 -1.506 50 10 AAGE CC(=O)NNC(=O)[C@H]1CCC(=O)NC1 1135818797 ZEHVQOZJTPHQCH-LURJTMIESA-N 199.210 -1.320 50 10 AAGE CN1CCOC[C@H]1CNC(=O)NN 1329052902 DEGWZYNAEAHQQC-ZCFIWIBFSA-N 188.231 -1.510 50 10 AAGE C[C@H](C(=O)NNCCO)N(C)C 1931436743 CIROFHWZOQEJKH-ZCFIWIBFSA-N 175.232 -1.450 50 10 AAGE NNC(=O)[C@H]1C[C@H]1C(N)=O 2241522864 NIEZPWIROXXJBA-GBXIJSLDSA-N 143.146 -1.902 50 10 AAGE C[C@@H](C(=O)NN)N(C)CCN(C)C 82544086 DFUSZRIQWBTRLC-ZETCQYMHSA-N 188.275 -1.142 50 10 AAGE C[C@@H]1OCC[C@@H]1NC(=O)C(=O)NN 157705134 FWOYXUVWLGUQNX-WHFBIAKZSA-N 187.199 -1.730 50 10 AAGE C[C@@H](CC(=O)NN)SCC(N)=O 300794697 ZOCVUAFZNXPMNW-BYPYZUCNSA-N 191.256 -1.027 50 10 AAGE CO[C@@H]1C[C@H]1C(=O)NCB(O)O 706475645 JIWLZYQYDVHRFS-RFZPGFLSSA-N 172.977 -1.851 50 10 AAGE O=C(NCB(O)O)C12CCN(CC1)C2 715870718 MRSKTJWFOYGNDB-UHFFFAOYSA-N 198.031 -1.790 50 10 AAGE COc1ncnc(B(O)O)c1C 1881461094 FSDYMVYAZDYJPQ-UHFFFAOYSA-N 167.961 -1.527 50 10 AAGE NNC(=O)CN1[C@H]2CC[C@@H](C2)[C@H]1CO 1885165603 CPUVLLRHMVTGNQ-BIIVOSGPSA-N 199.254 -1.179 50 10 AAGE C[C@@H](CN(C)C1COC1)C(=O)NN 1915652132 ZEYHYZOBAMFSCA-LURJTMIESA-N 187.243 -1.057 50 10 AAGE NNC(=O)N[C@@H]1CNC[C@@H]1F 1923843871 PQLKBZUFHYXESH-IUYQGCFVSA-N 162.168 -1.531 50 10 AAGE CON(C)CCC(=O)NN 1928677176 VKLCVKBFGNLOMB-UHFFFAOYSA-N 147.178 -1.140 50 10 AAGE NC1(B(O)O)C[C@@H]2COC[C@H]2C1 1934819159 CEXOZXBNTSHXNG-PHDIDXHHSA-N 171.005 -1.248 50 10 AAGE NNC(=O)N1CC2(CCC(=O)NC2)C1 2241350984 STZDIAULYUHLHH-UHFFFAOYSA-N 198.226 -1.218 50 10 AAGE C[C@H](NC(=O)C(=O)NN)C(N)=O 35797058 ULMYPVXZDJHATO-REOHCLBHSA-N 174.160 -3.034 50 10 AAGE NNC(=O)C(=O)NCCCCCO 58851006 HTVFOIRPKRKOMY-UHFFFAOYSA-N 189.215 -1.745 50 10 AAGE CC(=O)O[C@@H]1C(C=O)=CC(=O)[C@@H]1O 75576381 BAHPNTWLZYOEAX-JGVFFNPUSA-N 184.147 -1.013 50 10 AAGE NNC(=O)N1CC[C@@H](CO)C1 156848091 QZWLQPMFPYRVQI-RXMQYKEDSA-N 159.189 -1.116 50 10 AAGE NC(=O)Nc1ccc(B(O)O)cc1F 203611600 VSUQCLKLPHBNQS-UHFFFAOYSA-N 197.962 -1.004 50 10 AAGE N[C@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@@H](N)[C@@H]1Cl 306983190 SMAXJMCZRABISI-DZOCOKBZSA-N 196.634 -2.655 50 10 AAGE CC[C@@H](O)C(=O)NNC(C)=O 307293103 OMPNAOGNKYKAOB-RXMQYKEDSA-N 160.173 -1.075 50 10 AAGE COC(C)(C)C(=O)NNC(=O)CO 308480305 NAFGYGZVNKZRNF-UHFFFAOYSA-N 190.199 -1.449 50 10 AAGE NNC(=O)[C@H](N)Cc1cc[n+]([O-])cc1 687728482 GSYSQXDURZNISZ-SSDOTTSWSA-N 196.210 -1.820 50 10 AAGE NC(=O)NNC(=O)Cn1cccn1 700869618 ORMFAJNDDWNQRX-UHFFFAOYSA-N 183.171 -1.417 50 10 AAGE NNC(=O)C12COC(CO)(C1)C2 1881542560 WEZWRSSYNQXFHN-UHFFFAOYSA-N 172.184 -1.482 50 10 AAGE O=C(C#CB(O)O)N1CC[C@H](CO)C1 2241467847 BWAPEUXVZUOMMH-ZETCQYMHSA-N 196.999 -2.157 50 10 AAGE Cc1ccnc(C(N)=O)c1B(O)O 2241495936 OHWAMMUFINUBBD-UHFFFAOYSA-N 179.972 -1.831 50 10 AAGE C=C[C@H](NC(=O)C#CB(O)O)C(=O)O 2241585173 ZQBRHRDRCQPODU-YFKPBYRVSA-N 196.955 -2.243 50 10 AAGE CNC(=O)N(N)C[C@H](C)O 59631804 JPFGHPSGUPOOCH-BYPYZUCNSA-N 147.178 -1.118 50 10 AAGE CNCCN(C)[C@H](C)C(=O)NN 70534926 NZEWTPLOMBLMGC-ZCFIWIBFSA-N 174.248 -1.484 50 10 AAGE C[C@]1(O)NC(=O)OC1=O 100223056 NKKGGKDVSHPUMY-SCSAIBSYSA-N 131.087 -1.039 50 10 AAGE Nc1cc(B(O)O)cc(=O)[nH]1 206086574 PNBCIVUOPVFAPY-UHFFFAOYSA-N 153.934 -2.363 50 10 AAGE CC(=O)N[C@H](CN=C=O)C(=O)O 238138749 NGTVIWCYVMCYJF-RXMQYKEDSA-N 172.140 -1.089 50 10 AAGE C[C@H](O)[C@]1(O)C=C[C@@](O)(C#N)[C@@H]1O 238430553 HGQUNQCSXPPEAJ-RULNZFCNSA-N 185.179 -1.716 50 10 AAGE Nc1nc2ccc(B(O)O)cc2[nH]1 306655196 KIAZDCDQLPFHIX-UHFFFAOYSA-N 176.972 -1.175 50 10 AAGE O=C(CO)N/N=C1\C=C(O)CN1 306868026 QHSQEKQHYAGANE-UHFFFAOYSA-N 171.156 -1.547 50 10 AAGE C[C@H](C(=O)NN)N1CC(C)(O)C1 307628556 MIPWGMHQNJNJKP-RXMQYKEDSA-N 173.216 -1.569 50 10 AAGE CC(=O)NCCC(=O)N(C)N 704676784 WBJBUVMCCKHQOI-UHFFFAOYSA-N 159.189 -1.155 50 10 AAGE NNC(=O)CN1CCC2(COC2)C1 1915567967 MBEKXDMWXIIRQI-UHFFFAOYSA-N 185.227 -1.301 50 10 AAGE NNC(=O)[C@@H]1CO[C@@H]2COC[C@H]21 1953462391 ISGIFOWIXJXDBR-KVQBGUIXSA-N 172.184 -1.362 50 10 AAGE O=C(Nn1cnnc1)[C@H]1C[C@@H]1B(O)O 2241496251 QJPXXVLRSQTXRY-WHFBIAKZSA-N 195.975 -1.789 50 10 AAGE C=CC(=O)Nc1ncc(B(O)O)s1 2241554301 BNPSJKDLQHBYOB-UHFFFAOYSA-N 198.012 -1.053 50 10 AAGE CCOC[C@H](C)NC(=O)C(=O)NN 44682261 ULVIJFRKFVROJB-YFKPBYRVSA-N 189.215 -1.483 50 10 AAGE CCNCC(=O)NN 58848486 KYVJWDBLFYJOIZ-UHFFFAOYSA-N 117.152 -1.414 50 10 AAGE NNC(=O)[C@H](N)CCC(=O)O 82962594 HACMXPVQBHWNHX-GSVOUGTGSA-N 161.161 -1.832 50 10 AAGE C[C@]1(C(=O)NN)COC[C@H]1N 85395518 ZXLWCUAMVVTRKW-XINAWCOVSA-N 159.189 -1.660 50 10 AAGE N#C/C(N)=C(/C#N)N(N)C=N 204977688 ONRXFGZFQIYHPJ-AGRCOCRUSA-N 150.145 -1.013 50 10 AAGE CCNC(=O)NNC(=O)C1COC1 306499509 WEHSNEXIKBJJRQ-UHFFFAOYSA-N 187.199 -1.017 50 10 AAGE C=CCn1ccc(B(O)O)n1 575449461 LEBWSUSFJUGRLV-UHFFFAOYSA-N 151.962 -1.251 50 10 AAGE O=C(Cn1cccn1)NCB(O)O 701944851 PSKTWGKRYLQSPE-UHFFFAOYSA-N 182.976 -1.989 50 10 AAGE C[C@H](OCC1CN(C)C1)C(=O)NN 1886370072 HMVFZYXEUANMHW-LURJTMIESA-N 187.243 -1.057 50 10 AAGE NNC(=O)CN1C[C@H]2CC(O)C[C@@H]2C1 1886544659 WMRYMCAZJBXYAT-RNFRBKRXSA-N 199.254 -1.321 50 10 AAGE O=C(O)CCC(=O)NCB(O)O 1923804533 RPIXQBBHJSJOPT-UHFFFAOYSA-N 174.949 -2.021 50 10 AAGE COC[C@@H](N)CC(=O)NN(C)C 1929904746 KTTKDPMFMMVGAN-LURJTMIESA-N 175.232 -1.057 50 10 AAGE COCCOC[C@@H](N)[C@@H](O)C#N 1952813525 HVYRQEAOMOLDPP-RQJHMYQMSA-N 174.200 -1.139 50 10 AAGE NNC(=O)NCCCNC(N)=O 1953395473 NMNODDTYHMHQSK-UHFFFAOYSA-N 175.192 -1.782 50 10 AAGE C[C@@H](O)CNc1cc(B(O)O)ccn1 2210067934 IQOJVKQDZIJXJO-ZCFIWIBFSA-N 196.015 -1.446 50 10 AAGE C=CCNC(=O)c1cc(B(O)O)co1 2241754239 AGJJJMYCXRZJGR-UHFFFAOYSA-N 194.983 -1.125 50 10 AAGE NC(=O)NNC(=O)[C@H]1COCCO1 70044674 YIECCPHXJRNEMQ-SCSAIBSYSA-N 189.171 -1.899 50 10 AAGE NNC(=O)NC1CS(=O)(=O)C1 307594566 KIHNGHNDXRFKBW-UHFFFAOYSA-N 179.201 -2.044 50 10 AAGE CO[C@]1(CO)CCN(C(=O)NN)C1 402719260 MLWBSRGCVUNRGS-SSDOTTSWSA-N 189.215 -1.347 50 10 AAGE NNC(=O)[C@@H]1CNCC12CC2 715916374 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C[C@H]1C[C@@H](C(=O)NN)N1 1912826805 FHTYVNVTTSFCEX-IMJSIDKUSA-N 129.163 -1.273 50 10 AAGE NNC(=O)CN1CC[C@](F)(CO)C1 1917085907 BTFGCPWDRURYSP-SSDOTTSWSA-N 191.206 -1.617 50 10 AAGE C[C@@H]1C[C@@H](NC(=O)C#CB(O)O)CN1 2241467856 BZDKICVKWMEDET-RNFRBKRXSA-N 196.015 -2.132 50 10 AAGE CC(C)[C@H](N)CNC(=O)C#CB(O)O 2241468059 GQVOOSWWHKBYRW-SSDOTTSWSA-N 198.031 -1.899 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CCNC1 2241468602 RALNGMGAUOTXLI-ZCFIWIBFSA-N 181.988 -2.520 50 10 AAGE COCCNC(=O)C1(B(O)O)CC1 2241473284 HEKHYSVOUXEZHN-UHFFFAOYSA-N 187.004 -1.244 50 10 AAGE C[C@@H]1C[C@H]1N(C)C(=O)C#CB(O)O 2241476306 PIONYROGKCBWMW-RNFRBKRXSA-N 181.000 -1.131 50 10 AAGE C[C@H](CO)NC(=O)[C@H]1C[C@@H]1B(O)O 2241494842 DWGSWYSCSZFSJZ-SRQIZXRXSA-N 187.004 -1.654 50 10 AAGE C[C@@H](CC(=O)NN)N1CCNC1=O 2297013571 HJQLRZNUVKMLEB-YFKPBYRVSA-N 186.215 -1.220 50 10 AAGE NC(=S)NNC(=O)CCC(=O)O 34742742 MNTQHWFTTFFRTK-UHFFFAOYSA-N 191.212 -1.284 50 10 AAGE N#CC1=C[C@H](O)[C@H](O)[C@H](O)[C@@H]1O 140874791 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2241623951 GCQATIZYXMQZSL-ZCFIWIBFSA-N 172.184 -1.359 50 10 AAGE CS(=O)(=O)C1CC(C(=O)NN)C1 2241659432 KTACNMYCVGEWKU-UHFFFAOYSA-N 192.240 -1.201 50 10 AAGE NNC(=O)C(=O)N[C@H]1C[C@H]2CO[C@H]1C2 2241842695 OGGZNJVLSIGIRU-SRQIZXRXSA-N 199.210 -1.730 50 10 AAGE CCC(=O)NN/C(N)=C/C(=O)OC 209854934 LKVOTZBDQVJWIU-SNAWJCMRSA-N 187.199 -1.010 50 10 AAGE C[C@@]1(O)CCN(CCC(=O)NN)C1 235415923 YAAVXIZTNJNGTP-MRVPVSSYSA-N 187.243 -1.177 50 10 AAGE C#CC(=O)NN(C)C(N)=O 306669384 GVXAORQBPSDJFH-UHFFFAOYSA-N 141.130 -1.339 50 10 AAGE C/C(=N/NC(N)=O)[C@@](C)(N)CO 306958962 WQVAKYYVYQOMPV-WGFXVOQCSA-N 174.204 -1.260 50 10 AAGE CC(=O)NNC(=O)[C@H]1C[C@@H]1[N+](=O)[O-] 307527191 SANBGVJOTCUXSG-WHFBIAKZSA-N 187.155 -1.181 50 10 AAGE C[C@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)C#N 308204627 HABJMIHBEMYZOB-REQIZBSHSA-N 191.183 -2.666 50 10 AAGE CC(C)C(=O)NNC(=O)NCCO 308284990 YMZVDFNSICBHFU-UHFFFAOYSA-N 189.215 -1.035 50 10 AAGE CNNC(=O)[C@H]1CNC(=O)C1 575560438 WQZNVAAJABEOFG-SCSAIBSYSA-N 157.173 -1.627 50 10 AAGE C[C@@H](Cn1ccnn1)C(=O)NN 710718726 GWTCOQSJDXMOQF-YFKPBYRVSA-N 169.188 -1.096 50 10 AAGE C[C@@H](O)[C@H]1CCN1CCC(=O)NN 1882399718 ALMLHOQVNGVIBK-RNFRBKRXSA-N 187.243 -1.179 50 10 AAGE CN1C[C@@H](N(C)C(=O)NN)CC1=O 1882878107 ZQEQRPASIOMBGQ-YFKPBYRVSA-N 186.215 -1.268 50 10 AAGE NNC(=O)CN1CC2(CC(CO)C2)C1 1886845860 ZNULEGZVXSWAOF-UHFFFAOYSA-N 199.254 -1.319 50 10 AAGE CC(C)NNC(=O)COCCN 1923697096 ZGGQXIRWFFEVGS-UHFFFAOYSA-N 175.232 -1.009 50 10 AAGE CC(CO)(CO)[C@H](N)[C@@H](O)C#N 1952957668 BJZLFOGGHJXWFP-NTSWFWBYSA-N 174.200 -1.811 50 10 AAGE OB(O)c1ccn(CCC2COC2)n1 1955561940 ICFBIBWSQUTAHN-UHFFFAOYSA-N 196.015 -1.401 50 10 AAGE OB(O)c1cncnc1-n1cccn1 1956965917 NEYSCIOLUQJPIT-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE O=C(C#CB(O)O)NC1CCC1 2241468424 NZHLMXDQSDEKPY-UHFFFAOYSA-N 166.973 -1.330 50 10 AAGE N#CNCC=CB(O)O 2241555405 LUJGRZABPPKFHR-UHFFFAOYSA-N 125.924 -1.375 50 10 AAGE CC[C@@H](NC(=O)C#CB(O)O)C(=O)O 2241583887 GCFKKMATZFXDCC-RXMQYKEDSA-N 198.971 -2.019 50 10 AAGE 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N#Cc1cc(NN)ccc1B(O)O 307134048 ZFKJGJVMBIIRAJ-UHFFFAOYSA-N 176.972 -1.476 50 10 AAGE C[C@H](C(=O)NNC=O)n1cncn1 307510208 KLSAPBPBGLPIGE-RXMQYKEDSA-N 183.171 -1.384 50 10 AAGE C[C@H](O)[C@H](CO)[C@H](O)C(=O)NN 379321105 ZTHFBXFHFIHONJ-YUPRTTJUSA-N 178.188 -2.674 50 10 AAGE O=C1COc2c(cncc2B(O)O)N1 687827856 ZXSVAJNNSPXRGC-UHFFFAOYSA-N 193.955 -1.908 50 10 AAGE CNNC(=O)Cn1cncn1 707623727 TZSXZXYCFMAQTK-UHFFFAOYSA-N 155.161 -1.471 50 10 AAGE C[C@H]1[C@H](O)CN1CCC(=O)NN 1880906879 JSRZSEQAETTZNX-NTSWFWBYSA-N 173.216 -1.569 50 10 AAGE NNC(=O)CN1C[C@@H]2COC[C@@H]21 1881023988 YWKVTAYFHRXJSC-RITPCOANSA-N 171.200 -1.693 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@@H]2[C@H]2C[C@@H]21 1957163965 BGWUCMROBGRUTP-YTLHQDLWSA-N 195.222 -1.157 50 10 AAGE O=C(CO)N1CCC(B(O)O)CC1 2208629340 NNJUFTYIEKESNS-UHFFFAOYSA-N 187.004 -1.556 50 10 AAGE N[C@H]1C[C@@H]1Nc1ncc(B(O)O)cn1 2210068029 KIVPPRXNFYQTMW-WDSKDSINSA-N 194.003 -2.332 50 10 AAGE O=C(C#CB(O)O)N=c1ccs[nH]1 2241468712 SXHNDVRJUPZAAZ-UHFFFAOYSA-N 195.996 -1.481 50 10 AAGE O=C(C#CB(O)O)NCc1cc[nH]c1 2241475957 IXYBJQRWFYGMDD-UHFFFAOYSA-N 191.983 -1.354 50 10 AAGE C#C[C@H](CO)NC(=O)C#CB(O)O 2241478933 NWLGNFIAQGBUIP-ZCFIWIBFSA-N 180.956 -2.888 50 10 AAGE CN(C)C(=O)c1nccnc1B(O)O 2241501832 AVRLTGKINDFXRE-UHFFFAOYSA-N 194.987 -2.142 50 10 AAGE C[C@H](CF)N(C)C(=O)C#CB(O)O 2241731054 SUCFBAJPURFQBJ-ZCFIWIBFSA-N 186.979 -1.182 50 10 AAGE NNC(=O)CN1CCn2cncc2C1 2241848656 ICFQEITZUBAUAD-UHFFFAOYSA-N 195.226 -1.311 50 10 AAGE O=C(NCCO[N+](=O)[O-])N[N+](=O)[O-] 5410765 BFGCTTNIBFQFKS-UHFFFAOYSA-N 194.103 -1.314 50 10 AAGE CCOC(=O)N/N=C(/N)C(N)=O 238265632 DFIQUGUEHUIGOA-UHFFFAOYSA-N 174.160 -1.510 50 10 AAGE NNC(=O)[C@@H]1CCC[C@@H]1NC(N)=O 238554743 XBWHVEXADAFBAO-UHNVWZDZSA-N 186.215 -1.187 50 10 AAGE O=Cc1c(B(O)O)ccc2c1OCO2 238648006 QLDNCTODULSHKU-UHFFFAOYSA-N 193.951 -1.092 50 10 AAGE CC(=O)NN[C@@H](C)c1nnnn1C 307749100 FIDCVFBJSAUOQY-BYPYZUCNSA-N 184.203 -1.088 50 10 AAGE N[C@@H]1N[C@H](Cl)[C@@H]2CCN[C@@H]2N1 585665128 ODARHCRZUCREHU-UNTFVMJOSA-N 176.651 -1.078 50 10 AAGE CN(CC(=O)NN)C1(CCO)CC1 1882993067 PVINSHNKSLLLBH-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H](O)C1(C)C 1883986153 CSGNRMGYGRHISF-PHDIDXHHSA-N 187.243 -1.180 50 10 AAGE Cn1[nH]nnc1=NCB(O)O 1923941435 FOAHYWHLLDJICB-UHFFFAOYSA-N 156.942 -2.944 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@H]1N 1953341027 BIGLEQAHRSWBKH-KVTDHHQDSA-N 155.201 -1.040 50 10 AAGE OB(O)c1cncnc1OC1CC1 1954086870 XUTOQVKUOCRQFM-UHFFFAOYSA-N 179.972 -1.302 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2C[C@@H](O)[C@H]1C2 2297052248 PNAKZEPMSADYTR-RULNZFCNSA-N 199.254 -1.180 50 10 AAGE NNC(=O)[C@H]1CCC[C@]1(O)NN 104534609 VKNSZBFOQLMJBT-INEUFUBQSA-N 174.204 -2.072 50 10 AAGE NNC(=O)c1cc[n+]([O-])c(NN)c1 104540050 GHEZQIMTNZJFQE-UHFFFAOYSA-N 183.171 -1.791 50 10 AAGE C[C@H](ON)C(=O)NN 139842341 SLBIDTMQFDOOIP-REOHCLBHSA-N 119.124 -1.745 50 10 AAGE NNC(=O)C(=O)NCCc1ncno1 231840921 YWAAVRPPWXSFCZ-UHFFFAOYSA-N 199.170 -2.282 50 10 AAGE Cc1c[nH]c2ncnc(B(O)O)c12 238557927 SYMPTXBPUDXWML-UHFFFAOYSA-N 176.972 -1.054 50 10 AAGE NCc1ncccc1B(O)O 238612002 DSXFHULFXQIASQ-UHFFFAOYSA-N 151.962 -1.780 50 10 AAGE NNC(=O)[C@@]12CNC[C@H]1C2 575516992 HBPQTVARXZRSFG-XINAWCOVSA-N 141.174 -1.414 50 10 AAGE NNC(=O)CN1CC[C@@H]2[C@@H](O)C[C@@H]21 1877531469 SYHZDOQUWLCXSJ-ACZMJKKPSA-N 185.227 -1.569 50 10 AAGE NNC(=O)C1(N)CC(CO)C1 1880403424 SKBRIXINMUHBAQ-UHFFFAOYSA-N 159.189 -1.924 50 10 AAGE O=C(O)COc1ccc(B(O)O)cn1 1885834193 RZFSCMJUZRGSRX-UHFFFAOYSA-N 196.955 -1.775 50 10 AAGE NNC(=O)C(=O)N[C@@H]1CO[C@H]2C[C@@H]1C2 1886080138 RJFVEAQBQDUUHO-NGJCXOISSA-N 199.210 -1.730 50 10 AAGE O=C(NCC#CB(O)O)[C@@H]1[C@H]2CC[C@H]21 1895048675 CFQIPNNGDVHHTC-JIGDXULJSA-N 193.011 -1.226 50 10 AAGE CC(C)NNC(=O)C[C@H](O)CN 1923696060 JTFOSMZDYXYFDE-LURJTMIESA-N 175.232 -1.275 50 10 AAGE CC(C)(C(N)=O)C(=O)NNC=O 1923704671 UFJFPTCPGJLRNS-UHFFFAOYSA-N 173.172 -1.725 50 10 AAGE Cn1nncc1C(=O)NNC=O 1923931035 DRLYEZGZASYYLN-UHFFFAOYSA-N 169.144 -1.794 50 10 AAGE O=C(NO)c1cccc(F)c1B(O)O 2241583732 CITNXVORPBPCDD-UHFFFAOYSA-N 198.946 -1.376 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]2OCC[C@@H]2N1 2297076159 CZRFVWNMIYHWRJ-ZLUOBGJFSA-N 171.200 -1.504 50 10 AAGE CN1CC(C#N)=C(NCC(=O)O)C1=O 38276466 BIXUHCMGWQTBTJ-UHFFFAOYSA-N 195.178 -1.090 50 10 AAGE NNC(=O)C[C@@H]1CCC(=O)N1 39136630 VZLUTRWHGLKDKD-BYPYZUCNSA-N 157.173 -1.355 50 10 AAGE NNC(=O)CN(CCO)CCO 58853902 CZYXTOBCLQDGSO-UHFFFAOYSA-N 177.204 -2.737 50 10 AAGE COCCCN(C)C(=O)C(=O)NN 62028918 DTCXZCCPCFMCOH-UHFFFAOYSA-N 189.215 -1.529 50 10 AAGE O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CCl 100469171 ZHVNVPHMOCWHHO-JGWLITMVSA-N 198.602 -2.132 50 10 AAGE NC(N)=NCCC[C@H](N)B(O)O 170000226 ACTXPNAHMKBUTO-BYPYZUCNSA-N 174.013 -2.621 50 10 AAGE in-vitro N/N=C/C(=O)NCC(=O)NN 223546027 SIPBJLOWTZHQNU-KRXBUXKQSA-N 159.149 -2.963 50 10 AAGE CC(=O)c1cc(B(O)O)cc(C=O)n1 238126691 ULWLXUWQTTWTIZ-UHFFFAOYSA-N 192.967 -1.224 50 10 AAGE CCOC(=O)CNNC(N)=O 238289154 ABKMLVDMNYJFES-UHFFFAOYSA-N 161.161 -1.278 50 10 AAGE COc1c(C#N)cncc1B(O)O 238345370 JGCLRGZUXMCKNC-UHFFFAOYSA-N 177.956 -1.358 50 10 AAGE Cn1nnnc1CNC(=O)NN 306829983 KPHRLGKQUHMFNU-UHFFFAOYSA-N 171.164 -2.117 50 10 AAGE N#Cc1cccc(B(O)O)c1NN 306909476 GXJNEJVVRDVCQI-UHFFFAOYSA-N 176.972 -1.476 50 10 AAGE O=C1CN=C2N[C@@H](Cl)NC[C@H]2N1 605700472 ZHDXVJCBZUMXAE-CVYQJGLWSA-N 188.618 -1.402 50 10 AAGE CN(C)NC(=O)[C@@H](N)CCO 1880390312 MSALJBOIBPGSOF-YFKPBYRVSA-N 161.205 -1.711 50 10 AAGE COC[C@@H]1CC[C@@]1(N)B(O)O 1880543792 QOZRMMFTVCQZND-WDSKDSINSA-N 158.994 -1.248 50 10 AAGE CN1CCO[C@@H](C(=O)N(C)N)C1 1881070241 XOEZKILHEMCILL-ZCFIWIBFSA-N 173.216 -1.351 50 10 AAGE O=c1ccc(B(O)O)cn1CCCF 1885133314 UTSCUGUKMAIQIP-UHFFFAOYSA-N 198.990 -1.112 50 10 AAGE C=C[C@]1(O)CCN([C@H](C)C(=O)NN)C1 1891927124 OHEAJPDAUAUIMZ-APPZFPTMSA-N 199.254 -1.012 50 10 AAGE CC(=O)NNC(=O)C=CC(=O)O 1912030926 PIXVUXJXPDOTRO-UHFFFAOYSA-N 172.140 -1.206 50 10 AAGE CN(C(=O)NN)[C@H]1CCNC1=O 1916836692 DPAPVRHTWFPQAH-BYPYZUCNSA-N 172.188 -1.610 50 10 AAGE CO[C@@H](CN)C(=O)NNC(C)C 1923858408 RIPDYEVZHXBWTJ-LURJTMIESA-N 175.232 -1.011 50 10 AAGE C[C@H]1[C@@H](C)[C@@H]1CNC(=O)C(=O)NN 1954567691 OPKYKNGRHPQRKE-FMCRUOTFSA-N 185.227 -1.006 50 10 AAGE CON(C)C(=O)c1ccoc1B(O)O 2241468885 WKFGLZXUOXRMOK-UHFFFAOYSA-N 198.971 -1.407 50 10 AAGE CC[C@@H](O)[C@@H](C)NC(=O)C#CB(O)O 2241478554 HVVMPLUNHPIPJO-RNFRBKRXSA-N 199.015 -1.723 50 10 AAGE C#CCONC(=O)[C@H]1C[C@@H](B(O)O)C1 2241481454 VBDMGANZYCIZPX-KNVOCYPGSA-N 196.999 -1.080 50 10 AAGE O=C(NCB(O)O)c1cc(=O)cc[nH]1 2241651837 KILGOYAWGPPOBN-UHFFFAOYSA-N 195.971 -1.883 50 10 AAGE NNC(=O)CSc1ncn[nH]1 5649245 DWFDSKPYRBJWSD-UHFFFAOYSA-N 173.201 -1.113 50 10 AAGE NNC(=O)NCCCC(N)=O 37660822 TULBFSXFYOHESU-UHFFFAOYSA-N 160.177 -1.575 50 10 AAGE Cc1c(B(O)O)ccnc1N 203713192 VWSKBYUAPKHEIV-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE Cc1nc2ncc(B(O)O)cc2n1C 238511128 ZMDZFIKLISBSAP-UHFFFAOYSA-N 190.999 -1.043 50 10 AAGE NNC(=O)[C@H]1CCC[C@@H]1NC(N)=O 238556524 XBWHVEXADAFBAO-WHFBIAKZSA-N 186.215 -1.187 50 10 AAGE O=C(CO)[C@H](O)[C@@H](O)[C@@H](O)CCl 238688221 GKKJMTUOJYXAJQ-FUTKDDECSA-N 198.602 -2.131 50 10 AAGE CC[C@H](NNC(C)=O)C(N)=O 307667143 GHVDCBUBCXDLCE-YFKPBYRVSA-N 159.189 -1.109 50 10 AAGE CCCN(CC(N)=O)C(=O)NN 307962090 MVDQZWLXKZHPQJ-UHFFFAOYSA-N 174.204 -1.233 50 10 AAGE NNC(=O)C[C@H](O)[C@@H](O)[C@@H](O)CO 381898521 BECUBMLLHUYFKV-RVJQKOHUSA-N 194.187 -3.559 50 10 AAGE NNC(=O)C(=O)NCc1cnoc1 719373848 SWVCMUXTMJOFDN-UHFFFAOYSA-N 184.155 -1.719 50 10 AAGE C[C@H](C(N)=O)[N+]1=C=C(C=O)NN1 885297029 NZWQFLRBHLRQRG-SCSAIBSYSA-O 169.164 -2.352 50 10 AAGE NNC(=O)C(=O)NC[C-]1C#CON1 885449226 XSPYBQYAEWTXCT-UHFFFAOYSA-N 183.147 -2.880 50 10 AAGE CN1C[C@@H]2C[C@H](C1)N2CC(=O)NN 1882777133 AFAXMCRGTROWHN-KNVOCYPGSA-N 184.243 -1.635 50 10 AAGE NNC(=O)CN1C[C@H](O)C2(CC2)C1 1930234905 DAOGUDVKZNWRTH-LURJTMIESA-N 185.227 -1.567 50 10 AAGE C[C@]12C[C@@H]1C(=O)N(CC(=O)NN)C2=O 1932149352 ZVEOESPSHRFNDY-VHWMUFPASA-N 197.194 -1.629 50 10 AAGE CC(C)CN(CCO)CC(=O)NN 1933488691 RJPQTHFYOSTBHQ-UHFFFAOYSA-N 189.259 -1.073 50 10 AAGE NC1(B(O)O)[C@@H]2C[C@@H]2[C@H]2C[C@H]21 1953209794 LNPWIKUUMQXSBT-KVTDHHQDSA-N 152.990 -1.018 50 10 AAGE CC1(C#N)CN(CC(=O)NN)C1 1953695785 QUBDVMICRNBQSF-UHFFFAOYSA-N 168.200 -1.178 50 10 AAGE C#CCC1(C(=O)NCB(O)O)CC1 1953973311 ZNINMSCWZVGXLL-UHFFFAOYSA-N 181.000 -1.082 50 10 AAGE C[C@@H]1[C@@H](O)CN1C(=O)C#CB(O)O 2241468940 XJZPGGSZTKWZNK-RITPCOANSA-N 182.972 -2.407 50 10 AAGE C#C[C@H](NC(=O)C#CB(O)O)C(C)C 2241478560 HXNVXDMLHFIVGW-QMMMGPOBSA-N 193.011 -1.224 50 10 AAGE COC(=O)C(=O)NNC(C)=O 144516675 IVWJNDCZRWPJSN-UHFFFAOYSA-N 160.129 -1.673 50 10 AAGE O=C(O)c1csc(B(O)O)n1 209834093 WTPKCUYRBBGOQH-UHFFFAOYSA-N 172.958 -1.479 50 10 AAGE N#Cc1ccnc(C=O)c1B(O)O 238612361 GEWIMSVQSUOFHX-UHFFFAOYSA-N 175.940 -1.554 50 10 AAGE CCOC(=O)c1ccc(B(O)O)cn1 299890103 UHNIQBRTPICZAB-UHFFFAOYSA-N 194.983 -1.062 50 10 AAGE CCC1(O)CN(CC(=O)NN)C1 306680398 KOAVLLJRLLFOBG-UHFFFAOYSA-N 173.216 -1.567 50 10 AAGE CN(C)NC(=O)[C@H]1CCC(=O)N1 307470620 OOSCVHQCISTVJJ-RXMQYKEDSA-N 171.200 -1.142 50 10 AAGE C/C(=C\C(=O)N1CCOCC1)B(O)O 307553352 RCBZARWEKIOWEW-VOTSOKGWSA-N 199.015 -1.197 50 10 AAGE O=C1CN=C2N[C@H](Cl)NC[C@@H]2N1 605700471 ZHDXVJCBZUMXAE-BBIVZNJYSA-N 188.618 -1.402 50 10 AAGE O=C(O)CCCC(=O)NNCCO 1929833246 GPKHCXXGNQKIKL-UHFFFAOYSA-N 190.199 -1.146 50 10 AAGE C[C@@]12C[C@H]1C(=O)N(CC(=O)NN)C2=O 1932149350 ZVEOESPSHRFNDY-RNHFCUEFSA-N 197.194 -1.629 50 10 AAGE COC1CN(S(=O)(=O)N=C=O)C1 1953548120 KHWWRDZUISMREU-UHFFFAOYSA-N 192.196 -1.102 50 10 AAGE NNC(=O)CN1CCC12CC(CO)C2 1955550756 JRERWIHVYOHGNK-UHFFFAOYSA-N 199.254 -1.177 50 10 AAGE C#CCONC(=O)[C@H]1C[C@H](B(O)O)C1 2241481738 VBDMGANZYCIZPX-LJGSYFOKSA-N 196.999 -1.080 50 10 AAGE NC(=O)NC(=O)[C@H]1C[C@@H](B(O)O)C1 2241584727 SFCHHTLESKYRFO-ZXZARUISSA-N 185.976 -1.566 50 10 AAGE C[C@H](C(=O)NN)[C@@H](C)N(C)CCO 86313486 GOZVTAMBCBATKQ-NKWVEPMBSA-N 189.259 -1.075 50 10 AAGE O=C1NCCC[C@H]1B(O)O 306484472 RUEQFXULAFJAIS-SCSAIBSYSA-N 142.951 -1.261 50 10 AAGE CNC(=O)NCCNC(=O)NN 306894804 ZJAYSZPORNYLME-UHFFFAOYSA-N 175.192 -1.912 50 10 AAGE C[C@H]1OCCN(C)[C@@H]1C(=O)NN 306897264 SLDBWMIUYSRMGF-RITPCOANSA-N 173.216 -1.305 50 10 AAGE C[C@H]1CN(CC(=O)NN)C[C@H]1O 307323733 HDRDSKKVTLFGJE-NTSWFWBYSA-N 173.216 -1.711 50 10 AAGE C[C@@H](CC(=O)NN)N1CC(C)(O)C1 307569667 XQCQVSFYRFYIAS-LURJTMIESA-N 187.243 -1.179 50 10 AAGE CO[C@H]1CNC[C@@H]1C(=O)NN 575481101 MOGDDHYGLTVQTO-WHFBIAKZSA-N 159.189 -1.789 50 10 AAGE C[C@@H]1C[C@]1(C)NC(=O)C(=O)NN 606252652 SJZSAVIJYZGZIY-FBCQKBJTSA-N 171.200 -1.109 50 10 AAGE NNC(=O)N1CCC[C@H]1[C@@H](O)CO 1882226065 IDQHLZWMBOXODD-WDSKDSINSA-N 189.215 -1.613 50 10 AAGE C#C[C@H](C)NC(=O)NNC(N)=O 1923754171 PJBJWSPUWWSXKV-BYPYZUCNSA-N 170.172 -1.109 50 10 AAGE NNC(=O)[C@H]1[C@@H]2OCCN[C@@H]21 1929947285 UVEDMMJVATUIFM-WDCZJNDASA-N 157.173 -2.037 50 10 AAGE NNC(=O)N1CCOC[C@H](CO)C1 1933580981 IHQCNKHASZSJHY-LURJTMIESA-N 189.215 -1.490 50 10 AAGE C[C@H]([C@](C)(N)B(O)O)S(C)(=O)=O 1953677423 DMCXRBWAHFSECF-UHNVWZDZSA-N 195.049 -1.851 50 10 AAGE OB(O)c1cnc(N[C@H]2C[C@H]2F)nc1 2210061197 RHYRHGMTIPTRGS-RITPCOANSA-N 196.978 -1.321 50 10 AAGE C[C@@H](O)CNC(=O)C#CB(O)O 2241468752 UHXZIKGWDHBYOY-RXMQYKEDSA-N 170.961 -2.501 50 10 AAGE O=C(C#CB(O)O)N1CC2(CCN2)C1 2241478280 BIJKRUVEFABKEP-UHFFFAOYSA-N 193.999 -2.424 50 10 AAGE NNC(=O)N1CCNC(=O)C1 34977826 XAPTUEYQHYHDJQ-UHFFFAOYSA-N 158.161 -1.999 50 10 AAGE NNC(=O)[C@H]1CCN1 306923575 GCIMDKXYEVELJK-GSVOUGTGSA-N 115.136 -1.662 50 10 AAGE [C-]#[N+]C1=C[C@@H](O)[C@@](O)([C@@H](C)O)[C@@H]1O 306931155 DIACYUPTLLZTEL-JBBNEOJLSA-N 185.179 -1.363 50 10 AAGE OCCOc1ccc(B(O)O)cn1 308206918 UFFYMPGYAYCUBU-UHFFFAOYSA-N 182.972 -1.868 50 10 AAGE O=S(=O)(CC1CC1)NCB(O)O 701939631 NTNPQHRQDZWFKQ-UHFFFAOYSA-N 193.033 -1.672 50 10 AAGE CC1(C)OCCO[C@@H]1[C@@H](N)B(O)O 1883672831 MWETZRGQKQJTGG-PHDIDXHHSA-N 189.020 -1.480 50 10 AAGE C[C@]12CO[C@](C(=O)NCB(O)O)(C1)C2 1904541917 ZONTYRGTVOTCPQ-OCAPTIKFSA-N 199.015 -1.316 50 10 AAGE C[C@@H](CNC(=O)C(=O)NN)C(F)F 1922255380 VJUJAYJJIPUBKH-VKHMYHEASA-N 195.169 -1.006 50 10 AAGE NC(=O)NNC(=O)[C@@H]1[C@@H]2CCOC[C@H]21 1930432826 JTKACLGAMGZCHW-HSUXUTPPSA-N 199.210 -1.032 50 10 AAGE NNC(=O)C(=O)N[C@H]1CCC[C@H]1F 1954272292 SFXAEUCGPHYFBU-UHNVWZDZSA-N 189.190 -1.017 50 10 AAGE NNC(=O)C(=O)NC1[C@@H]2C[C@@H]2[C@H]2C[C@@H]12 1954995164 MQLPPWDJSSFDMB-KVTDHHQDSA-N 195.222 -1.253 50 10 AAGE NOCCNc1ncccc1B(O)O 2210060474 KUAGPPHVSOMBEO-UHFFFAOYSA-N 197.003 -1.936 50 10 AAGE O=C(NC1(CO)CC1)[C@H]1C[C@@H]1B(O)O 2241479774 FKGNUOBNGVYAFU-WDSKDSINSA-N 199.015 -1.510 50 10 AAGE CNC(=O)[C@H]1C[C@@H]1B(O)O 2241495221 HPBNRSFGDORTPK-IMJSIDKUSA-N 142.951 -1.405 50 10 AAGE C[C@@H](C(=O)NN)N(C)CC1COC1 2241662476 SDBNLXAHHFOGON-LURJTMIESA-N 187.243 -1.057 50 10 AAGE CON(CC1CC1)C(=O)C(=O)NN 2242167923 HSNXCGXIGPXOJZ-UHFFFAOYSA-N 187.199 -1.224 50 10 AAGE CC[C@@]1(NC(=O)NN)CCNC1=O 2242179395 AKEVVPFRJVBODD-SSDOTTSWSA-N 186.215 -1.172 50 10 AAGE NNC(=O)[C@H]1CCC[C@@]1(O)NN 104534595 VKNSZBFOQLMJBT-XINAWCOVSA-N 174.204 -2.072 50 10 AAGE Cc1nc(N)cc(B(O)O)n1 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COC(=O)[C@H](C)NC(=O)C#CB(O)O 2241471940 NPFWJPSXHCGUAA-YFKPBYRVSA-N 198.971 -2.321 50 10 AAGE COC1CN(C(=O)C#CB(O)O)C1 2241478761 LBWBXCDRWFRSGE-UHFFFAOYSA-N 182.972 -2.141 50 10 AAGE NNC(=O)CNc1nc(N)n[nH]1 6261686 UXIRWCKCZMERIH-UHFFFAOYSA-N 171.164 -2.211 50 10 AAGE C[C@H](NC=O)C(=O)NN 104697424 MLLSMVRWAJMIHJ-VKHMYHEASA-N 131.135 -1.889 50 10 AAGE NC(=O)[C@H](O)CNC(=O)CCl 228653162 LQEYKWXVXGSXOB-GSVOUGTGSA-N 180.591 -1.812 50 10 AAGE Nc1ccnc(N)c1B(O)O 238658970 YBYDITVHJNJRKV-UHFFFAOYSA-N 152.950 -2.074 50 10 AAGE CC(=O)N/N=C1/C(=O)NN=C1C 306410915 MKDNNQRIQYJANG-UHFFFAOYSA-N 168.156 -1.016 50 10 AAGE N#C[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)CO 307933522 GQXJZINGMGHWDU-ZXXMMSQZSA-N 177.156 -3.054 50 10 AAGE NC(=O)Nc1ccc(B(O)O)c(F)c1 405192050 XQYJUKWFAKSPCM-UHFFFAOYSA-N 197.962 -1.004 50 10 AAGE NC[C@@H]1CCO[C@H]1C(=O)NN 715316204 JCDHDJORYFDRFN-CRCLSJGQSA-N 159.189 -1.660 50 10 AAGE NNC(=O)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]21 1881744687 GOBIAPBVRRWQEW-LMVFSUKVSA-N 185.183 -2.120 50 10 AAGE CN(CCF)CCOCC(=O)NN 1917259408 NMNIYOGIWKWMLI-UHFFFAOYSA-N 193.222 -1.106 50 10 AAGE OB(O)CNCc1cnccn1 1923810782 OSPMOQQHBZIEFN-UHFFFAOYSA-N 166.977 -1.422 50 10 AAGE C[C@@](N)(CCS(C)(=O)=O)B(O)O 1953514613 IKKYFMDEMYJAON-RXMQYKEDSA-N 195.049 -1.850 50 10 AAGE C#C[C@@H](NC(=O)C#CB(O)O)C(C)C 2241468126 HXNVXDMLHFIVGW-MRVPVSSYSA-N 193.011 -1.224 50 10 AAGE CCn1cc(B(O)O)c(C(=O)NC)n1 2241495899 ODCKKTHSBIAPGX-UHFFFAOYSA-N 197.003 -2.058 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@H]2[C@@H]1C[C@H]2O 2297079452 IWIULTLLYMMMAN-DKXJUACHSA-N 199.254 -1.180 50 10 AAGE C[C@H](O)CN(C)[C@@H](C)C(=O)NN 82471099 KYVCTRUMZLPWRG-WDSKDSINSA-N 175.232 -1.323 50 10 AAGE CN1C[C@H](NC(=O)NN)CCC1=O 82757284 HFCWIVJMUCONLB-RXMQYKEDSA-N 186.215 -1.220 50 10 AAGE CN(C)NC(=O)[C@]1(C)COC[C@@H]1N 147287103 MDEAWKRUTKNDFB-POYBYMJQSA-N 187.243 -1.057 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@H](CO)C1 159480766 MMVLFHUBOLVYBQ-RQJHMYQMSA-N 187.243 -1.321 50 10 AAGE NNC(=O)c1cc(O)[nH]c(=O)c1 222174459 ACCRFCDWVNCILL-UHFFFAOYSA-N 169.140 -1.316 50 10 AAGE N#Cc1nc(N)ccc1B(O)O 238573391 ZPRBVTCKFVPQNP-UHFFFAOYSA-N 162.945 -1.785 50 10 AAGE OC[C@@]1(O)O[C@@H](CCl)[C@@H](O)[C@@H]1O 238694124 HERFDENCNURSOX-BGPJRJDNSA-N 198.602 -1.973 50 10 AAGE C[C@H]1C[C@H](O)CN1CCC(=O)NN 306689931 AEQGREIZQTVXNX-BQBZGAKWSA-N 187.243 -1.179 50 10 AAGE CNC(=O)Nc1cccc(B(O)O)n1 405131279 GFWOPJAUSLSFKL-UHFFFAOYSA-N 194.987 -1.487 50 10 AAGE CN(CC(N)=O)C1=C(C#N)NC#CN1 885573186 RZZABYBTRWTMIJ-UHFFFAOYSA-N 191.194 -1.793 50 10 AAGE C[C@H](O)[C@H]1CCN1[C@@H](C)C(=O)NN 1882400162 FALXABBCFSSKHG-LYFYHCNISA-N 187.243 -1.180 50 10 AAGE N#C[C@]1(O)COC[C@H]1N 1930130184 HZBUNVGXNIAQPO-UHNVWZDZSA-N 128.131 -1.401 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@@H](O)[C@H]2C1 1931413388 QSDSDAZZVWCISO-LYFYHCNISA-N 185.227 -1.711 50 10 AAGE NNC(=O)C(=O)NC[C@H]1C[C@H](F)C1 1932740603 MEHNFJSXKKKBSG-URHBZAFASA-N 189.190 -1.159 50 10 AAGE NNC(=O)[C@@]12CCNC[C@H]1C2 1951339319 IDNVPLMVWYNNLE-IYSWYEEDSA-N 155.201 -1.024 50 10 AAGE CN1CCN(CC(=O)NN)[C@@H]2C[C@@H]21 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O=C(CCl)[C@H](O)[C@@H](O)[C@H](O)CO 307918469 VBGLFNMWEMGFTR-SRQIZXRXSA-N 198.602 -2.131 50 10 AAGE O=C1C[C@H](CCl)N[C@H]2NCNN12 605675355 PINGJLLCPZLPCI-INEUFUBQSA-N 190.634 -1.235 50 10 AAGE O=C(NCB(O)O)NC1CCC1 701940698 VMOYTITUCCQDDJ-UHFFFAOYSA-N 171.993 -1.150 50 10 AAGE NNC(=O)CCN1C[C@H]2C[C@@H](O)[C@H]1C2 1884633126 BHVUWWUGCDKFEF-BWZBUEFSSA-N 199.254 -1.179 50 10 AAGE O=C(O)c1c(O)cc(B(O)O)cc1F 1893685560 QUVSBIAHLWWHRD-UHFFFAOYSA-N 199.930 -1.091 50 10 AAGE O=CNNC(=O)[C@H]1COCCO1 1923810515 IVDSFSLYVJFDKA-RXMQYKEDSA-N 174.156 -1.821 50 10 AAGE NNC(=O)[C@@]12CNC[C@@H]1COC2 1923845679 XFJSPJGVSYEDKI-IYSWYEEDSA-N 171.200 -1.788 50 10 AAGE NNC(=O)CN1C[C@@H](O)[C@@H](C2CC2)C1 1929071600 QKLSWGSHVCFEEZ-HTQZYQBOSA-N 199.254 -1.321 50 10 AAGE N[C@@H]1C[C@H]1Nc1cc(B(O)O)ccn1 2210067547 AJICMSWFPIZTNM-RNFRBKRXSA-N 193.015 -1.727 50 10 AAGE CN(C)C(=O)c1ncncc1B(O)O 2241474600 HAQURGQYYSPRRO-UHFFFAOYSA-N 194.987 -2.142 50 10 AAGE O=C(O)[C@H](O)[C@@](O)(OO)C(=O)O 103835823 DONFFNSWBSKBRF-WIXRXDCYSA-N 182.084 -2.305 50 10 AAGE C[C@H](B(O)O)N1CC[C@](C)(N)C1=O 195847423 ATJSDXPLQQPXNL-VDTYLAMSSA-N 186.020 -1.663 50 10 AAGE Nc1cncc(B(O)O)c1F 238602801 RRWKISGBHTUABW-UHFFFAOYSA-N 155.925 -1.517 50 10 AAGE Cn1ncnc1CNC(=O)C(=O)NN 307392523 YUAHSTIRJUXQHD-UHFFFAOYSA-N 198.186 -2.579 50 10 AAGE OB(O)c1ccn(C2CCOCC2)n1 575456604 ZXABYNXMRPBQOT-UHFFFAOYSA-N 196.015 -1.086 50 10 AAGE Cn1cc(C(=O)NNC(N)=O)nc1O 606272073 FRNOBDUUTGIOCV-UHFFFAOYSA-N 199.170 -1.561 50 10 AAGE CN(CC(C)(CO)CO)C(=O)NN 689773692 JPYLOINBSCCGBY-UHFFFAOYSA-N 191.231 -1.508 50 10 AAGE CO[C@@]1(C(=O)NN(C)C)CCNC1 704168586 PGUKDDVYNXKNKV-QMMMGPOBSA-N 187.243 -1.042 50 10 AAGE CO[C@H]1CCNC[C@H]1C(=O)NN 1880974566 WHRNHCAZOSDABN-RITPCOANSA-N 173.216 -1.399 50 10 AAGE CS(=O)(=O)C[C@@H](N)C(=O)NN 1886387919 SDXPBKQWVNXNDT-GSVOUGTGSA-N 181.217 -2.652 50 10 AAGE CC[C@@H](C(=O)NN)N1CC(CO)C1 1929744277 ZJPKGGGPXPQPJP-ZETCQYMHSA-N 187.243 -1.321 50 10 AAGE NNC(=O)CN1C(=O)[C@@H]2C=C[C@H]1C2 1954495361 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AAGE C[C@@H]1C[C@@H]1C(=O)NN[C@@H]1CNC[C@H]1O 307482293 YVGMEOONFYCQIW-ULAWRXDQSA-N 199.254 -1.404 50 10 AAGE CC(=O)NNC(=O)[C@@H]1COC(=O)N1 307663942 JOHJTPWBGKWFPB-BYPYZUCNSA-N 187.155 -1.738 50 10 AAGE NNC(=O)/C=C\CCC(=O)NN 321391761 IKYZTVICZIUTQD-IWQZZHSRSA-N 172.188 -1.697 50 10 AAGE NNC(=O)CCN1CC2CC1(CO)C2 694575113 WERYMSTYXNUOHF-UHFFFAOYSA-N 199.254 -1.177 50 10 AAGE Cn1c#cc(N2NNC(C#N)=C2N)n1 885535285 LVIZWGKCNJJETK-UHFFFAOYSA-N 189.182 -1.499 50 10 AAGE NC[C@H](O)C(=O)NN 1879941048 PFJIUSTTXLFGSA-REOHCLBHSA-N 119.124 -2.704 50 10 AAGE NC(=O)c1ccncc1B(O)O 1880848666 HASBIAATNINWIF-UHFFFAOYSA-N 165.945 -2.140 50 10 AAGE NNC(=O)[C@@H]1CNCCS1(=O)=O 1881421550 MDMYWRIEAFGXDP-BYPYZUCNSA-N 193.228 -2.637 50 10 AAGE NNC(=O)[C@H]1CNCCS1(=O)=O 1881421551 MDMYWRIEAFGXDP-SCSAIBSYSA-N 193.228 -2.637 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@@H](O)[C@H]1C2 1884634876 OCJZMOHFTZITBH-HSUXUTPPSA-N 199.210 -2.042 50 10 AAGE C=CC1(O)CN([C@H](C)CC(=O)NN)C1 1891959419 DCWYRPRCTWIGDN-SSDOTTSWSA-N 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NNC(=O)CN1CC[C@@H]1[C@@H](O)CO 2241811050 LIQABIIXZYTYDL-RITPCOANSA-N 189.215 -2.596 50 10 AAGE N#CC(/C=N/NC=O)=C(/O)NC=O 306408639 IJZWUFBSFWFCHX-UMQVLASDSA-N 182.139 -1.243 50 10 AAGE NNc1ccc(B(O)O)c(F)c1 307167100 QSOUSEKMOHKWEL-UHFFFAOYSA-N 169.952 -1.209 50 10 AAGE CNC(=O)CC(=O)NNC(=O)CO 308279337 XBQPVZWCODVXER-UHFFFAOYSA-N 189.171 -2.738 50 10 AAGE COCCOCCC(=O)NNC=O 388762943 DYEYTTUGJVGJRG-UHFFFAOYSA-N 190.199 -1.183 50 10 AAGE NNC(=O)CN(CCCO)C1CC1 404248991 KTJIRTBIDYZCSV-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE CNNC(=O)[C-]1C#CC(=O)NN1 642818987 QUQUAPRRRHFARY-UHFFFAOYSA-N 167.148 -2.593 50 10 AAGE C[C@@H](CO)CN(C)C(=O)C(=O)NN 688387301 LGQMKTMWCOFVDJ-RXMQYKEDSA-N 189.215 -1.937 50 10 AAGE N[C@]1(B(O)O)COC2CC1C2 1880291060 RBIGLUQTTVEFDV-JMMWHDCWSA-N 156.978 -1.495 50 10 AAGE CN(N)C(=O)C1COCCOC1 1881572503 VVRZXOWMBMKZTB-UHFFFAOYSA-N 174.200 -1.019 50 10 AAGE NNC(=O)C(=O)N1CC2(CCOC2)C1 1915567725 KIQINMKUUCGYOU-UHFFFAOYSA-N 199.210 -1.775 50 10 AAGE O=C(NNCCO)[C@@]12COC[C@H]1C2 1929836107 CYHSBYNUJCWHNP-SVRRBLITSA-N 186.211 -1.364 50 10 AAGE CCOC(=O)[C@@H](N)CB(O)O 2080985854 RZQJPRRCIMHMDN-BYPYZUCNSA-N 160.966 -1.650 50 10 AAGE Cc1oc(B(O)O)cc1C(=O)NN 2241471905 MXQWIGWBAUDTJI-UHFFFAOYSA-N 183.960 -2.129 50 10 AAGE O=C1OC(=O)[C@@H](O)[C@@H]1O 113692197 BOGVTNYNTGOONP-LWMBPPNESA-N 132.071 -2.208 50 10 AAGE Cc1cc(B(O)O)nc(C#N)n1 198083154 KSOPBSQPJAWOHI-UHFFFAOYSA-N 162.945 -1.664 50 10 AAGE N#Cc1ncc(B(O)O)cc1O 238631930 NLYCJZICMSMPAI-UHFFFAOYSA-N 163.929 -1.661 50 10 AAGE NNC(=O)CCN1CC(O)C1 306680742 MAGMRTHFXHKQES-UHFFFAOYSA-N 159.189 -1.957 50 10 AAGE CC[C@@](C)(NC(=O)NN)C(N)=O 306887306 QNVKEJBKALTFAP-ZCFIWIBFSA-N 174.204 -1.187 50 10 AAGE COCCCNC(=O)NNC(N)=O 308362542 MRNTVTFGCQUDET-UHFFFAOYSA-N 190.203 -1.095 50 10 AAGE NC(=O)NNC(=O)[C@]12COC[C@H]1C2 575519969 AZAPTUYMABEFHZ-CLZZGJSISA-N 185.183 -1.278 50 10 AAGE COCCCC(=O)NCB(O)O 706537873 DAYXSXWENSVGCM-UHFFFAOYSA-N 174.993 -1.459 50 10 AAGE NC[C@@H]1C[C@@H](C(=O)NN)CO1 713827204 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238472099 CUZPZXKGDHCXSK-SCSAIBSYSA-N 157.922 -2.404 50 10 AAGE NC(=O)NNC(=O)NNC=O 238590079 FOWNCVBURZQEIS-UHFFFAOYSA-N 161.121 -2.470 50 10 AAGE O=CC1=C[C@@H](O)[C@@H](O)CO1 238704392 SOWXNHCSGHGSDY-RITPCOANSA-N 144.126 -1.179 50 10 AAGE O=CC1=C[C@H](O)[C@@H](O)[C@H](O)C1 306634216 UZGBQMZZECVISB-RRKCRQDMSA-N 158.153 -1.402 50 10 AAGE C#Cc1cc(B(O)O)ccn1 307398484 UACDOODTHYUQQH-UHFFFAOYSA-N 146.942 -1.257 50 10 AAGE CN1CC[C@H](N(C)C(=O)NN)C1=O 606259405 FEBCRUWQEBBAIG-YFKPBYRVSA-N 186.215 -1.268 50 10 AAGE C[C@@H]1CO[C@@H](C(=O)NCB(O)O)C1 718526342 LMBQHEZKCAQSTH-NTSWFWBYSA-N 187.004 -1.460 50 10 AAGE C[N+]1=C=C(C(=O)NN)NN1 885228802 SLRCXGCDPZDNRR-UHFFFAOYSA-O 142.142 -2.805 50 10 AAGE C[C-]1NC#CN1CCC(=O)NN 885299137 UFHWILWHPWWAMO-UHFFFAOYSA-N 167.192 -1.301 50 10 AAGE CN1NN/C(=C2\N=C=C=C=C2C=O)N1 885535394 YVVBUEWGVDABRV-BQYQJAHWSA-N 189.178 -1.267 50 10 AAGE C=C(CO)C(=O)NNC(=O)N(C)C 1625912786 STIULMKHHPNQGU-UHFFFAOYSA-N 187.199 -1.163 50 10 AAGE C[S@@](=O)N[C@@H]1CCC=C1B(O)O 1881335130 GHNFAPZXMHMKLZ-SREIQFSDSA-N 189.045 -1.030 50 10 AAGE CO[C@H]1C[C@H]1CNC(=O)C(=O)NN 1882817726 CZHSWAJZZMGJAD-WHFBIAKZSA-N 187.199 -1.873 50 10 AAGE Cn1ncc(B(O)O)cc1=O 1951323645 DIOBYOUIBGRESF-UHFFFAOYSA-N 153.934 -2.540 50 10 AAGE O=C(C#CB(O)O)NCCCF 2241476063 KUWKVBWVGULVSR-UHFFFAOYSA-N 172.952 -1.522 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2C[C@H](C1)[C@H]2O 2241815232 PHRMLJVRVJLURZ-OOJXKGFFSA-N 199.254 -1.323 50 10 AAGE OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1Cl 13514671 UDOJFSFHKNQOHC-PHYPRBDBSA-N 198.602 -1.975 50 10 AAGE in-vitro C[C@H](CNC(C)(C)CO)C(=O)NN 58853865 SSYLVGPYGKBMKV-ZCFIWIBFSA-N 189.259 -1.027 50 10 AAGE CC1=NN(CC(=O)NN)C(=O)CC1 103221537 QLGHNTOPTGUCQN-UHFFFAOYSA-N 184.199 -1.025 50 10 AAGE OB(O)c1cc(O)c2nc[nH]c2c1 306908428 GCOZXJRLQZDTAL-UHFFFAOYSA-N 177.956 -1.052 50 10 AAGE O=C(NCB(O)O)c1ccns1 705449646 SJAMNTARCLHFRS-UHFFFAOYSA-N 186.001 -1.115 50 10 AAGE NNC(=O)[C@H](N)Cn1ccnc1 1772716889 DZGCVTSAMAADFC-RXMQYKEDSA-N 169.188 -1.800 50 10 AAGE CN(C)c1nccc(B(O)O)n1 1880853128 GCJRFYZQOCHMRY-UHFFFAOYSA-N 166.977 -1.778 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H](O)C1(C)C 1883986152 CSGNRMGYGRHISF-NTSWFWBYSA-N 187.243 -1.180 50 10 AAGE NNC(=O)[C@@]12CNC[C@H]1COC2 1923843003 XFJSPJGVSYEDKI-CAHLUQPWSA-N 171.200 -1.788 50 10 AAGE O=C=NCn1cnnn1 1928686426 FADHUXSTJXDMLU-UHFFFAOYSA-N 125.091 -1.034 50 10 AAGE Cn1ncnc1[C@](C)(N)B(O)O 1932756550 JNSXKMPQNYWHTA-YFKPBYRVSA-N 169.981 -1.999 50 10 AAGE CC=CCN=c1ncc(B(O)O)c[nH]1 2210059700 BPNNTIKRMKHDST-UHFFFAOYSA-N 193.015 -1.434 50 10 AAGE O=C(C#CB(O)O)Nc1ncccn1 2241475889 HPDMWLNFXFHSMO-UHFFFAOYSA-N 190.955 -1.570 50 10 AAGE OCC(CO)(CO)NCCCl 58850464 NTVHUUSYNMADJA-UHFFFAOYSA-N 183.635 -1.470 50 10 AAGE CN(C)c1ncc(B(O)O)c(=O)[nH]1 195893075 NNBXWIVONBGYLW-UHFFFAOYSA-N 182.976 -2.484 50 10 AAGE C[C@@H](CC(=O)NN)[C@H](O)C(=O)NN 238390939 CFBDPRCKOURCRL-UCORVYFPSA-N 190.203 -2.647 50 10 AAGE COc1cc(B(O)O)cnc1N 238446405 AQWNUXXOORESKN-UHFFFAOYSA-N 167.961 -1.648 50 10 AAGE NC(=O)NCCCB(O)O 238585190 KOVPGEKWHCASAK-UHFFFAOYSA-N 145.955 -1.482 50 10 AAGE O=Cc1cnc2ccc(B(O)O)cn12 306950008 XNSBBJGNZLELMV-UHFFFAOYSA-N 189.967 -1.173 50 10 AAGE CCN(C)c1ncc(B(O)O)cn1 307100492 TWXVKFJKCNQIQX-UHFFFAOYSA-N 181.004 -1.388 50 10 AAGE O=CNNC(=O)[C@H]1CCOC1 307695774 BZOGMRMGGQVAFZ-YFKPBYRVSA-N 158.157 -1.200 50 10 AAGE NC(=O)NNC(=O)CCn1cccn1 706013136 LXUFUPPWNMIXJG-UHFFFAOYSA-N 197.198 -1.027 50 10 AAGE O=C(CO)NNC(=O)[C@H]1CC12CC2 1472536726 NCHYHQIOXFBOHJ-RXMQYKEDSA-N 184.195 -1.074 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H]2[C@@H](O)C[C@H]21 1885072213 GFLQIMCGJZKFLH-JKUQZMGJSA-N 199.210 -2.042 50 10 AAGE O=C(NCB(O)O)[C@@H]1C[C@@H]2C[C@@H]2CO1 1931603809 JUQVXUDTUGXFDX-XVMARJQXSA-N 199.015 -1.460 50 10 AAGE C[C@]12CCO[C@H]1[C@@](N)(B(O)O)C2 1933397701 KMJOXVWHLMBRFO-FSDSQADBSA-N 171.005 -1.105 50 10 AAGE NNC(=O)C1(CO)CNC1 1953167960 RZCIPYVWUAOPCD-UHFFFAOYSA-N 145.162 -2.442 50 10 AAGE OCCSc1ncccc1B(O)O 2209388377 UYNKKMGRDIANRR-UHFFFAOYSA-N 199.040 -1.154 50 10 AAGE OCCOc1cc(B(O)O)ccn1 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-1.321 50 10 AAGE NNC(=O)[C@H]1C[C@H](N)[C@@H]2C[C@H]12 1953201694 AYUGSVNUXYTPAE-FSIIMWSLSA-N 155.201 -1.040 50 10 AAGE CCN(C)c1ncc(B(O)O)c(C)n1 1956956173 SPQDTXVUXFPTFE-UHFFFAOYSA-N 195.031 -1.079 50 10 AAGE OCCCOc1cc(B(O)O)ccn1 2210063500 AVCBQQDZWJTEQM-UHFFFAOYSA-N 196.999 -1.477 50 10 AAGE CC=C1CN(C(=O)C#CB(O)O)C1 2241479295 VTSHPYMWIOEFNN-UHFFFAOYSA-N 178.984 -1.210 50 10 AAGE O=C(NCC=CB(O)O)C(F)F 2241555695 PKBILRHJSMZLOJ-UHFFFAOYSA-N 178.931 -1.064 50 10 AAGE CC(C)C[C@@H](NC(=O)CN)B(O)O 213604122 NTXNJVNYGXQNCQ-ZCFIWIBFSA-N 188.036 -1.512 50 10 AAGE NNC(=O)N1CC[C@@](O)(CO)C1 306164101 OJJHTVDCIGLZRW-LURJTMIESA-N 175.188 -2.001 50 10 AAGE O=C(Cn1cncn1)NCB(O)O 702031709 AEUJKZNAPDHWSG-UHFFFAOYSA-N 183.964 -2.594 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@H]2[C@@H]1CO 1896395154 JHTGQTIKKUEPFZ-RNJXMRFFSA-N 199.254 -1.321 50 10 AAGE NNC(=O)N1CC(N2CC(F)C2)C1 1954418363 OUXQKQXDOKCXMD-UHFFFAOYSA-N 188.206 -1.092 50 10 AAGE NC[C@H]1C[C@H]1CNC(=O)C#CB(O)O 2241468003 FTAQVAYLSVLRDN-RQJHMYQMSA-N 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NNC(=O)N[C@H](CO)C(=O)NN 238661899 SZWDZLUOEMQNPJ-UWTATZPHSA-N 177.164 -3.490 50 10 AAGE OCc1cnccc1B(O)O 238729505 ZHPRYMSMRLZRTK-UHFFFAOYSA-N 152.946 -1.746 50 10 AAGE NNC(=O)[C@H](N)Cc1ccncc1 259079145 ZGQJYQBZRNMYHH-SSDOTTSWSA-N 180.211 -1.059 50 10 AAGE NC(=O)C(=O)NN=Cc1ccc[nH]1 308362355 FFZGXSCUFQJTOF-UHFFFAOYSA-N 180.167 -1.050 50 10 AAGE CC(=O)N[C@H](C)C(=O)NNCCO 1882544094 REPQXXKVFFOYFP-RXMQYKEDSA-N 189.215 -1.876 50 10 AAGE CN(C)NC(=O)C1=C[C@H](O)[C@H](N)C1 1882799368 HMCZIBJTQPSGAL-RQJHMYQMSA-N 185.227 -1.403 50 10 AAGE NNC(=O)CCN1C[C@@H](O)C12CCC2 1900923106 VFWODHGNHSDGRD-SSDOTTSWSA-N 199.254 -1.034 50 10 AAGE NNC(=O)[C@]1(O)CCCNC1 1923842727 PIGPRDGVJLUBAU-LURJTMIESA-N 159.189 -1.909 50 10 AAGE COC[C@H](C(=O)NN)N1CCCO1 1928676496 JLXZVJZWBBFRAA-ZCFIWIBFSA-N 189.215 -1.371 50 10 AAGE NNC(=O)N1C[C@H](F)[C@H](O)C1 1929911931 BPKVXTLEPHPNME-IUYQGCFVSA-N 163.152 -1.416 50 10 AAGE N[C@H]1C[C@@H]1Nc1cc(B(O)O)ccn1 2210067545 AJICMSWFPIZTNM-BQBZGAKWSA-N 193.015 -1.727 50 10 AAGE N#CC1(NC(=O)C#CB(O)O)CCC1 2241467737 AEXRUVSEDYXSEF-UHFFFAOYSA-N 191.983 -1.436 50 10 AAGE CCONC(=O)c1ccoc1B(O)O 2241467898 CVWXCRWIXDUICW-UHFFFAOYSA-N 198.971 -1.359 50 10 AAGE CNC(=O)c1c(B(O)O)cnn1C 2241468923 XAXSQYQBDPRRGU-UHFFFAOYSA-N 182.976 -2.541 50 10 AAGE O=C(c1n[nH]cc1B(O)O)N1CCC1 2241475394 WXHFZNXMBWMPFW-UHFFFAOYSA-N 194.987 -2.065 50 10 AAGE CC[C@@](C)(CO)NC(=O)C#CB(O)O 2241479536 ZWKGHGOIZCKYKR-QMMMGPOBSA-N 199.015 -1.721 50 10 AAGE NCCNC(=O)c1c[nH]nc1B(O)O 2241480692 NLHQKUWJCJJSEJ-UHFFFAOYSA-N 197.991 -3.222 50 10 AAGE O=C(NCC1(O)CC1)[C@H]1C[C@@H]1B(O)O 2241494774 CSWJHCGNTGSZSS-WDSKDSINSA-N 199.015 -1.510 50 10 AAGE CNC(=O)c1cnsc1B(O)O 2297002580 QGEYBLCVSYWJKN-UHFFFAOYSA-N 186.001 -1.818 50 10 AAGE C[C@@H](O)C(=O)OC(=O)[C@@H](C)O 103820437 AURKDQJEOYBJSQ-QWWZWVQMSA-N 162.141 -1.182 50 10 AAGE O=C/C(O)=C(/O)[C@H](O)[C@H](O)CO 147087075 ADGXMKSOBBXKBS-AVCLAYCWSA-N 178.140 -1.773 50 10 AAGE NNC(=O)[C@H]1CCCCS1(=O)=O 167636750 RYYICGQQNOBGIB-RXMQYKEDSA-N 192.240 -1.056 50 10 AAGE CC(=O)c1cc(B(O)O)cc(C#N)n1 206086040 WXOCBLJYCROGDI-UHFFFAOYSA-N 189.967 -1.164 50 10 AAGE CCN(CB(O)O)C(=O)C(C)(C)N 238250617 DGQVSWMIDJKSKI-UHFFFAOYSA-N 188.036 -1.416 50 10 AAGE CNNC(=O)C[C@@H](C)N 259205435 ZEXYAYLJSSKBHE-SCSAIBSYSA-N 131.179 -1.026 50 10 AAGE CN1C[C@H](NC(=O)CCl)C(=O)N1 306858524 ZMTODNVWMPAEST-BYPYZUCNSA-N 191.618 -1.313 50 10 AAGE C[C@H](C(=O)NN)N1CC2(COC2)C1 697131539 CFDKLECSYKGDJJ-ZCFIWIBFSA-N 185.227 -1.303 50 10 AAGE CC(=O)NCCC(=O)NCB(O)O 702022396 WAENLTAMAZLFNJ-UHFFFAOYSA-N 187.992 -2.359 50 10 AAGE NC(=O)C1(N)CN(C(=O)F)C1 1880315303 BXNKFZOPXUHHDG-UHFFFAOYSA-N 161.136 -1.426 50 10 AAGE NNC(=O)C(=O)N[C@H]1[C@H]2OCC[C@@H]21 1881744693 GOBIAPBVRRWQEW-WDCZJNDASA-N 185.183 -2.120 50 10 AAGE CO[C@H]1CN(CC(=O)NN)C[C@@H]1F 1928692556 QNYYDIGJLYWHHS-WDSKDSINSA-N 191.206 -1.355 50 10 AAGE NNC(=O)[C@@H]1[C@@H]2CC[C@H]1NC2 1953290847 WPIJSPKQJRQYPV-HSUXUTPPSA-N 155.201 -1.026 50 10 AAGE NNC(=O)[C@@]1(CO)CCCN1 1953304418 PRQNPLMZLNYODN-LURJTMIESA-N 159.189 -1.909 50 10 AAGE CC1CN(C(=O)C#CB(O)O)C1 2241467772 ASWCHFKYPXCGGF-UHFFFAOYSA-N 166.973 -1.520 50 10 AAGE O=C(C1CC(B(O)O)C1)N1CCCN1 2241474967 OBUZSLYQQJSSAG-UHFFFAOYSA-N 198.031 -1.024 50 10 AAGE O=C(C#CB(O)O)NCc1ccno1 2241476543 VCMCSITWROWVBW-UHFFFAOYSA-N 193.955 -1.694 50 10 AAGE C[C@@H](CCN)NC(=O)C#CB(O)O 2241478243 AXPSBXBECJNZJL-LURJTMIESA-N 184.004 -2.145 50 10 AAGE O=C(N[C@H]1C[C@@H](O)C1)[C@@H]1C[C@@H]1B(O)O 2241496580 VEOQNCNISYOJSS-UCROKIRRSA-N 199.015 -1.511 50 10 AAGE O=C(NO)c1cc(B(O)O)c[nH]1 2241584963 WHUXTXHFUPEYTP-UHFFFAOYSA-N 169.933 -2.187 50 10 AAGE NNC(=O)c1nnc2ccnn2c1N 32232504 JVUHKCVXEKCLAH-UHFFFAOYSA-N 193.170 -1.690 50 10 AAGE NCCNC(=O)N[N+](=O)[O-] 104566401 MAKCHXDYDBTWCI-UHFFFAOYSA-N 148.122 -1.564 50 10 AAGE Nc1ncc(B(O)O)c(N)n1 238673096 QYAZSWLRHGJSPX-UHFFFAOYSA-N 153.938 -2.679 50 10 AAGE N#C/C(C=NNC=O)=C(/O)NC=O 308047826 IJZWUFBSFWFCHX-PGNAWXQYSA-N 182.139 -1.243 50 10 AAGE CN(C)CC[S@](=O)CC(=O)NN 526892379 MXQVBQRJJRNCFM-LBPRGKRZSA-N 193.272 -1.713 50 10 AAGE CO[C@H]1COC[C@@H]1N(C)C(=O)NN 1881953580 ATWRGGOSDYTUIM-WDSKDSINSA-N 189.215 -1.085 50 10 AAGE CN(C[C@H]1C[C@@H]1F)C(=O)C(=O)NN 1882863369 HFZMSRLBNNJEOB-UHNVWZDZSA-N 189.190 -1.207 50 10 AAGE NNC(=O)C(=O)NC[C@@H]1[C@@H]2CCO[C@H]21 1884457674 ZSHLIUFYBSKORX-KVQBGUIXSA-N 199.210 -1.873 50 10 AAGE COC12CC(C1)N(C(=O)C(=O)NN)C2 1886608985 WCADFLAZRATBPQ-UHFFFAOYSA-N 199.210 -1.634 50 10 AAGE CN1CC[C@@](N)(C(=O)NN)C1 1923857740 UWSVJTSUONBTHO-LURJTMIESA-N 158.205 -1.991 50 10 AAGE Cn1ncc(CNCB(O)O)n1 1923937766 URBMNKFXFDPFJQ-UHFFFAOYSA-N 169.981 -2.083 50 10 AAGE C[C@@H]1CCOC[C@]1(N)B(O)O 1932287526 QTRJLQNAWRQLDJ-PHDIDXHHSA-N 158.994 -1.248 50 10 AAGE NC(=O)Nc1ncc(B(O)O)cn1 1954372337 VYLZNSHZLYYDGI-UHFFFAOYSA-N 181.948 -2.353 50 10 AAGE NNC(=O)CN1C[C@H](O)C2(CCC2)C1 1956265396 PRLMGIMCWUSWJF-ZETCQYMHSA-N 199.254 -1.177 50 10 AAGE CN(O)C(=O)c1nn(C)cc1B(O)O 2241467799 BCTFRZVVWWWYDW-UHFFFAOYSA-N 198.975 -2.439 50 10 AAGE C#CCNC(=O)c1ccoc1B(O)O 2241469050 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SZMVZLPAJYXUMP-URHBZAFASA-N 187.199 -1.730 50 10 AAGE CC(C)OCCC(=O)NCB(O)O 716967688 WBBOQPJZKBHDFO-UHFFFAOYSA-N 189.020 -1.070 50 10 AAGE N[C@H](B(O)O)[C@@H]1COCCO1 1880462442 HLFIYZZPQANTRZ-WHFBIAKZSA-N 160.966 -2.259 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H](O)[C@H](F)C1 1929912933 MTVYMMZHYJKXGL-KVQBGUIXSA-N 191.206 -1.621 50 10 AAGE NNC(=O)C(=O)N[C@H]1[C@H]2CCC[C@H]21 1930493049 AAKIAUCOWZRODT-FPFOFBBKSA-N 183.211 -1.109 50 10 AAGE NNC(=O)CO[C@@H]1CCNC1 1932606422 GQDODOYHFAOFDU-RXMQYKEDSA-N 159.189 -1.645 50 10 AAGE NNC(=O)[C@@H]1C[C@H](N)[C@H]2C[C@@H]21 1951338990 AYUGSVNUXYTPAE-AZGQCCRYSA-N 155.201 -1.040 50 10 AAGE NNC(=O)CN1CCO[C@H]2C[C@@H]21 1953696071 ABJBQDLSXZOGOS-WDSKDSINSA-N 171.200 -1.551 50 10 AAGE O=C1CN(C(=O)CCl)CC(=O)N1 85085471 YBXWOFOXAJYKLM-UHFFFAOYSA-N 190.586 -1.290 50 10 AAGE C=C[Si](O)(O)O 196198861 JDDPGRVMAVYUOZ-UHFFFAOYSA-N 106.153 -1.373 50 10 AAGE OCc1ncc(B(O)O)cn1 222060267 GTJUIIQCSBXYPT-UHFFFAOYSA-N 153.934 -2.351 50 10 AAGE Cc1nc2cncc(B(O)O)c2n1C 238508986 RDIODJIMEDVGKJ-UHFFFAOYSA-N 190.999 -1.043 50 10 AAGE NNc1cc(CO)ccc1B(O)O 307101812 HYOXBQDXVYARIS-UHFFFAOYSA-N 181.988 -1.856 50 10 AAGE C[C@@H]1C[C@H](O)CN1C(=O)C(=O)NN 307247046 ZEVRXWFSOIRLDT-UHNVWZDZSA-N 187.199 -2.042 50 10 AAGE CNNC(=O)[C@H](C)NC(C)=O 704663898 DAIVVNCHSCNQFT-BYPYZUCNSA-N 159.189 -1.238 50 10 AAGE COC[C@H](ON)C(=O)NN(C)C 710546281 VOJPFZVYFNYRLU-YFKPBYRVSA-N 177.204 -1.516 50 10 AAGE OB(O)c1ncns1 725090992 VZJSZKFHMOFVNY-UHFFFAOYSA-N 129.937 -1.782 50 10 AAGE C[C@@H]1[C@H](O)CCN1CCC(=O)NN 1914255899 OZIBYCNQJAIPOP-RNFRBKRXSA-N 187.243 -1.179 50 10 AAGE COC[C@H](N)CC(=O)NN 1929881616 FABPPFRRNPJJFL-SCSAIBSYSA-N 147.178 -1.660 50 10 AAGE CN(C)NC(=O)[C@@H](N)CO 1931763719 SLIQULMJRWYIDG-BYPYZUCNSA-N 147.178 -2.101 50 10 AAGE NNC(=O)CN1CC(=O)N[C@H]2CC[C@H]21 1956630038 UOSMNFKYNWEOGV-NTSWFWBYSA-N 198.226 -2.061 50 10 AAGE C=C(CN1CCC12CN(C)C2)B(O)O 2210009723 LBJLWCXULMAAJN-UHFFFAOYSA-N 196.059 -1.056 50 10 AAGE CN(CC1(N)CC1)C(=O)C#CB(O)O 2241468118 HPGHWZZKAJEOSG-UHFFFAOYSA-N 196.015 -2.049 50 10 AAGE C[C@@H](C#N)CNC(=O)C#CB(O)O 2241475996 JPIASAQKGJXWQN-LURJTMIESA-N 179.972 -1.722 50 10 AAGE Cc1c(C(=O)NO)nn(C)c1B(O)O 2241583738 CNBWPBRHSJIORZ-UHFFFAOYSA-N 198.975 -2.473 50 10 AAGE O=C(OC(=O)[C@H](O)CO)[C@@H](O)CO 59696605 CJCXKMLGWBVDGS-ZXZARUISSA-N 194.139 -3.237 50 10 AAGE C[C@H](CO)N(C)C(=O)NN 124499164 KOMGMLFPTWYXMV-SCSAIBSYSA-N 147.178 -1.118 50 10 AAGE Cc1cc(B(O)O)cc(C=O)n1 198023885 ASUPMLNAKSVDSB-UHFFFAOYSA-N 164.957 -1.118 50 10 AAGE C[C@@H]1CN(C(=O)NN)C[C@@H](CO)O1 229987010 NAGKZJGKRFDMOP-RITPCOANSA-N 189.215 -1.349 50 10 AAGE CO[C@@H]1OC(C=O)=C[C@H](O)[C@@H]1O 238340250 YISYJKZMQGJXSO-LYFYHCNISA-N 174.152 -1.206 50 10 AAGE N#C[C@@H](O)Cn1ccc(=O)[nH]c1=O 238696357 WCQGVYVABYIEDR-RXMQYKEDSA-N 181.151 -1.579 50 10 AAGE NNC(=O)CN1CCN(C2CC2)C1=O 690767050 SSMPBAFATRSDOO-UHFFFAOYSA-N 198.226 -1.124 50 10 AAGE CC(=O)OCC=NNNC(N)=O 713327121 YWWGRFMLKUSVOK-UHFFFAOYSA-N 174.160 -1.292 50 10 AAGE Cc1nnc(CNC(=O)C(=O)NN)o1 719374000 ZVPYUPQRVOVWQS-UHFFFAOYSA-N 199.170 -2.016 50 10 AAGE NC(=O)NN/C=C1/C#C[C](C(=O)O)N1 885215109 FTPKFMGOGUKEFQ-UHFFFAOYSA-N 195.158 -1.776 50 10 AAGE C[C@@H]1OCC[C@H]1[C@@H](N)B(O)O 1880344738 BKNNFYCEASJQKH-KVQBGUIXSA-N 158.994 -1.249 50 10 AAGE NNC(=O)[C@@H]1CNC[C@H](O)C1 1934304498 DXLWWILOJAONHF-CRCLSJGQSA-N 159.189 -2.053 50 10 AAGE C[C@@H](NC(=O)C(=O)NN)c1cnco1 1955526309 JQSZBNQHMKNMTN-SCSAIBSYSA-N 198.182 -1.158 50 10 AAGE NNC(=O)N1CCC[C@@H]2CNC(=O)[C@H]21 2241249873 AKWROBBFVNXTCV-RITPCOANSA-N 198.226 -1.220 50 10 AAGE O=C(C#CB(O)O)N1C[C@@H]2C[C@H](C1)N2 2241468266 KMWOUHIMFOBLLP-KNVOCYPGSA-N 193.999 -2.426 50 10 AAGE N#CNC(=O)c1ncncc1B(O)O 2241473063 CFQUXPCQQYSBKL-UHFFFAOYSA-N 191.943 -2.633 50 10 AAGE C#C[C@H](C)NC(=O)[C@H]1C[C@@H]1B(O)O 2241479413 XNRGQFWVNGRACX-ACZMJKKPSA-N 181.000 -1.013 50 10 AAGE N[C@@H]1C[C@H]1NC(=O)C1(B(O)O)CCC1 2241481778 VLSLDIKJCJIRBO-PHDIDXHHSA-N 198.031 -1.401 50 10 AAGE O=C(NCCCO)[C@H]1C[C@H]1B(O)O 2241495146 HDJJAGZDPSZEKM-NTSWFWBYSA-N 187.004 -1.652 50 10 AAGE NNC(=O)CC[C@H]1CNCCO1 2242393299 KAHAJXFNDSFEDV-LURJTMIESA-N 173.216 -1.255 50 10 AAGE NNC(=O)C(=O)N[C@H]1[C@@H]2CCCO[C@@H]21 2297036050 BMBHOAICVPWMRP-ZLUOBGJFSA-N 199.210 -1.730 50 10 AAGE C[C@H](O)C(=O)NNC(=O)[C@H](C)O 5362399 QPTYEEKWFKVUKH-IMJSIDKUSA-N 176.172 -2.105 50 10 AAGE CN(CCO)C(=O)CCC(=O)NN 58845317 GAXMFMHJISHAGM-UHFFFAOYSA-N 189.215 -1.793 50 10 AAGE O=C1OC(=O)[C@H]2CNC[C@@H]12 84466339 WGRNJBASWAHMQX-ZXZARUISSA-N 141.126 -1.095 50 10 AAGE OCC#Cc1ccc(B(O)O)cc1 197022362 DZGWJSMSIAHVMX-UHFFFAOYSA-N 175.980 -1.290 50 10 AAGE NNC(=O)C[C@H](O)[C@H](O)[C@H](O)CO 224159947 BECUBMLLHUYFKV-RPDRRWSUSA-N 194.187 -3.559 50 10 AAGE NC(=O)NNC(O)(C(=O)O)C(=O)O 238590265 MWEAFEABOVPALY-UHFFFAOYSA-N 193.115 -2.983 50 10 AAGE NC[C@@H](O)CSS(=O)(=O)O 238625525 PIVWUOGPDNCRQS-GSVOUGTGSA-N 187.242 -1.158 50 10 AAGE OB(O)c1cnn(C[C@@H]2CCOC2)c1 694508570 MCYWBQLTZZDZSW-ZETCQYMHSA-N 196.015 -1.401 50 10 AAGE NNC(=O)Cn1nnnc1C(=O)O 1860739310 CBNHKONVAUKJIW-UHFFFAOYSA-N 186.131 -2.639 50 10 AAGE O=C(NCC#CB(O)O)[C@H]1CCCO1 1895239727 QLXZCSGAWAHKFB-SSDOTTSWSA-N 196.999 -1.703 50 10 AAGE CNNC(=O)N1CC[C@H](O)C1 1914083184 PHKWZDXXBLVBTP-YFKPBYRVSA-N 159.189 -1.103 50 10 AAGE NNC(=O)[C@@H]1CC[C@@H](C(=O)O)O1 1914770195 BZEHDUUUECVWJZ-IMJSIDKUSA-N 174.156 -1.392 50 10 AAGE CO[C@@H]1CN(CC(=O)NN)C[C@@H]1F 1928692553 QNYYDIGJLYWHHS-NTSWFWBYSA-N 191.206 -1.355 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@H]2C[C@H]1C[C@H]2O 1956910768 GAIWHVJHBDFUCH-FKSUSPILSA-N 199.254 -1.180 50 10 AAGE OB(O)c1ccnc(N2CCCN2)c1 2210061824 YYOVRWZYHIEDDT-UHFFFAOYSA-N 193.015 -1.524 50 10 AAGE CNNC(N)=O 6626002 RKNBYEDXBCUNQB-UHFFFAOYSA-N 89.098 -1.211 50 10 AAGE CC(C)(NNC(N)=O)C(N)=O 17551584 OVCYWRHTKXZFBC-UHFFFAOYSA-N 160.177 -1.577 50 10 AAGE CCN(CCO)C[C@H](C)C(=O)NN 58854842 ZEVFDNCGGNOWHJ-ZETCQYMHSA-N 189.259 -1.073 50 10 AAGE C=CC[C@@H](N)C(=O)NN 128814277 SKMGUYDKYONGJX-SCSAIBSYSA-N 129.163 -1.120 50 10 AAGE C/N=C/N/C(C#N)=C(/N)C(N)=O 212531653 CYXHABIIBYUVAT-SNAWJCMRSA-N 167.172 -1.587 50 10 AAGE NNC(=O)NCCOCC(N)=O 230094234 GZSJJSGAPMZGOV-UHFFFAOYSA-N 176.176 -2.339 50 10 AAGE CN(C)NC(=O)[C@H]1CNC(=O)CN1 230904679 VNOCFBUEXUCJDK-RXMQYKEDSA-N 186.215 -2.333 50 10 AAGE COc1nc(B(O)O)ccc1F 307494490 HXICMNNTOXEFKY-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE CC(=O)Nc1ccc(B(O)O)c(N)c1 307503908 WOGSNPIEHGLUSV-UHFFFAOYSA-N 193.999 -1.093 50 10 AAGE O=C(NCB(O)O)c1csnn1 706428342 BQSJNFQCKXCVGC-UHFFFAOYSA-N 186.989 -1.720 50 10 AAGE NNC(=O)[C@@H]1C[C@H]1CN1CCNCC1 885191036 PFHARKRPACITMR-JGVFFNPUSA-N 198.270 -1.482 50 10 AAGE CC1=NN[C-](C(=O)N(C)N)C#C1 885280691 WWDVKSGDOHXCQV-UHFFFAOYSA-N 165.176 -1.167 50 10 AAGE O=CNNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1923790672 ZAYGEBJMKAWZTF-QWWZWVQMSA-N 173.128 -1.571 50 10 AAGE Cc1nc(=NCB(O)O)s[nH]1 1923941042 HYJLESDHLYRIKN-UHFFFAOYSA-N 173.006 -1.308 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@H]1CO 1929742136 VHGGTAMFIRGJGV-WDSKDSINSA-N 173.216 -1.569 50 10 AAGE NC(=O)CNc1cc(B(O)O)ccn1 2210060486 KYUKRJXSBBJOFU-UHFFFAOYSA-N 194.987 -2.341 50 10 AAGE COCCCN(C)C(=O)C#CB(O)O 2241471586 KMRSNXKPRUBKBT-UHFFFAOYSA-N 199.015 -1.503 50 10 AAGE NNC(=O)N[C@@H]1CCCNC1=O 50392649 OZNGJPNHHARPKE-SCSAIBSYSA-N 172.188 -1.562 50 10 AAGE NCc1cc(B(O)O)ccn1 197464605 YAZVZTDEUBDQMF-UHFFFAOYSA-N 151.962 -1.780 50 10 AAGE C[C@H](NS(C)(=O)=O)B(O)O 205327020 LBALBDULCPLUSS-VKHMYHEASA-N 166.995 -2.064 50 10 AAGE O=C(CCl)N1C[C@@H](O)[C@H](O)C1 236540710 LJZHGRAAFMEPAW-RFZPGFLSSA-N 179.603 -1.211 50 10 AAGE OB(O)/C=C/[C@@H]1O[C@H](O)[C@@H](O)[C@H]1O 306393358 DQCSKJVOIMGUKO-RONFPEQKSA-N 189.960 -3.006 50 10 AAGE Cc1cnnc(B(O)O)c1 306563692 VXMZCRBXGNAAIP-UHFFFAOYSA-N 137.935 -1.535 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1CN1C#CNN1 885390061 HDGCQNBNGUSHAZ-PHDIDXHHSA-N 181.199 -2.144 50 10 AAGE O=C(NNCCO)[C@@H]1C[C@H]1F 1880183557 RLDDPVBRDFIUTJ-RFZPGFLSSA-N 162.164 -1.043 50 10 AAGE NNC(=O)NC[C@@H]1CNC(=O)O1 1881014250 WLPGGMXEJQLWFR-GSVOUGTGSA-N 174.160 -1.732 50 10 AAGE C#CCOc1cc(B(O)O)c(F)cn1 1892557334 OAGSTBFKSSQNHL-UHFFFAOYSA-N 194.958 -1.088 50 10 AAGE C[C@@H]1C[C@H](F)CN1C(=O)C#CB(O)O 2241468194 IVMQRRUWCBOSAE-RQJHMYQMSA-N 198.990 -1.039 50 10 AAGE NCCCNC(=O)C1(B(O)O)CC1 2241472947 AGDRRQYKRRNLQY-UHFFFAOYSA-N 186.020 -1.542 50 10 AAGE C=CCN(OC)C(=O)C(=O)NN 2241803679 SZRGNVZSEJGOMY-UHFFFAOYSA-N 173.172 -1.448 50 10 AAGE NC(=O)N/N=C/c1c[nH]c(=O)[nH]c1=O 1605003 FCZOMWRIABJSMU-XNWCZRBMSA-N 197.154 -1.935 50 10 AAGE CCN(CCO)C[C@@H](C)C(=O)NN 58854838 ZEVFDNCGGNOWHJ-SSDOTTSWSA-N 189.259 -1.073 50 10 AAGE CN(C=O)CC(=O)NN 143504147 IFOQAMMOARQDSN-UHFFFAOYSA-N 131.135 -1.936 50 10 AAGE OC[C@H](O)COC[C@@H](O)CCl 147199429 YLPXUJPMQZRZLW-WDSKDSINSA-N 184.619 -1.044 50 10 AAGE N#CC[C@H](N)B(O)O 219632087 AOFMCECDSQQQJO-VKHMYHEASA-N 113.913 -1.761 50 10 AAGE COC[C@@H](OC1COC1)C(=O)NN 232418749 OUGYVHOBTNYKAO-ZCFIWIBFSA-N 190.199 -1.593 50 10 AAGE COc1ncc(B(O)O)cc1CN 238397740 RDWHKYTVZQNLPF-UHFFFAOYSA-N 181.988 -1.771 50 10 AAGE Cc1cc(N)nc(NCC(=O)NN)n1 238456396 POCJNUQBOTZJAF-UHFFFAOYSA-N 196.214 -1.231 50 10 AAGE Cc1c(C(=O)NN)c[nH]c1C(=O)NN 238524983 GDHHWNDMVAGWOQ-UHFFFAOYSA-N 197.198 -1.470 50 10 AAGE Cc1c(N)cncc1B(O)O 238526465 XVVVCLLSZLLRRI-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE CN(N)C(=O)CN1CSCC1=O 704673463 SLUFWNHBOUVCNS-UHFFFAOYSA-N 189.240 -1.149 50 10 AAGE NC[C@]1(O)C[C@H](C(=O)NN)C1 1880220768 OLOOMSHBMCRNQE-DTXYKFKXSA-N 159.189 -1.924 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]2CC[C@H]21 1924442466 NYVZZPVLVKZZET-PHDIDXHHSA-N 183.211 -1.013 50 10 AAGE COC1([C@H](N)B(O)O)CCC1 1931497816 WLCGUSIONHLSCQ-YFKPBYRVSA-N 158.994 -1.105 50 10 AAGE CS(=O)(=O)CC[C@@H](O)[C@H](O)C#N 1951367732 ORKSJRLFXYGVHE-PHDIDXHHSA-N 193.224 -1.334 50 10 AAGE C=CCONC(=O)C#CB(O)O 2241470879 DSAFPNXRHKNJTJ-UHFFFAOYSA-N 168.945 -1.764 50 10 AAGE O=C([C@@H]1C[C@@H]1B(O)O)N1CC[C@@H](O)C1 2241479816 FTPDQERZDIORRO-QYNIQEEDSA-N 199.015 -1.558 50 10 AAGE C#CC(=O)Nc1ccc(B(O)O)cn1 2241555964 RVWBXNFBQNZHPU-UHFFFAOYSA-N 189.967 -1.667 50 10 AAGE CC#CCC(=O)NCCC#CB(O)O 2241905619 HHJPNYJEFTUHEE-UHFFFAOYSA-N 193.011 -1.079 50 10 AAGE C#CC(=O)N1CC[C@H](B(O)O)C1 2297009204 SWOVKRUUKPIPHS-LURJTMIESA-N 166.973 -1.305 50 10 AAGE NNC(=O)C(=O)N1CCC[C@@H]1CO 42435228 UFUVSHFFPIPRMV-RXMQYKEDSA-N 187.199 -2.040 50 10 AAGE NNC(=O)C(=O)Nc1cccnn1 161129562 LWYVJBIEYUVKMK-UHFFFAOYSA-N 181.155 -1.595 50 10 AAGE CO[C@@H]1COCC[C@@H]1NC(=O)NN 306758407 USRHMEPYNWUTFP-NTSWFWBYSA-N 189.215 -1.037 50 10 AAGE OB(O)c1ncncc1F 306930896 CHDXGTQXUAOBHC-UHFFFAOYSA-N 141.898 -1.705 50 10 AAGE CC[S@@](=O)CC(=O)NN 526869874 ZDAYLZGGVFMVOH-SECBINFHSA-N 150.203 -1.255 50 10 AAGE O=C(NCC#CB(O)O)[C@@H]1C[C@@H]1F 1877557017 YEAZUIWCMRBBDN-RITPCOANSA-N 184.963 -1.524 50 10 AAGE C[C@H](NC(=O)C#CB(O)O)[C@@H](C)O 2241468086 HFXSOADDDCOYAF-NTSWFWBYSA-N 184.988 -2.113 50 10 AAGE O=C(C#CB(O)O)N1CC[C@H](O)C1 2241468278 KRDAYJXGOGSVNJ-LURJTMIESA-N 182.972 -2.405 50 10 AAGE O=C(NCC#CCO)[C@H]1C[C@@H]1B(O)O 2241495335 ITCZPEVYFFRHGZ-BQBZGAKWSA-N 196.999 -2.039 50 10 AAGE Cc1cc(F)c(B(O)O)cc1C(N)=O 2241741921 SNIWEEARHNDWCK-UHFFFAOYSA-N 196.974 -1.087 50 10 AAGE NC(CF)(CF)B(O)O 2242434893 RJSWVQWOAXNCCI-UHFFFAOYSA-N 138.910 -1.365 50 10 AAGE OC[C@@H](O)[C@@H](O)CCl 104734070 DGGUDQTUJAPWME-IUYQGCFVSA-N 140.566 -1.061 50 10 AAGE CN(CCO)C(=O)NCN=C=O 170294004 LHJLPQXPEYUOEB-UHFFFAOYSA-N 173.172 -1.087 50 10 AAGE NNC(=O)Cn1[nH]ncc1=O 199116130 XSJXMILLJVOAME-UHFFFAOYSA-N 157.133 -2.439 50 10 AAGE C[C@@H](ON)C(=O)NNC(=O)CN 238412704 DGVYPVOZKKUKDI-GSVOUGTGSA-N 176.176 -2.629 50 10 AAGE CCn1ccc(B(O)O)cc1=O 306224382 DHDYDRNOSZZNNZ-UHFFFAOYSA-N 166.973 -1.452 50 10 AAGE NNCc1nn[nH]c1C(=O)NN 306652316 GMOYTGBHNKMSCW-UHFFFAOYSA-N 171.164 -2.629 50 10 AAGE NC(=O)C(=O)NNC(=O)C1CC1 307413782 SIRAFFVQFOIQSL-UHFFFAOYSA-N 171.156 -1.971 50 10 AAGE Cn1cncc1CB(O)O 401641897 IIJRPEZCZABMOL-UHFFFAOYSA-N 139.951 -1.025 50 10 AAGE CN(C)NC(=O)[C@H]1CNCCOC1 575544340 JBRUQWWYYBHXSU-ZETCQYMHSA-N 187.243 -1.185 50 10 AAGE COC[C@@H](C)OC(=O)NCB(O)O 704489798 QLTNJXOIKPGAGV-RXMQYKEDSA-N 190.992 -1.241 50 10 AAGE C#CCO[C@@H](C)C(=O)NNC(=O)NC 1625508630 ZSHCHNUSYACUFJ-LURJTMIESA-N 199.210 -1.015 50 10 AAGE N#Cc1nscc1B(O)O 1880057303 MIBVFPINIFDSGJ-UHFFFAOYSA-N 153.959 -1.305 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H](O)[C@H]1C 1880908180 WAUFIEVDDJSAOJ-HSUXUTPPSA-N 173.216 -1.570 50 10 AAGE COCc1cccnc1B(O)O 1881477560 XYTCOWPCWCTPTH-UHFFFAOYSA-N 166.973 -1.092 50 10 AAGE CC1(C)[C@@H](O)[C@H](O)CN1C(=O)NN 1882318343 CYPIMWBHSQYQGR-UHNVWZDZSA-N 189.215 -1.614 50 10 AAGE NNC(=O)CCN1CC(O)(CO)C1 1954058321 WITLTBKGVMORHZ-UHFFFAOYSA-N 189.215 -2.595 50 10 AAGE COCCNc1cc(B(O)O)ccn1 2210061240 RUGGDYABBVZRFT-UHFFFAOYSA-N 196.015 -1.180 50 10 AAGE C[C@@H](CO)C(=O)N(C)N 2241247494 UQRVBHRCKWPSCT-BYPYZUCNSA-N 132.163 -1.053 50 10 AAGE N[C@@H]1C[C@@H]1NC(=O)C#CB(O)O 2241468013 FWGHUNZBLAYMIX-UHNVWZDZSA-N 167.961 -2.782 50 10 AAGE COC(=O)c1csnc1B(O)O 2241492718 DZFGFVJREYFAQR-UHFFFAOYSA-N 186.985 -1.391 50 10 AAGE NNC(=O)C1CC(B(O)O)C1 2241495092 GWXLBWODZPXYIB-UHFFFAOYSA-N 157.966 -1.771 50 10 AAGE 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NWLSXKIMMWVQKL-UHFFFAOYSA-N 190.992 -1.239 50 10 AAGE C[C@@H](CO)NC(=O)C#CB(O)O 2241476384 RATZASYTYKRKRB-YFKPBYRVSA-N 170.961 -2.501 50 10 AAGE OB(O)c1cnn2ncccc12 238638237 FYIMXRYOAFHBIW-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE N#Cc1cnc(N)c(B(O)O)c1 238676778 GQXUDMDOAZOFKE-UHFFFAOYSA-N 162.945 -1.785 50 10 AAGE C/C(=C\C(=O)NN)C(=O)NN 306195269 IJBGWLSDVLULOW-NSCUHMNNSA-N 158.161 -2.088 50 10 AAGE CN(CC(=O)NN)C(N)=O 307220376 OTLJHYXGLXMRQJ-UHFFFAOYSA-N 146.150 -2.013 50 10 AAGE C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)C(=O)NN 308176535 APMGLRZHDSCHJE-QMKXCQHVSA-N 194.187 -3.560 50 10 AAGE N#CC1(O)CCN(C(=O)C(=O)O)CC1 606272364 KTNKONCWFBFMJU-UHFFFAOYSA-N 198.178 -1.052 50 10 AAGE N=[C]CNC(=O)C1=C=C=C(C=O)N1 885197703 ISKSLZUIJRUOKB-UHFFFAOYSA-N 176.155 -1.047 50 10 AAGE NNC1=N[C@H](Cl)N[C@@H]2NCN[C@H]12 885688268 XEFSYDHXEOVFFF-TXQLHFEISA-N 190.638 -2.181 50 10 AAGE C[C@@H](O)[C@@H]1CCN1CC(=O)NN 1880869671 ZFWGWQPMBBGNRB-RITPCOANSA-N 173.216 -1.569 50 10 AAGE C[C@H](O[C@H](C)C(=O)NN)C(=O)O 1881651359 CZWZWXQAUSYHFY-DMTCNVIQSA-N 176.172 -1.146 50 10 AAGE CCOCC(=O)NCC#CB(O)O 1883751116 SLHLKLBXAVPOMH-UHFFFAOYSA-N 184.988 -1.846 50 10 AAGE NNC(=O)C(=O)N[C@@H]1[C@@H]2CCCO[C@H]21 1884444298 BMBHOAICVPWMRP-KVQBGUIXSA-N 199.210 -1.730 50 10 AAGE Cn1cc(CNCB(O)O)nn1 1923937963 BVSBTWBKMDDFID-UHFFFAOYSA-N 169.981 -2.083 50 10 AAGE O=C(O)C=CC(=O)NNCCO 1929831779 IEWOEJGRDPWEAF-UHFFFAOYSA-N 174.156 -1.760 50 10 AAGE CCCN(CCN)C(=O)C#CB(O)O 2241468562 QJFKEONATGVYFQ-UHFFFAOYSA-N 198.031 -1.801 50 10 AAGE O=C(C#CB(O)O)N1CCC12CNC2 2241468597 QXRKWAFLHHGPET-UHFFFAOYSA-N 193.999 -2.424 50 10 AAGE CNC(=O)c1ncc(C)cc1B(O)O 2241475071 PYVHPECWNLDTEI-UHFFFAOYSA-N 193.999 -1.571 50 10 AAGE C#C[C@H](CCC)NC(=O)C#CB(O)O 2241479518 ZORYYXXBJFNANU-MRVPVSSYSA-N 193.011 -1.080 50 10 AAGE NNC(=O)[C@@H]1CC[C@@H]2CNC[C@@H]2O1 2242190761 ZFKNTSQPYPNLCP-VQVTYTSYSA-N 185.227 -1.257 50 10 AAGE NN[C@H](C(=O)O)[C@@H](Cl)C(=O)O 19172136 GWLHLYRBOKYJEU-NCGGTJAESA-N 182.563 -1.405 50 10 AAGE NNC(=O)C1=CNC(=O)NC1 39136561 AJYHCMLJCXNROF-UHFFFAOYSA-N 156.145 -1.827 50 10 AAGE NNC(=O)[C@@H](N)CC(N)=O 69635754 UVBHHXZVPJGUMH-REOHCLBHSA-N 146.150 -2.821 50 10 AAGE COc1cc(B(O)O)cc(C(C)=O)n1 206086386 LBGAFBQIPUWREC-UHFFFAOYSA-N 194.983 -1.027 50 10 AAGE NNC(=O)CNC(=O)[C@H](N)CO 238657531 OSZZCORIDWKSTK-GSVOUGTGSA-N 176.176 -3.588 50 10 AAGE CCC(=O)NNC1=NC(=O)C(=O)N1 306667817 JUYZINAPNMHEQM-UHFFFAOYSA-N 184.155 -1.970 50 10 AAGE NC(=O)C(=O)NN/C=C1/N=C=[C]N1 885199776 XVTVPRVODVAJQO-UHFFFAOYSA-N 180.147 -2.519 50 10 AAGE N#CC1=C=C=C(N2CC(O)C2)NN1 885351349 BXZUTQZXEYXCMT-UHFFFAOYSA-N 176.179 -1.226 50 10 AAGE C[C@@H]1C[C@@]1(F)C(=O)NCC#CB(O)O 1878085886 UTYRQNAHSBFGCL-SVRRBLITSA-N 198.990 -1.134 50 10 AAGE CN(C)NC(=O)CCNCCO 1891642335 MWHMPJNKMXHGGG-UHFFFAOYSA-N 175.232 -1.449 50 10 AAGE CON(C(=O)C(=O)NN)C1CCC1 1954815676 WBTBCJNUUIHPDK-UHFFFAOYSA-N 187.199 -1.081 50 10 AAGE NCCCN=c1ncc(B(O)O)c[nH]1 2210061602 WIJFFLCYLFXIGW-UHFFFAOYSA-N 196.019 -2.661 50 10 AAGE CN(C(=O)C#CB(O)O)[C@@H]1CCNC1 2241478954 OGBFVVAJGTVITE-SSDOTTSWSA-N 196.015 -2.178 50 10 AAGE C[S@@](=O)NCCC#CB(O)O 2241901647 AOOWOESBHZIIHM-LLVKDONJSA-N 175.018 -1.725 50 10 AAGE NNC(=O)C(=O)N1CCC[C@H](O)C1 42472207 PJNJRFHNYYOVPM-YFKPBYRVSA-N 187.199 -2.040 50 10 AAGE CC[C@H](C(=O)NN)N1CCNCC1 82469766 FWJFZFKXSUQNOO-SSDOTTSWSA-N 186.259 -1.340 50 10 AAGE N#CC1=C[C@@H](O)[C@H](O)[C@H](CO)O1 211484105 XEFNLUVAZWYCPL-VQVTYTSYSA-N 171.152 -1.493 50 10 AAGE OB(O)c1ccc(-c2nnco2)nc1 238646762 UKULTJPSGGOCRQ-UHFFFAOYSA-N 190.955 -1.189 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@H]2C1 307584349 ICPOYIBCLZJEGG-SYDPRGILSA-N 169.184 -1.545 50 10 AAGE O=C/C=C\C(=O)NCC(=O)O 307758653 PISMRXQXORUPFN-UPHRSURJSA-N 157.125 -1.058 50 10 AAGE CNC(=O)NNC(=O)[C@@H]1[C@H]2COC[C@H]21 823425177 NWZIQTHJLOLVJK-FMCRUOTFSA-N 199.210 -1.161 50 10 AAGE N#CC1=C=NC(C2=C=NNN2)=N[C]1N 885201881 QCQUYBHKRBCCKE-UHFFFAOYSA-N 186.158 -1.457 50 10 AAGE NNC(=O)C1=C=NN2CCN[C-]12 885288096 YKAISXNPSBOSOS-UHFFFAOYSA-N 166.164 -2.104 50 10 AAGE NNC(=O)[C@H](F)[C@H]1CCNC1 1119236854 GPILXEHGXOVAMB-CRCLSJGQSA-N 161.180 -1.076 50 10 AAGE COC[C@@H](C(=O)NN)N(C)CCF 1917255236 NBFBFJYBHSOUSA-LURJTMIESA-N 193.222 -1.107 50 10 AAGE Cc1n[nH]cc1C(=O)NNCCO 1929831379 AWAQKGYODLRTHK-UHFFFAOYSA-N 184.199 -1.055 50 10 AAGE C=C1CON(C(=O)C(=O)NN)C1 1930172614 SSECBUMVFWSUPJ-UHFFFAOYSA-N 171.156 -1.694 50 10 AAGE NNC(=O)NCC1COC1 1933413057 MVOJPDUGUNDESE-UHFFFAOYSA-N 145.162 -1.194 50 10 AAGE CC(CO)(CO)[C@H](N)[C@H](O)C#N 1952957669 BJZLFOGGHJXWFP-PHDIDXHHSA-N 174.200 -1.811 50 10 AAGE NNC(=O)[C@@H]1[C@@H]2CS(=O)(=O)C[C@@H]21 1953770959 NEPLJEOPDMFOPN-ZXFHETKHSA-N 190.224 -1.733 50 10 AAGE CC1(C)OCCN[C@@H]1C(=O)NN 2241259904 NCMGVZYVUHJQRW-RXMQYKEDSA-N 173.216 -1.257 50 10 AAGE C[C@@H](CO)NC(=O)C1(B(O)O)CC1 2241473404 JOWDGYALMJLTJB-YFKPBYRVSA-N 187.004 -1.510 50 10 AAGE CCn1cc(B(O)O)cc1C(=O)NC 2241474114 WTPNKGZAXYUJPH-UHFFFAOYSA-N 196.015 -1.453 50 10 AAGE CCNC(=O)c1cc(B(O)O)n[nH]1 2241475455 XWJYNFAOYRAERP-UHFFFAOYSA-N 182.976 -2.161 50 10 AAGE CCOC[C@H](C)NC(=O)C#CB(O)O 2241478415 DUUWLOXFTWDTGW-ZETCQYMHSA-N 199.015 -1.457 50 10 AAGE NC[C@H]1C[C@@H]1NC(=O)C#CB(O)O 2241479490 ZBZWBNMEGDTTRD-RITPCOANSA-N 181.988 -2.535 50 10 AAGE C[C@@](O)(C#N)[C@H](O)C(=O)O 104734950 FKGDUKDFBWCKQU-NQXXGFSBSA-N 145.114 -1.294 50 10 AAGE CS(=O)(=O)CCB(O)O 203427152 ONTICYYZLXUHEG-UHFFFAOYSA-N 151.980 -1.496 50 10 AAGE NNC(=O)C(=O)NCc1ncon1 231840915 KFTRONZSFQKHTF-UHFFFAOYSA-N 185.143 -2.324 50 10 AAGE NNC(=O)N1CCC[C@H]2C(=O)NC[C@@H]21 232296333 KKXCKPMOOXHWTE-RITPCOANSA-N 198.226 -1.220 50 10 AAGE NNC(=O)CN1CC[C@@](O)(CO)C1 307525961 HIQDSFVACBZRDF-ZETCQYMHSA-N 189.215 -2.595 50 10 AAGE NC(=O)N/N=C/[C@H](O)CC(=O)O 307852431 ABIQLZDXXHSREG-DEVJWOQWSA-N 175.144 -1.524 50 10 AAGE NC(=O)NN=C/C=C\C=NNC(N)=O 308268187 MPJVWCCKIFDYHO-DSYZRMFOSA-N 198.186 -1.149 50 10 AAGE CN(CC1(O)CC1)C(=O)C#CB(O)O 1888981057 QYLYKXWRWJADCV-UHFFFAOYSA-N 196.999 -2.015 50 10 AAGE C[C@H]1COC[C@@H](C(=O)NN)N1 1923935378 CTVISXUPICIVKS-WHFBIAKZSA-N 159.189 -1.647 50 10 AAGE CO[C@@H]1CN(CC(=O)NN)C[C@H]1F 1928692554 QNYYDIGJLYWHHS-PHDIDXHHSA-N 191.206 -1.355 50 10 AAGE O=C(NNCCO)[C@@]12COC[C@@H]1C2 1929836108 CYHSBYNUJCWHNP-XPUUQOCRSA-N 186.211 -1.364 50 10 AAGE COC1([C@@H](N)B(O)O)CCC1 1931497815 WLCGUSIONHLSCQ-RXMQYKEDSA-N 158.994 -1.105 50 10 AAGE NNC(=O)[C@@H]1CC=CCN1 1953167047 HJZJFCUURVEGTD-YFKPBYRVSA-N 141.174 -1.106 50 10 AAGE NNC(=O)N1CC[C@]2(CNC(=O)C2)C1 1955976631 MFWJDTJYRHFHIM-QMMMGPOBSA-N 198.226 -1.218 50 10 AAGE C[C@H](O)CNC(=O)C1(B(O)O)CC1 2241473819 QPVZKHYACWMFRX-YFKPBYRVSA-N 187.004 -1.510 50 10 AAGE CC#CC(C)(C)NC(=O)C#CB(O)O 2241478829 LYFJELMYVMLJDS-UHFFFAOYSA-N 193.011 -1.080 50 10 AAGE CCN(CCCO)C(=O)C#CB(O)O 2241479402 XIWHPSBHPOBRLA-UHFFFAOYSA-N 199.015 -1.767 50 10 AAGE NNC(=O)[C@H]1C(=O)NN=C1O 39065292 MIEMWOKDONFVGF-UHFFFAOYSA-N 158.117 -2.406 50 10 AAGE Cc1nn(C)c(/N=C/N)c1C(=O)NN 141394174 YKWATBRAQLNJHI-UHFFFAOYSA-N 196.214 -1.049 50 10 AAGE C[C@@H](N[C@@H]1NC(=O)OC1=O)C(=O)O 238380026 DGRSHQCDDLNUSC-PWNYCUMCSA-N 188.139 -1.358 50 10 AAGE CO[C@H]1C=C[C@](OC)(C(=O)NN)O1 306330219 OFMUTCFZNBXTOJ-IYSWYEEDSA-N 188.183 -1.122 50 10 AAGE C[C@@H]1OCCN[C@@H]1C(=O)NN 307307829 NIDIHNNXBZHZIE-WHFBIAKZSA-N 159.189 -1.647 50 10 AAGE N#C[C@H](O)C[C@@H](O)[C@@H](O)CO 307650029 HBUAPQSBFUMCOW-PBXRRBTRSA-N 161.157 -2.025 50 10 AAGE CON=C(C(=O)NN)c1cc[nH]n1 382588422 UGZGFDWHIIMYAI-UHFFFAOYSA-N 183.171 -1.250 50 10 AAGE CO[C@H]1C[C@H]1C(=O)NNC(N)=S 689976634 ONJICMOEJKMRCW-DMTCNVIQSA-N 189.240 -1.114 50 10 AAGE NNC(=O)[C@@H](N)[C@@H]1CCOC1 1929926060 IFKDRNRESJNQFY-UHNVWZDZSA-N 159.189 -1.660 50 10 AAGE C[C@@H](O)[C@@H]1CN(C(=O)NN)CCO1 1954189024 ILMPGQFRAAVLMC-RITPCOANSA-N 189.215 -1.349 50 10 AAGE CC(C)CN=c1ncc(B(O)O)c[nH]1 2210059570 BFYOXYGYIPGIMP-UHFFFAOYSA-N 195.031 -1.354 50 10 AAGE C[C@H](CO)C(=O)NCB(O)O 2241246794 PZFZJZAWTFLLSX-SCSAIBSYSA-N 160.966 -2.257 50 10 AAGE C[C@@H](CCCO)NC(=O)C#CB(O)O 2241471301 ILJONJSHOWQZIJ-ZETCQYMHSA-N 199.015 -1.721 50 10 AAGE N[C@H]1COC[C@@H]1NC(=O)C#CB(O)O 2241476051 KQNIVNWCVQOAIM-WDSKDSINSA-N 197.987 -3.156 50 10 AAGE CCn1cc(B(O)O)c(C(N)=O)n1 2241494728 BVVRKUPBTHPSCO-UHFFFAOYSA-N 182.976 -2.318 50 10 AAGE Cc1noc(CNC(=O)C(=O)NN)n1 45014846 FELQXHVWZHOKHU-UHFFFAOYSA-N 199.170 -2.016 50 10 AAGE C[C@@H](C(=O)NN)N(C)CC(N)=O 82467298 WVDOOSWETCDVQA-BYPYZUCNSA-N 174.204 -2.218 50 10 AAGE NNC(=O)CN1CCS(=O)CC1 82469743 ZBWJIUOHIDTWMH-UHFFFAOYSA-N 191.256 -1.959 50 10 AAGE COCC[C@H](NC(C)=O)C(=O)NN 238329629 DDQGYMUBYQSHDZ-LURJTMIESA-N 189.215 -1.483 50 10 AAGE NNC(=O)[C@@H]1CO[C@H](CCO)C1 238554890 JFWGSCGSYHKHOX-NTSWFWBYSA-N 174.200 -1.236 50 10 AAGE [C-]#[N+][C@]1(O)C=C[C@](O)([C@H](C)O)[C@H]1O 306341685 YDESHCUKJUUXAP-YWIQKCBGSA-N 185.179 -1.363 50 10 AAGE CC[S@](=O)CC(=O)NNC(C)=O 307948539 AQMVJUGNXNQOCW-LBPRGKRZSA-N 192.240 -1.078 50 10 AAGE CO[C@@H](C)CCC(=O)NCB(O)O 702022236 SIPXIMAHYWPOEH-LURJTMIESA-N 189.020 -1.070 50 10 AAGE CN1C#C[C-](/C=C/B(O)O)N1 885240217 BSJASOYRUQZNJX-DUXPYHPUSA-N 150.954 -1.503 50 10 AAGE O=C(NCC#CB(O)O)[C@@]12CC[C@H]1C2 1895048797 DNLOGRJDMRIYCN-IONNQARKSA-N 193.011 -1.082 50 10 AAGE OB(O)c1cncnc1-n1cncn1 1956963826 DHNAEOXBUDIOOF-UHFFFAOYSA-N 190.959 -2.263 50 10 AAGE CONC(=O)C1(B(O)O)CC1 2241473145 DQWMNYYQUSHPCK-UHFFFAOYSA-N 158.950 -1.329 50 10 AAGE O=C([C@@H]1C[C@@H]1B(O)O)N1CCCCN1 2241478368 CXZLMXVXMQYGFZ-RQJHMYQMSA-N 198.031 -1.024 50 10 AAGE CC(C)(CN)CNC(=O)C#CB(O)O 2241479169 SNLSIACGBZSNBL-UHFFFAOYSA-N 198.031 -1.897 50 10 AAGE NNC(=O)[C@@H]1C[C@]12C[C@H]2N 2241528250 HLBYSXOKOFNMOO-RPDRRWSUSA-N 141.174 -1.286 50 10 AAGE NC[C@H]1CCN(CCC(=O)NN)C1 82468081 RONOFPOERNFVRL-SSDOTTSWSA-N 186.259 -1.353 50 10 AAGE CC(=O)N/N=C(/N)C(=O)NN 238145261 DNBMRCURFUTUTA-UHFFFAOYSA-N 159.149 -2.615 50 10 AAGE O=[S@@](CCO)[S@@](=O)CCO 238680617 FEHVOPHHWSDWPK-NXEZZACHSA-N 186.254 -1.617 50 10 AAGE NNc1cccc(B(O)O)c1 307040059 IAZPQSCWAUIBND-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE OB(O)C1CNNC1 585662734 DMRMOMSTOABGNW-UHFFFAOYSA-N 115.929 -2.063 50 10 AAGE N#CC1=C(N2CC[C@@H](O)C2)NNC#C1 885557987 GUBPHVYLWVDOPO-MRVPVSSYSA-N 190.206 -1.143 50 10 AAGE CO[C@@H]1C[C@H]1C(=O)NCC#CB(O)O 1877555742 GPVXOCDHLKTFCA-RNFRBKRXSA-N 196.999 -1.847 50 10 AAGE C=C(CN1CC(N(C)C)C1)B(O)O 1883745015 UVGCPXDYMKEJDB-UHFFFAOYSA-N 184.048 -1.200 50 10 AAGE CC1(F)CN(C(=O)C(=O)NN)C1 1930276761 HIESHAVMOXAXGJ-UHFFFAOYSA-N 175.163 -1.453 50 10 AAGE C[C@H]1C[C@H](CO)CN1CC(=O)NN 1934979889 BMFXCMWUUPWNKO-BQBZGAKWSA-N 187.243 -1.321 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2C[C@H]1[C@@H]1C[C@@H]21 1955370185 VJOPVIUPOLJXBY-JWXFUTCRSA-N 195.222 -1.157 50 10 AAGE CC[C@@H](CC#N)NC(=O)C#CB(O)O 2241467988 FMSYDBXDSJOKET-ZETCQYMHSA-N 193.999 -1.190 50 10 AAGE C[C@H](N)CN(C)C(=O)C#CB(O)O 2241468956 XPDXGFQXZBWKGQ-LURJTMIESA-N 184.004 -2.193 50 10 AAGE CCC#CC(=O)NCB(O)O 2297010847 YSRLTCDORVQPES-UHFFFAOYSA-N 154.962 -1.472 50 10 AAGE NNC(=O)Cc1n[nH]c(=O)[nH]c1=O 5479815 OZVXUAIFSUWPGC-UHFFFAOYSA-N 185.143 -3.009 50 10 AAGE N#C/C(N)=C(\C#N)NC=O 39192588 WLJRXWKOEDTVIV-PLNGDYQASA-N 136.114 -1.050 50 10 AAGE CNC[C@H](C)C(=O)NN 58838249 XYSGMIXXRCWMGF-BYPYZUCNSA-N 131.179 -1.168 50 10 AAGE Cc1cncc(O)c1B(O)O 306582347 QGOHSWCGVPJRNZ-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE O[C@@H]1[C@H](Cl)[C@H](O)OC[C@H]1O 307172639 QBZSYPGANFVRKW-MGCNEYSASA-N 168.576 -1.336 50 10 AAGE COC(=O)C(=O)NNC(=O)N(C)C 308319709 ZQGVQUQORHTIPD-UHFFFAOYSA-N 189.171 -1.538 50 10 AAGE N#CCC(=O)NNC(=O)CCO 379329084 SKXFNJZTPDNYBJ-UHFFFAOYSA-N 171.156 -1.570 50 10 AAGE CNC(=O)NN=Cc1nnn(C)n1 379393360 UMOFIHSBIGFTLE-UHFFFAOYSA-N 183.175 -1.527 50 10 AAGE CC#CC(=O)NNC(N)=O 606243236 HYJJSEYEWWXTLG-UHFFFAOYSA-N 141.130 -1.291 50 10 AAGE C[C@H](O)CN(CC(=O)NN)C1CC1 692098439 WLJHBBTUDDFPLZ-LURJTMIESA-N 187.243 -1.179 50 10 AAGE O=C(NCB(O)O)[C@]12COC[C@H]1C2 701932972 UACUFIPNMVVNJB-IYSWYEEDSA-N 184.988 -1.849 50 10 AAGE NNC(=O)CN1CC2(CCCO2)C1 702939710 SVJUGVOXKJDBNZ-UHFFFAOYSA-N 185.227 -1.159 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2COC[C@H]21 1882697303 GOXZBPHJLNGTOK-RFZPGFLSSA-N 185.183 -2.167 50 10 AAGE C[C@H]1[C@@H](O)CCN1C(=O)C(=O)NN 1914255371 NGEAYUUOYHYKNZ-WHFBIAKZSA-N 187.199 -2.042 50 10 AAGE NNC(=O)[C@@H](F)C1(O)CNC1 1953324613 OGDOJSRJOLVHBZ-GSVOUGTGSA-N 163.152 -2.351 50 10 AAGE C[C@@H]1CC[C@@H]1NC(=O)C#CB(O)O 2241475768 FBPMHISCULMIQD-RQJHMYQMSA-N 181.000 -1.084 50 10 AAGE CNCCCNC(=O)C#CB(O)O 2241478543 HKQSVEVTSMCGAC-UHFFFAOYSA-N 184.004 -2.273 50 10 AAGE NC(=O)C(=O)NNC(=O)C(N)=O 238619840 FIRKQRDHXLZLMI-UHFFFAOYSA-N 174.116 -3.896 50 10 AAGE N#Cc1cncc(B(O)O)c1C#N 238635993 NNISTFWSCMLCSF-UHFFFAOYSA-N 172.940 -1.495 50 10 AAGE NNC(=O)C[C@H](N)[C@H](O)[C@@H](O)CO 238659034 SONPCMUHTVOGBX-FKZODXBYSA-N 193.203 -3.592 50 10 AAGE CN1CCO[C@@H](C(=O)NNC=O)C1 306235388 AJFPANDLQRKTEB-ZCFIWIBFSA-N 187.199 -1.906 50 10 AAGE COc1c(NN)cccc1B(O)O 306814518 BCYJXGOZNWMVEI-UHFFFAOYSA-N 181.988 -1.339 50 10 AAGE NNC(=O)N[C@@H]1CCN(C(N)=O)C1 306907651 FAPDSTHGSFTAAW-SCSAIBSYSA-N 187.203 -1.688 50 10 AAGE O=C[C@H](O)[C@H](O)[C@@H](O)/C=C\B(O)O 308116843 WRTNKKAVXFZOQQ-GJSKJJDASA-N 189.960 -3.164 50 10 AAGE Cn1cc(C(=O)NCB(O)O)nc1O 708425305 OQMSPBHSLNRJJH-UHFFFAOYSA-N 198.975 -2.133 50 10 AAGE CON=CC(=O)NNc1nc[nH]n1 1648832220 ZXVOLBDMYGTPIZ-UHFFFAOYSA-N 184.159 -1.120 50 10 AAGE NNC(=O)[C@@H](N)CCF 1879950869 GXHKDYCRCRLAIL-VKHMYHEASA-N 135.142 -1.337 50 10 AAGE NNC(=O)CN1CCOC[C@H](F)C1 1887281816 USHYYMYQQWKOLA-ZCFIWIBFSA-N 191.206 -1.353 50 10 AAGE C=C[C@](C)(O)C(=O)NN 1923441869 HTOJMNMLIJTKJL-YFKPBYRVSA-N 130.147 -1.087 50 10 AAGE N[C@@H](B(O)O)[C@H]1C[C@H]2CC[C@H]1O2 1953416720 CUIKLNIGZMORKE-XZBKPIIZSA-N 171.005 -1.107 50 10 AAGE OB(O)c1nccn2ccnc12 2208980623 GIABWZAKIAFVOG-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE NCCNC(=O)C1CC(B(O)O)C1 2241480733 OMHYCMOSASKURK-UHFFFAOYSA-N 186.020 -1.686 50 10 AAGE C[C@@H]1[C@@H](O)CN1C[C@@H]1C[C@H]1C(=O)NN 2297131910 FQXWYVMJXOIPBH-CWKFCGSDSA-N 199.254 -1.323 50 10 AAGE O[C@@H]1CN[C@H](CCl)[C@@H](O)[C@@H]1O 238672943 UJTPCYUIJJZFFA-KVTDHHQDSA-N 181.619 -1.720 50 10 AAGE O[B-](O)(O)c1ccc2c(n1)CCC2 238852703 HDXZZBKXFXHBQD-UHFFFAOYSA-N 179.992 -1.307 50 10 AAGE O=CNNC(=O)c1ccc[n+]([O-])c1 306211000 DBZZMUMVPRBYLH-UHFFFAOYSA-N 181.151 -1.289 50 10 AAGE O=CNNC(=O)CC1OCCCO1 306317744 HVTBSSUKXMTXNT-UHFFFAOYSA-N 188.183 -1.083 50 10 AAGE C=CC[S@](=O)CC(=O)NN 526865206 MPNGPSSROINUBL-JTQLQIEISA-N 162.214 -1.089 50 10 AAGE CC(=O)N(C)CC(=O)NNC(N)=O 700841612 QMADNMAUGJZSJA-UHFFFAOYSA-N 188.187 -1.836 50 10 AAGE CNNC(=O)CCn1cncn1 704682342 YIMNCKGPTWBMRX-UHFFFAOYSA-N 169.188 -1.081 50 10 AAGE C#CCOCC(=O)NCB(O)O 1881028295 IAVJPKTUNGLMSJ-UHFFFAOYSA-N 170.961 -2.236 50 10 AAGE O=S(=O)(NCB(O)O)C1COC1 1923224492 IVRGRWPJOLYDGG-UHFFFAOYSA-N 195.005 -2.683 50 10 AAGE CC1(O)CN(CC2(C(=O)NN)CC2)C1 1931266484 GTBGMFJWOBQVTH-UHFFFAOYSA-N 199.254 -1.177 50 10 AAGE N#C[C@H](O)C[C@@H](O)CO 1951518641 PXHSPDBSGURILY-RFZPGFLSSA-N 131.131 -1.386 50 10 AAGE CN(N)C(=O)c1ncc[nH]c1=O 1953370529 SSOZGMBDIQFRLN-UHFFFAOYSA-N 168.156 -1.284 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@H]2C[C@]2(O)C1 1956823770 JVUJPHGKUSHZNF-FJXKBIBVSA-N 199.254 -1.179 50 10 AAGE C#CCN=c1cc(B(O)O)cc[nH]1 2209388531 WWHWWISYCGMBSJ-UHFFFAOYSA-N 175.984 -1.772 50 10 AAGE O=C(C#CB(O)O)N1C[C@H]2C[C@@H](C1)C2 2241468069 GVTZOTMEQBROHN-OCAPTIKFSA-N 193.011 -1.130 50 10 AAGE NCC(CN)NC(=O)C#CB(O)O 2241478807 LOTDFXFRCYQKGH-UHFFFAOYSA-N 184.992 -3.596 50 10 AAGE OC[C@H]1O[C@H](O)[C@H](Cl)[C@@H](O)[C@@H]1O 13783288 SNGNCYILSHZBLM-UKFBFLRUSA-N 198.602 -1.975 50 10 AAGE Cc1cc(B(O)O)ncn1 205041067 JHAMQRIDIQXAJM-UHFFFAOYSA-N 137.935 -1.535 50 10 AAGE Cc1cccc(B(O)O)c1C(N)=O 205263803 JBCNIEFZSUHIIV-UHFFFAOYSA-N 178.984 -1.226 50 10 AAGE COc1nc(CN)ccc1B(O)O 238381330 QTZZMCNRYDIYLU-UHFFFAOYSA-N 181.988 -1.771 50 10 AAGE COc1ncc(O)cc1B(O)O 238419825 XZJNBWQZZVNMEK-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE OB(O)c1nccc2nccnc12 238639206 LMHWKACEYBUJGH-UHFFFAOYSA-N 174.956 -1.295 50 10 AAGE CNC(=O)NNC(=O)CC1COC1 306498773 GWJJEXDQAGCLOZ-UHFFFAOYSA-N 187.199 -1.017 50 10 AAGE NNC(=O)N1C[C@H](O)C[C@H]1CO 606252154 JCHPKMNTJQYBSL-CRCLSJGQSA-N 175.188 -2.003 50 10 AAGE CC[S@](=O)NCC#CB(O)O 1880469129 YDDNABXPKPOAKA-NSHDSACASA-N 175.018 -1.725 50 10 AAGE C[C@H](C(=O)NN)N1CC=CC[C@@H]1CO 1884398572 FDCIJTZPCNMAPB-HTQZYQBOSA-N 199.254 -1.012 50 10 AAGE CN(NC(N)=O)S(C)(=O)=O 1888554749 PJUYCDHLFLZHEX-UHFFFAOYSA-N 167.190 -1.539 50 10 AAGE N#CC(N)=C(C#N)N=CNN 1911599343 WRAVHIIGHHERKU-UHFFFAOYSA-N 150.145 -1.305 50 10 AAGE COC1([C@H](N)B(O)O)CC1 1931496675 HNVADSQYEFRCHZ-BYPYZUCNSA-N 144.967 -1.495 50 10 AAGE CN1CCN(C(=O)NN)[C@@H]2C[C@H]21 1953415308 ULWIJTGBYUDZCJ-PHDIDXHHSA-N 170.216 -1.042 50 10 AAGE N[C@H]1C[C@H]1CNC(=O)C#CB(O)O 2241468531 QASVIUWTYSBQCR-WDSKDSINSA-N 181.988 -2.535 50 10 AAGE NNC(=O)C(=O)NCC[C@H]1CCO1 2242561073 OXKFOJLKJIRNID-YFKPBYRVSA-N 187.199 -1.729 50 10 AAGE NNC(=O)C(=O)NC[C@H]1[C@@H]2CCO[C@@H]21 2297041336 ZSHLIUFYBSKORX-ZLUOBGJFSA-N 199.210 -1.873 50 10 AAGE CC(C)n1nnc(CC(=O)NN)n1 4928812 CZHLGLCJWIBQPT-UHFFFAOYSA-N 184.203 -1.214 50 10 AAGE C/C(NN)=C1\C(=O)OC(=O)N(C)C1=O 104558561 IXBCRRKDUOZONX-ONEGZZNKSA-N 199.166 -1.141 50 10 AAGE CN(CC(=O)NN)[C@H]1CCOC1 133543994 HFWKBXXPUYOBIS-LURJTMIESA-N 173.216 -1.303 50 10 AAGE NC(=O)NN=C(C=NO)C=NO 307871398 MFJQSYNIQFOMQH-UHFFFAOYSA-N 173.132 -1.069 50 10 AAGE CCS(=O)(=O)CC(=O)NNC=O 379330377 AZBUEEBNBRYWRN-UHFFFAOYSA-N 194.212 -1.802 50 10 AAGE COCn1cccc1B(O)O 1880251970 JRURAZADLAROBR-UHFFFAOYSA-N 154.962 -1.228 50 10 AAGE NNC(=O)CN1CCOC[C@H]1CF 1882475786 BOEKEXNQNQNAFI-ZCFIWIBFSA-N 191.206 -1.353 50 10 AAGE NNC(=O)C(=O)N1CC=CC[C@@H]1CO 1884400017 OATBUTPEVQLMCG-ZCFIWIBFSA-N 199.210 -1.874 50 10 AAGE O=C(NNCCO)c1cc[nH]n1 1929830351 JHDOYIDHZWLQJO-UHFFFAOYSA-N 170.172 -1.364 50 10 AAGE N#C[C@H](O)[C@H](N)c1nc[nH]n1 1952884473 HKLGLUAXSIZBSW-IMJSIDKUSA-N 153.145 -1.311 50 10 AAGE CN(C)NC(=O)c1cc(B(O)O)c[nH]1 2241478448 FMQZZRKNWHVUEE-UHFFFAOYSA-N 197.003 -2.099 50 10 AAGE C[C@@H](O)CNC(=O)[C@H]1C[C@H]1B(O)O 2241496394 SDFDFNTZDYZDSX-NGJCXOISSA-N 187.004 -1.654 50 10 AAGE C[C@@H](O)C(=O)NCC=CB(O)O 2241554742 GELSUHAEOIQEGB-RXMQYKEDSA-N 172.977 -1.948 50 10 AAGE CC(=O)NNC(=O)CN(C)CCN 54419200 CXADGVJAJVTMDW-UHFFFAOYSA-N 188.231 -1.956 50 10 AAGE NNC(=O)c1cnc(N)nc1 147096123 VDWIDRNXQHILET-UHFFFAOYSA-N 153.145 -1.338 50 10 AAGE Cc1ncc(CO)cc1B(O)O 238473982 CZMTZVAAJPSYIL-UHFFFAOYSA-N 166.973 -1.438 50 10 AAGE NC(=O)CSCC(=O)NNC=O 308072049 CHSJUWMPCVOOAR-UHFFFAOYSA-N 191.212 -2.018 50 10 AAGE CCN(CC(=O)NN)C[C@H](C)O 692161838 XNEWQMVVJBZXMP-LURJTMIESA-N 175.232 -1.321 50 10 AAGE Cc1nnsc1B(O)O 698165951 CURWKOMATXTOMA-UHFFFAOYSA-N 143.964 -1.474 50 10 AAGE Cn1ncc(C(=O)NCB(O)O)n1 702028843 HQQJLJLTYQVXNU-UHFFFAOYSA-N 183.964 -2.443 50 10 AAGE C[C@@]1(C(=O)NCB(O)O)CCCO1 706503706 FDIFSYXGKMTDBN-ZETCQYMHSA-N 187.004 -1.316 50 10 AAGE CN(N)C(=O)c1cn(C)c(=O)n1C 710383234 ZQIJJQKXPQXVHS-UHFFFAOYSA-N 184.199 -1.331 50 10 AAGE N#Cc1cnc(C(=O)NN)cn1 716253041 CWBQJHLAZOSWHO-UHFFFAOYSA-N 163.140 -1.048 50 10 AAGE CC(C)(N)[C@H](O)C(=O)NN 1880008909 JTIQEKKVOYTLPS-GSVOUGTGSA-N 147.178 -1.926 50 10 AAGE COC(=O)c1cc(B(O)O)n(C)n1 1883685337 FKHAYLJAITWQEM-UHFFFAOYSA-N 183.960 -2.114 50 10 AAGE NNC(=O)C(=O)N1[C@@H]2COC[C@H]1C2 1883761785 YNUVSSPYEYJMFL-SYDPRGILSA-N 185.183 -2.024 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@H]2C[C@]2(CO)C1 1899622778 KXBANBPEDVATIR-LKEWCRSYSA-N 199.254 -1.321 50 10 AAGE CC1(C)C[C@@H](O)CN1CC(=O)NN 1934003359 HCWLRFRVBSHVID-ZCFIWIBFSA-N 187.243 -1.179 50 10 AAGE CC(C)N1CC[C@](N)(B(O)O)C1 1953479464 XFWFLIPZLDKJQP-SSDOTTSWSA-N 172.037 -1.190 50 10 AAGE OB(O)c1ccc2nccn2n1 1953617388 ZRGHZURDHFZGMJ-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE CCN(C)c1ncncc1B(O)O 1954089297 MJUXOIMQOSPNJS-UHFFFAOYSA-N 181.004 -1.388 50 10 AAGE N[C@@H](B(O)O)[C@H]1CC1(F)F 2208932001 REBZXIVDXPABCA-PWNYCUMCSA-N 150.921 -1.019 50 10 AAGE CO[C@@H](C)C(=O)NCCC#CB(O)O 2241907098 AMCRFWWNHURFKZ-ZETCQYMHSA-N 199.015 -1.457 50 10 AAGE N#CCCNCC(=O)NN 5113490 VMWZQSWGDHUEPV-UHFFFAOYSA-N 142.162 -1.520 50 10 AAGE Cn1ccc(NC(=O)C(=O)NN)n1 86781267 POYKCOSPZVZVQX-UHFFFAOYSA-N 183.171 -1.652 50 10 AAGE NC(=O)N/N=C\[C@@H](N)CC(=O)O 220491975 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CN(C)NC(=O)C[C@H]1COCCN1 147249653 OSNNWCYPAWNNMO-ZETCQYMHSA-N 187.243 -1.042 50 10 AAGE COC(=O)NS(=O)(=O)N=C=O 157720741 YOGIMRFKLKPZJW-UHFFFAOYSA-N 180.141 -1.077 50 10 AAGE Cn1cc(C(=O)NNC(=O)CO)nn1 1437642524 XBHOHWBQZYHKLJ-UHFFFAOYSA-N 199.170 -2.432 50 10 AAGE O=C(NCC#CB(O)O)[C@@H]1CCCO1 1895239728 QLXZCSGAWAHKFB-ZETCQYMHSA-N 196.999 -1.703 50 10 AAGE C[C@H](CN1CCC1=O)C(=O)NN 1912296265 HARUYXSSQSFQCZ-RXMQYKEDSA-N 171.200 -1.155 50 10 AAGE O=C(CCc1cn[nH]c1)NNCCO 1929836324 HRGLISDQEBAYJQ-UHFFFAOYSA-N 198.226 -1.045 50 10 AAGE Cc1nc(B(O)O)n(C)n1 1930282446 BUCKZMKQTYCLHI-UHFFFAOYSA-N 140.939 -2.197 50 10 AAGE CN(C)NC(=O)CO[C@@H]1CCNC1 1932608384 CQMYWHKLULVCFL-SSDOTTSWSA-N 187.243 -1.042 50 10 AAGE NNC(=O)CN1CC2(CC2)C[C@H]1CO 1934333204 GIHLEEDANZETED-ZETCQYMHSA-N 199.254 -1.177 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@H]2C[C@H]1C[C@@H]2O 1956910771 GAIWHVJHBDFUCH-YWIQKCBGSA-N 199.254 -1.180 50 10 AAGE C#C[C@](C)(CC)NC(=O)C#CB(O)O 2241468180 IOLFQRAWAFUMNF-SECBINFHSA-N 193.011 -1.080 50 10 AAGE C#CC(=O)Nc1ccnc(B(O)O)c1 2241558768 ISIZBGRBSPXKAT-UHFFFAOYSA-N 189.967 -1.667 50 10 AAGE NC(=O)NC(=O)c1n[nH]cc1B(O)O 2241584662 RHYOJQKSMBNGNC-UHFFFAOYSA-N 197.947 -3.102 50 10 AAGE CCC(=O)NCCC#CB(O)O 2241909394 ZFRUYLVRXCRAJC-UHFFFAOYSA-N 168.989 -1.082 50 10 AAGE CCCC(=O)NNC(=N)C(N)=O 39139395 BVHALEPSOSLBOC-UHFFFAOYSA-N 172.188 -1.130 50 10 AAGE COc1ccc([B-](O)(O)O)cc1 196065613 BPATYHHKVNBQEE-UHFFFAOYSA-N 168.965 -1.182 50 10 AAGE OB(O)c1cccc(O)c1O 196866902 PNZNSTAZTCVTGR-UHFFFAOYSA-N 153.930 -1.222 50 10 AAGE O=CNN=Cc1cc(O)nc(O)n1 263609736 VJRDAHMZOASJSX-UHFFFAOYSA-N 182.139 -1.032 50 10 AAGE CNC(=O)CCSCC(=O)NN 399219924 VPLFQIQEFWDJHZ-UHFFFAOYSA-N 191.256 -1.154 50 10 AAGE N[C-]1N=C=C(B(O)O)S1 885233985 NMOHSGNHZPYBMP-UHFFFAOYSA-N 142.956 -1.296 50 10 AAGE CNC(=O)NNC(=O)C1(O)COC1 1543665652 YEECQGGNTHJEOK-UHFFFAOYSA-N 189.171 -2.292 50 10 AAGE COC[C@@H](OC)C(=O)NNCCO 1929836569 LLZSRKYAQVXTNA-ZCFIWIBFSA-N 192.215 -1.739 50 10 AAGE O=C(O)CNC(=O)NNCCO 1935197689 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COCCn1ccc(B(O)O)cc1=O 204846710 HBJBVOMFOBEQJL-UHFFFAOYSA-N 196.999 -1.826 50 10 AAGE O[B-]1(O)OO[B-](O)(O)OO1 256057134 PNIJRIIGBGFYHF-UHFFFAOYSA-N 153.648 -3.263 50 10 AAGE in-vitro NC1=CC=C[C@@H](B(O)O)C1=C=O 307682363 RHIIZENLFKYZMH-ZCFIWIBFSA-N 164.957 -1.000 50 10 AAGE C[C@@H]1C[C@H](NC(=O)C(=O)NN)CO1 401399312 PGJPIUXUYPJOJT-UHNVWZDZSA-N 187.199 -1.730 50 10 AAGE C[C@]1(C(=O)NCB(O)O)C[C@H]1F 702030901 RTQCUNIFAANCPW-XINAWCOVSA-N 174.968 -1.137 50 10 AAGE NCC(F)(F)CC(=O)NN 846673746 DXKIUDGOLZXBOB-UHFFFAOYSA-N 153.132 -1.040 50 10 AAGE C#CC(=O)NNc1nccn(C)c1=O 1160934326 BUDKCCWDCIVJFA-UHFFFAOYSA-N 192.178 -1.143 50 10 AAGE NNC(=O)CN1CC[C@@](F)(CO)C1 1917085908 BTFGCPWDRURYSP-ZETCQYMHSA-N 191.206 -1.617 50 10 AAGE C[C@@H](CN1CC(CO)C1)C(=O)NN 1929743361 PEEBFTFCVQWTQP-LURJTMIESA-N 187.243 -1.464 50 10 AAGE C[C@@H](O)[C@@H](N)C(=O)NN(C)C 1953344050 APOPFPMGCYSXQC-RFZPGFLSSA-N 161.205 -1.713 50 10 AAGE NCCSc1ccc(B(O)O)cn1 2209388534 WXFZVVCDWHJMCW-UHFFFAOYSA-N 198.056 -1.188 50 10 AAGE O=C(C#CB(O)O)Nc1ncncn1 2241469008 YOEIBQOBEGMKNQ-UHFFFAOYSA-N 191.943 -2.175 50 10 AAGE C#C[C@H](C)NC(=O)C#CB(O)O 2241469040 ZBZKZVNQECCYJW-LURJTMIESA-N 164.957 -1.860 50 10 AAGE CNC(=O)c1sccc1B(O)O 2241480162 FBTMDLNNJJXVPJ-UHFFFAOYSA-N 185.013 -1.213 50 10 AAGE NNC(=O)CNC(N)=S 33844289 DOASTZHFUWYSRH-UHFFFAOYSA-N 148.191 -2.191 50 10 AAGE NNC(=O)CCN1CC[C@H](N)C1 114149949 FEYBCXSILQGJBT-LURJTMIESA-N 172.232 -1.601 50 10 AAGE NNC(=O)OCCOC(=O)NN 141349440 FBJJKVRIWIPHHR-UHFFFAOYSA-N 178.148 -1.814 50 10 AAGE NC(=O)Cc1ccccc1B(O)O 204236808 ZZBJQOULHDBJJH-UHFFFAOYSA-N 178.984 -1.606 50 10 AAGE N#Cc1cc(B(O)O)cnc1C#N 238631740 WMXFNFJLKLOUMI-UHFFFAOYSA-N 172.940 -1.495 50 10 AAGE NNc1cccc([N+](=O)[O-])c1B(O)O 306910925 JTCCDGAUQFSJPP-UHFFFAOYSA-N 196.959 -1.440 50 10 AAGE NNC(=O)N1CC[C@H](O)[C@@H](CO)C1 306910980 QGBTXNPVUZXOPE-RITPCOANSA-N 189.215 -1.755 50 10 AAGE CC(=O)NN=C[C@@H](O)CO 307839235 UHCNQERPHHUVDK-RXMQYKEDSA-N 146.146 -1.539 50 10 AAGE NC(=O)NN=C[C@@H](O)CO 307846346 RMMPYGPFOXKUJK-GSVOUGTGSA-N 147.134 -2.006 50 10 AAGE CSCC(=O)NNC(=O)C(=O)O 307930205 FQXKTTNBRMLEHA-UHFFFAOYSA-N 192.196 -1.419 50 10 AAGE COC(=O)NNC(=O)C(=O)OC 388383210 VECVLLGIGNURSY-UHFFFAOYSA-N 176.128 -1.453 50 10 AAGE CN(C)NC(=O)[C@H]1OCC[C@H]1CN 715313684 CIDFXKDXCDOLIH-BQBZGAKWSA-N 187.243 -1.057 50 10 AAGE CC(=O)NNC(=O)c1cc(CO)on1 1440721576 JOPYFQAATSDLRX-UHFFFAOYSA-N 199.166 -1.052 50 10 AAGE O=C(CO)N1CC[C@H](B(O)O)C1 1891517231 MGHWAIXCJPRZJK-YFKPBYRVSA-N 172.977 -1.946 50 10 AAGE C=C[C@]1(O)CCCN(CC(=O)NN)C1 1891926277 CEADLSJXGCZIDD-VIFPVBQESA-N 199.254 -1.011 50 10 AAGE CON1CCN(C(=O)NN)CC1 1915695300 SDRXTWBGLHSZMG-UHFFFAOYSA-N 174.204 -1.251 50 10 AAGE NNC(=O)N1CC[C@@H]2C(=O)NC[C@H]2C1 1935276947 UGWOBWBQRMFDII-WDSKDSINSA-N 198.226 -1.362 50 10 AAGE C[C@]12CN(CC(=O)NN)C[C@]1(CO)C2 1956312271 NYLKZOXHQUEFAL-IUCAKERBSA-N 199.254 -1.319 50 10 AAGE OB(O)c1cccnc1NC1CNC1 2210061880 ZWVVACQHUOGQCR-UHFFFAOYSA-N 193.015 -1.855 50 10 AAGE OCCCNc1ncccc1B(O)O 2210068787 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174.160 -1.844 50 10 AAGE N#Cc1cncc(B(O)O)c1C=O 238636056 FVJNQZJEOOHAAH-UHFFFAOYSA-N 175.940 -1.554 50 10 AAGE COC(=O)[C@]1(C#N)C[C@H]1B(O)O 238799928 ZBGONEPCFQUWFG-XINAWCOVSA-N 168.945 -1.084 50 10 AAGE CC(=O)N1CCO[C@@H](C(=O)NN)C1 306478515 CIHKHTXTANRFEF-ZCFIWIBFSA-N 187.199 -1.776 50 10 AAGE COC(=O)C(=O)NNC(=O)[C@@H](C)O 308303286 MCYIDXYCOVPEGO-GSVOUGTGSA-N 190.155 -2.312 50 10 AAGE NNC(=O)C[S@@](=O)CC(=O)O 526845205 CNIQQNATGDMSRG-LLVKDONJSA-N 180.185 -2.190 50 10 AAGE Cn1cncc1C(=O)NCB(O)O 702008844 WKZSFSYMQPSPFW-UHFFFAOYSA-N 182.976 -1.838 50 10 AAGE C[C@H]1CC[C@H](C(=O)NCB(O)O)O1 702017085 HDWVVKUUZMYERK-NTSWFWBYSA-N 187.004 -1.318 50 10 AAGE NC[C-]1N=C=C(C(=O)NN)S1 885334014 FCOSHTLOGFUOIC-UHFFFAOYSA-N 171.205 -1.275 50 10 AAGE C[C@]1(F)C[C@H](NC(=O)C(=O)NN)C1 1883759547 NGSLBCXAHSNFJM-VOVMAIODSA-N 189.190 -1.017 50 10 AAGE NNC(=O)C(=O)N1CCC=C[C@@H]1CO 1885808388 RXQOBWADRXYZMZ-ZCFIWIBFSA-N 199.210 -1.874 50 10 AAGE NNC(=O)N1[C@H]2CC[C@H]1CC(=O)NC2 1956773149 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575470289 WZDGTAFBPVZKNL-UHFFFAOYSA-N 168.949 -2.512 50 10 AAGE NC(=O)NNC(=O)CCn1ccnc1 706013608 SRGORZQFELDUPZ-UHFFFAOYSA-N 197.198 -1.027 50 10 AAGE CCN1NN=C=C1/C=C/B(O)O 885288186 PNIAMADOEPYNLE-ONEGZZNKSA-N 166.977 -1.137 50 10 AAGE N=C=c1[n+]#cn(CCCCl)c1=C=N 885740471 JKSBNJADANDVEI-UHFFFAOYSA-N 195.633 -1.643 50 10 AAGE C[C@H](C(=O)NN)N(C)C1(CO)CC1 1882618041 MGKOEDBJNMHNAX-ZCFIWIBFSA-N 187.243 -1.179 50 10 AAGE NCC12CC(C1)[C@H](C(=O)NN)CO2 1891753820 YNFPSCMQNVREMB-NAJVVJGSSA-N 185.227 -1.270 50 10 AAGE NNC(=O)NC[C@H]1CCS1(=O)=O 1930858663 HKMYIXHLNXOEMU-SCSAIBSYSA-N 193.228 -1.654 50 10 AAGE C[C@]1(CO)COCCN1C(=O)NN 1953960025 SKPWYWRWPLDLKC-ZETCQYMHSA-N 189.215 -1.347 50 10 AAGE CCC[C@H](CN)NC(=O)C#CB(O)O 2241468638 RMQBEMHXRKBYDM-SSDOTTSWSA-N 198.031 -1.755 50 10 AAGE O=CNCc1ccc(B(O)O)s1 2241555305 LDIMFVXRIBYXLT-UHFFFAOYSA-N 185.013 -1.326 50 10 AAGE N#CCCS(=O)(=O)CC(=O)NN 82692520 VCBKVHOQDIEXAA-UHFFFAOYSA-N 191.212 -1.695 50 10 AAGE OC[C@@H](O)COC[C@@H](O)CCl 147199240 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10 AAGE COC(=O)N[C@H](CB(O)O)C(=O)O 1954524334 HWTGQJSAOMGYRS-GSVOUGTGSA-N 190.948 -1.732 50 10 AAGE NNC(=O)N1CC(C(=O)NC2CC2)C1 1956555824 OSUJIVJOMGNMGS-UHFFFAOYSA-N 198.226 -1.220 50 10 AAGE O=C(C#CB(O)O)N1CCC[C@@H]1CF 2241468455 ORVHWPKOSFHUGG-SSDOTTSWSA-N 198.990 -1.038 50 10 AAGE NC1(CNC(=O)C#CB(O)O)CCC1 2241478295 BRFNELNGNYKFGD-UHFFFAOYSA-N 196.015 -2.001 50 10 AAGE C[C@@]1(O)CON(C(=O)C#CB(O)O)C1 2241478725 KUYRTUSCRPUCTD-ZETCQYMHSA-N 198.971 -2.473 50 10 AAGE C[C@H](CF)N(C)C(=O)C(=O)NN 2241729110 HOIMQGOVHVDVFI-SCSAIBSYSA-N 177.179 -1.207 50 10 AAGE C[C@@H](O)C(=O)OC(=O)CO 60003618 PQJHWXXLQJFYEA-GSVOUGTGSA-N 148.114 -1.571 50 10 AAGE Nc1c(O)cccc1B(O)O 204754332 MMRSVHYWFBBQOE-UHFFFAOYSA-N 152.946 -1.346 50 10 AAGE OCCCc1ccc(B(O)O)cn1 209843370 SIAGSMVSPSWDEP-UHFFFAOYSA-N 181.000 -1.314 50 10 AAGE OB(O)c1ccc(O)c(F)n1 306763978 GUXRJPNYQBWMNU-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE N#CC1=C[C@H]2O[C@@H]2[C@H](O)[C@H]1O 306840073 AASWHARLAPKYTB-UCROKIRRSA-N 153.137 -1.061 50 10 AAGE NNC(=O)[C@@H]1CN2CC[C@H]1C2 306866528 ODSJBQOEMCPLBO-NTSWFWBYSA-N 155.201 -1.072 50 10 AAGE NC(=S)NNC(=O)c1ccncn1 307624666 OCILAPXMHYZNQL-UHFFFAOYSA-N 197.223 -1.045 50 10 AAGE CN(N)C(=O)CCO 1879943176 DIARLNGINSRPNV-UHFFFAOYSA-N 118.136 -1.299 50 10 AAGE CO[C@@H]1COC[C@@H]1N(C)C(=O)NN 1881953577 ATWRGGOSDYTUIM-NTSWFWBYSA-N 189.215 -1.085 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2C[C@]2(CO)C1 1899605579 KXBANBPEDVATIR-ACLDMZEESA-N 199.254 -1.321 50 10 AAGE O=C(NNCCO)C12CCN(CC1)C2 1929833082 CSMJUVXYKMJFAD-UHFFFAOYSA-N 199.254 -1.305 50 10 AAGE CC1(CNC(=O)C#CB(O)O)CNC1 2241468787 UZHZLDDRWJUBRS-UHFFFAOYSA-N 196.015 -2.273 50 10 AAGE O=C(C#CB(O)O)N1CC[C@H]2C[C@H]21 2241478794 LLXBOZUNOYMBAH-NKWVEPMBSA-N 178.984 -1.377 50 10 AAGE O=C(NO)C1CC(B(O)O)C1 2241584089 JFVRLXRYIQWSRU-UHFFFAOYSA-N 158.950 -1.255 50 10 AAGE OC[C@H](O)COOC[C@H](O)CO 112972781 CGORWLLFUJDORA-OLQVQODUSA-N 182.172 -2.359 50 10 AAGE NNc1cc(B(O)O)ccc1F 307167431 RPCZHJOEPLTJQG-UHFFFAOYSA-N 169.952 -1.209 50 10 AAGE 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AAGE NCCCN=c1ccc(B(O)O)c[nH]1 2210060138 GTGPLEKBJYEXJH-UHFFFAOYSA-N 195.031 -2.056 50 10 AAGE C[C@@H](CNC(=O)C#CB(O)O)N(C)C 2241471699 LCACDHHAYOKAQY-ZETCQYMHSA-N 198.031 -1.932 50 10 AAGE NNC(=O)c1ncc(B(O)O)cc1F 2241474148 XMNWTBONNUBTRZ-UHFFFAOYSA-N 198.950 -2.496 50 10 AAGE CCc1nn(C)c(C(N)=O)c1B(O)O 2241475091 QHNPDSAKUDKWNP-UHFFFAOYSA-N 197.003 -2.239 50 10 AAGE COC(=O)CSCC(=O)NN 82472441 ZPRARAICGOKLCB-UHFFFAOYSA-N 178.213 -1.118 50 10 AAGE NNC(=O)CF 138269244 HYXCKBUBQWDMFP-UHFFFAOYSA-N 92.073 -1.054 50 10 AAGE NNC(=O)CN1C[C@H](O)C[C@H]1CO 699289742 UFPCIJNNSUXGHD-NTSWFWBYSA-N 189.215 -2.596 50 10 AAGE CNNC(=O)CCS(C)(=O)=O 704665824 QWDNKSXPUUUDKV-UHFFFAOYSA-N 180.229 -1.328 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2COC[C@H]2C1 718159079 GUOSWFMNLOPDIY-PRJMDXOYSA-N 199.254 -1.057 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2COCC[C@@H]21 1877200007 JNQHQPJAOYTXPF-RITPCOANSA-N 199.210 -1.776 50 10 AAGE CC[C@@H](COC)C(=O)NCB(O)O 1883256222 RLNZVAISZMUCSF-LURJTMIESA-N 189.020 -1.213 50 10 AAGE Cn1ncnc1[C@H](N)[C@H](O)C#N 1953003692 GCRINHQGCZYXAV-RFZPGFLSSA-N 167.172 -1.301 50 10 AAGE OB(O)c1cnc(=NCCF)[nH]c1 2209387601 KGPOEUQCZVLTBF-UHFFFAOYSA-N 184.967 -2.040 50 10 AAGE O=C(C#CB(O)O)NCc1cnoc1 2241479140 RZVCNLFUDZCYCR-UHFFFAOYSA-N 193.955 -1.694 50 10 AAGE O=C(Nc1nn[nH]n1)[C@H]1C[C@@H]1B(O)O 2241495825 MZERGKLNGMJIDX-HRFVKAFMSA-N 196.963 -1.999 50 10 AAGE OB(O)c1ncnc2c1ncn2CF 2242483078 IUAKVMPIELEYLF-UHFFFAOYSA-N 195.950 -1.567 50 10 AAGE CNC(=O)c1ccn(CC(=O)NN)n1 84844188 LJQFXIZNOLQHGW-UHFFFAOYSA-N 197.198 -1.767 50 10 AAGE COc1nc(N(C)C)ncc1B(O)O 200997754 UQMSFPFAWSAPCU-UHFFFAOYSA-N 197.003 -1.769 50 10 AAGE CCC[C@H](N)C(=O)N(C)CB(O)O 207114624 MWBZIWKSTDLLQQ-LURJTMIESA-N 188.036 -1.416 50 10 AAGE CONC(=O)c1ccccc1B(O)O 217586485 TUWWXEUAXJGDKR-UHFFFAOYSA-N 194.983 -1.342 50 10 AAGE NCCCO[Si](O)(O)O 220147849 IXFMSJNYSYYNTP-UHFFFAOYSA-N 153.210 -2.236 50 10 AAGE CC(C)(O)c1cc(B(O)O)ccn1 238193180 KNTNQMJSIOKMSF-UHFFFAOYSA-N 181.000 -1.011 50 10 AAGE NNC(=O)[C@H]1CC12CNC2 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199.015 -1.150 50 10 AAGE CCOC[C@@H](N)C(=O)NN 1953153302 OPCOUAICMSWALN-SCSAIBSYSA-N 147.178 -1.660 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@]2(O)C[C@@H]2C1 2241326759 MNXJGXICYCBLKL-BHNWBGBOSA-N 199.254 -1.179 50 10 AAGE CCC[C@@H](CN)NC(=O)C#CB(O)O 2241468639 RMQBEMHXRKBYDM-ZETCQYMHSA-N 198.031 -1.755 50 10 AAGE C[C@H](CC(N)=O)NC(=O)C#CB(O)O 2241478883 MUPNSCWZLQJAOF-RXMQYKEDSA-N 197.987 -2.618 50 10 AAGE N#CC1=C(NN)C(=O)NC1=O 104538344 CGHQETQAKQCQFB-UHFFFAOYSA-N 152.113 -2.116 50 10 AAGE NNC(=O)[C@H](O)[C@@H](O)[C@H](O)CO 105061936 GQRGREOAXWDDQQ-FLRLBIABSA-N 180.160 -3.949 50 10 AAGE CCOC(=O)/C=C(\N)NNC(C)=O 140215686 GTAQDYWFAHWEJB-GQCTYLIASA-N 187.199 -1.010 50 10 AAGE NC(=O)Cn1cc(B(O)O)cn1 204242015 SQXHCAGQPLMTSM-UHFFFAOYSA-N 168.949 -2.952 50 10 AAGE Cl[C@@H]1NCN[C@H]2NNC[C@@H]12 585664605 RFVDHCFQEFZCRL-LMVFSUKVSA-N 162.624 -1.248 50 10 AAGE OB(O)c1cnn([C@H]2CCCO2)c1 606256341 AWOQJJIAXDXXID-SSDOTTSWSA-N 181.988 -1.128 50 10 AAGE NNC(=O)CN1C[C@H](F)[C@H](F)C1 714557921 JJPGVSCBEFYDEH-SYDPRGILSA-N 179.170 -1.032 50 10 AAGE CC[C@@H](F)C(=O)NNC(=O)CO 1472538186 SMFOJKUACWASPV-SCSAIBSYSA-N 178.163 -1.126 50 10 AAGE CN(C)NC(=O)[C@H](O)CN 1880009708 VPOUPMORTWDKDF-SCSAIBSYSA-N 147.178 -2.101 50 10 AAGE OB(O)c1ccn(C[C@@H]2C[C@H]2F)n1 1882859988 DDYBXCVVSYYRKE-NTSWFWBYSA-N 183.979 -1.079 50 10 AAGE CCc1cnn(CC(=O)NN)c(=O)c1 2242142509 UKLRFMVUSCDUSJ-UHFFFAOYSA-N 196.210 -1.204 50 10 AAGE Cc1n[nH]c(=O)c(C(=O)NN)c1C 37393915 OGHVQAPNOWKUDU-UHFFFAOYSA-N 182.183 -1.010 50 10 AAGE C#CCNCC(=O)NN 86157398 ABUCEAUFCAMPDR-UHFFFAOYSA-N 127.147 -1.801 50 10 AAGE [C-]#[N+]CC(=O)N(CCO)CCO 200896366 NJKLSWCUXWWLFL-UHFFFAOYSA-N 172.184 -1.281 50 10 AAGE Nc1cc(B(O)O)c[nH]c1=O 231391905 MRNMKFHMRPCOLH-UHFFFAOYSA-N 153.934 -2.363 50 10 AAGE N#Cc1c(F)cncc1B(O)O 238636669 PEYPGOHLMKMANX-UHFFFAOYSA-N 165.920 -1.228 50 10 AAGE CNNC(=O)C[C@H](C)N 259205432 ZEXYAYLJSSKBHE-BYPYZUCNSA-N 131.179 -1.026 50 10 AAGE C[C@H]1OCCN[C@@H]1C(=O)NN(C)C 306277808 OLAYIDQOUHRIRW-RQJHMYQMSA-N 187.243 -1.044 50 10 AAGE CN(C)C1CN(CC(=O)NN)C1 307412047 HVWGKXQMPJEDMJ-UHFFFAOYSA-N 172.232 -1.778 50 10 AAGE CCN(C)S(=O)(=O)NNC(C)=O 379330682 YCGISFRQBAFXFN-UHFFFAOYSA-N 195.244 -1.176 50 10 AAGE CN(CC(=O)NN)C[C@@H](O)C1CC1 690156041 QAJUQGIAMMFMHD-SSDOTTSWSA-N 187.243 -1.321 50 10 AAGE O=S(=O)(CCF)NCB(O)O 1880193302 RAXLBRGOSPZUOX-UHFFFAOYSA-N 184.985 -2.113 50 10 AAGE CN(C)NC(=O)[C@@H](O)C(C)(C)N 1880598788 ZOFLXUYMDVVQNZ-RXMQYKEDSA-N 175.232 -1.323 50 10 AAGE CCn1nnnc1C=NNC(N)=O 1883448631 YDZOFEZXSJZCGE-UHFFFAOYSA-N 183.175 -1.305 50 10 AAGE CC1(NC(=O)NN)CS(=O)(=O)C1 1918408383 OMLYRQRAGHXMSF-UHFFFAOYSA-N 193.228 -1.654 50 10 AAGE NNC(=O)[C@@H]1CNCc2nccn2C1 1955999971 MVPCYOIQIQENIN-ZCFIWIBFSA-N 195.226 -1.408 50 10 AAGE CC#CCN=c1cc(B(O)O)cc[nH]1 2210061582 WBPHTBOQRQVQPK-UHFFFAOYSA-N 190.011 -1.382 50 10 AAGE COCCCCNC(=O)C#CB(O)O 2241471947 NTBZOQIPWAADFS-UHFFFAOYSA-N 199.015 -1.455 50 10 AAGE O=C([C@H]1C[C@@H]1B(O)O)N1CCCCN1 2241478367 CXZLMXVXMQYGFZ-BQBZGAKWSA-N 198.031 -1.024 50 10 AAGE NCc1cc(B(O)O)cnc1F 238627530 HIPZSXNIPZJDET-UHFFFAOYSA-N 169.952 -1.641 50 10 AAGE C[C@@H]1CN(CC(=O)NN)CC[C@H]1O 253171497 ALXXMWQCIOXTEF-RNFRBKRXSA-N 187.243 -1.321 50 10 AAGE NNC(=O)[C@H]1Cn2cnnc2CN1 575533101 DGDQQVGPXGRABE-SCSAIBSYSA-N 182.187 -2.260 50 10 AAGE CNNC(=O)c1cn(C)c(=O)n1C 606259206 PKPVHIGDVZXGAV-UHFFFAOYSA-N 184.199 -1.412 50 10 AAGE CN(C)NC(=O)[C@@H]1NC[C@@H](O)[C@H]1O 1877833782 VNDUIUNWIJFVAW-HSUXUTPPSA-N 189.215 -2.727 50 10 AAGE CO[C@H]1CC[C@@](N)(B(O)O)C1 1880313696 ASLDYZCDDFORKY-WDSKDSINSA-N 158.994 -1.105 50 10 AAGE NNC(=O)CN1[C@@H]2COC[C@H]1C2 1881445838 NVCVWRDNYZUJFM-OLQVQODUSA-N 171.200 -1.551 50 10 AAGE C[C@H]1CC(=O)N[C@@H]1C(=O)NN 1923735771 LJVVWTFUSWSNRH-UCORVYFPSA-N 157.173 -1.499 50 10 AAGE Cn1ccc([C@](C)(N)B(O)O)n1 1929157634 ZSKBQLUQFWOUFN-LURJTMIESA-N 168.993 -1.394 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]2C[C@@]2(O)C1 1956822727 YKBDVSJOXSAPSD-YLWLKBPMSA-N 199.210 -2.040 50 10 AAGE C=CC(=O)Nc1ncc(B(O)O)cn1 2209711036 RUSUTVFDFRLFGE-UHFFFAOYSA-N 192.971 -1.719 50 10 AAGE O=C(C#CB(O)O)N1CC[C@@H]1CO 2241475928 IFHFGYMAAKWHON-ZCFIWIBFSA-N 182.972 -2.405 50 10 AAGE NC(=O)c1ncc(B(O)O)cc1F 2241482058 ZYQZANNGMZIASR-UHFFFAOYSA-N 183.935 -2.001 50 10 AAGE COC(=O)[C@@H](CO)NC(=O)CCl 37226254 SDIQFJSMWGNNKI-SCSAIBSYSA-N 195.602 -1.125 50 10 AAGE NNC(=O)[C@H]1CCCN(C(N)=O)C1 37388483 QJAKCGNDNAULPJ-YFKPBYRVSA-N 186.215 -1.233 50 10 AAGE COC(=O)NNCC(=O)O 104721497 OUTFMHBGSQQUTD-UHFFFAOYSA-N 148.118 -1.068 50 10 AAGE C[C@H](CN)B(O)O 200987091 JHUBKNGVRWCIIG-GSVOUGTGSA-N 102.930 -1.192 50 10 AAGE COC(=O)[C@@H]1CCN[C@@H]1B(O)O 238335803 CYEIEMSURJTRRY-UHNVWZDZSA-N 172.977 -1.851 50 10 AAGE NNC(=O)Cn1ccncc1=O 306285353 KDEICDMAOKCVDE-UHFFFAOYSA-N 168.156 -1.767 50 10 AAGE N[C@@H]1NC[C@H](Br)NC1=O 306328865 NXESRPNCRGFHCV-PWNYCUMCSA-N 194.032 -1.288 50 10 AAGE NC(=O)NNC(=O)C1[C@@H]2COC[C@@H]12 306800546 OTRDWPGFQHVPOW-QWWZWVQMSA-N 185.183 -1.422 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@H]1CO2 306848450 MPASBDODXSZKGZ-NTSWFWBYSA-N 171.200 -1.551 50 10 AAGE C[C@@H]1C[C@@H](O)CN(CC(=O)NN)C1 307000811 ASTQBVFQWNTGHW-RNFRBKRXSA-N 187.243 -1.321 50 10 AAGE CNC(=O)C(C)(C)NC(=O)NN 307393184 BCIOOVHEDJILAN-UHFFFAOYSA-N 174.204 -1.316 50 10 AAGE CC(=O)NNC(=O)NCCC(N)=O 388804100 PNRRVWRYMXHTJM-UHFFFAOYSA-N 188.187 -1.788 50 10 AAGE CN(N)C(=O)[C@H]1CCCC(=O)N1 575558186 MUNXEIHNLJWYQW-RXMQYKEDSA-N 171.200 -1.013 50 10 AAGE C[C@@H](NC(N)=O)C(=O)NNC(N)=O 700880612 XJNFDJDLKOGDSX-UWTATZPHSA-N 189.175 -2.257 50 10 AAGE CC(C)[C@@H](C(=O)NN)N1C#CNN1 885429529 CAPSEKJYNJHBPP-LURJTMIESA-N 183.215 -1.756 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1CN1CCNC1=O 885894784 QSCNOBONHFTQPE-PHDIDXHHSA-N 198.226 -1.362 50 10 AAGE N[C@]1(B(O)O)CO[C@@]2(CCOC2)C1 1882151831 JOZBGAKLSCAVCD-BQBZGAKWSA-N 187.004 -1.725 50 10 AAGE C#CCCOC(=O)NCC#CB(O)O 1887821532 NSKKERVZFRJIBN-UHFFFAOYSA-N 194.983 -1.249 50 10 AAGE CCN(C)NC(=O)[C@H]1CN=CN1 1923512393 SPEZQQXIBAWTHV-ZCFIWIBFSA-N 170.216 -1.031 50 10 AAGE C[C@@H](C(=O)NN)N1CC2(CC(O)C2)C1 1928569831 MWFJAJIAMBEPDX-LURJTMIESA-N 199.254 -1.179 50 10 AAGE CO[C@@H]1C[C@H]1C(=O)NNCCO 1929835681 WNEMRQRXKMMUEX-PHDIDXHHSA-N 174.200 -1.366 50 10 AAGE N#C[C@H](O)Cc1nc(O)nc(O)n1 1952939900 YLHNDMIRDPQYFR-GSVOUGTGSA-N 182.139 -1.290 50 10 AAGE NNC(=O)C(=O)N[C@@H]1[C@H]2C[C@H]2[C@H]2C[C@H]21 1954995163 MQLPPWDJSSFDMB-GGTDAZAQSA-N 195.222 -1.253 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@@H]2C[C@]2(O)C1 1956821551 JVUJPHGKUSHZNF-BHNWBGBOSA-N 199.254 -1.179 50 10 AAGE N[C@H]1C[C@H]1Nc1ncc(B(O)O)cn1 2210068026 KIVPPRXNFYQTMW-NTSWFWBYSA-N 194.003 -2.332 50 10 AAGE C[C@@H](N)CNC(=O)C#CB(O)O 2241468421 NWYBXNRCBAZTSO-RXMQYKEDSA-N 169.977 -2.535 50 10 AAGE NCCN(CCN)C(=O)C#CB(O)O 2241468811 VICRAWWFYCRTPF-UHFFFAOYSA-N 199.019 -3.252 50 10 AAGE CCONC(=O)c1coc(B(O)O)c1 2241481748 VELZNCWGJGFQIS-UHFFFAOYSA-N 198.971 -1.359 50 10 AAGE O=C(OC(=O)[C@H](O)CO)[C@H](O)CO 59696606 CJCXKMLGWBVDGS-QWWZWVQMSA-N 194.139 -3.237 50 10 AAGE N#CC1=C(N)CC(=N)N=C1NN 104564607 YZFGUMJJTRJNCA-UHFFFAOYSA-N 164.172 -1.034 50 10 AAGE CN(C)NC(=O)c1nonc1N 147294223 ZSAQBVLVWJLZSA-UHFFFAOYSA-N 171.160 -1.142 50 10 AAGE CC(C)[C@@H](NC(=O)[C@@H](C)N)B(O)O 210167083 CYSODVAPDPNLDY-PHDIDXHHSA-N 188.036 -1.514 50 10 AAGE C=CC1=C(B(O)O)CCC(=O)C1(O)O 212161338 NCKYAQCCHKTVTQ-UHFFFAOYSA-N 197.983 -1.475 50 10 AAGE O=Cc1ccc(C=O)c(B(O)O)c1 220123413 DHBQFDKQMYPULU-UHFFFAOYSA-N 177.952 -1.009 50 10 AAGE N[C@H]1CC(=O)N[C@H](Cl)N1 225354205 GJBRQZGSKYESRB-VVJJHMBFSA-N 149.581 -1.097 50 10 AAGE CCOC(=O)c1cnccc1B(O)O 238275732 ZILWGSLLJXCIDO-UHFFFAOYSA-N 194.983 -1.062 50 10 AAGE COc1cc(F)ncc1B(O)O 238360341 KRUMBTOHQRPJOA-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE Cn1c(=O)cc(NNC=O)[nH]c1=O 238524389 JEHIARPQXGKETQ-UHFFFAOYSA-N 184.155 -1.854 50 10 AAGE O=C(O)[C@H](Cl)C[C@@H](O)[C@@H](O)CO 238712489 VKFUMESKFQTBCR-WDCZJNDASA-N 198.602 -1.217 50 10 AAGE NNC(=O)CCc1cc(=O)[nH][nH]1 306285709 FFFITJCVEBADSK-UHFFFAOYSA-N 170.172 -1.375 50 10 AAGE N#C[C@]1(O)C[C@H](O)[C@H]2O[C@H]21 307131361 ZZFYRSMSXDWPRD-SLPGGIOYSA-N 141.126 -1.227 50 10 AAGE COCC(=O)NNC(=O)CCCO 308436345 WRUMMFUONHABOQ-UHFFFAOYSA-N 190.199 -1.447 50 10 AAGE CCSCCNC(=O)C(=O)NN 388404999 RPFQVBVLTWKWGT-UHFFFAOYSA-N 191.256 -1.154 50 10 AAGE NC(=O)NNC(=O)[C@]12COC[C@@H]1C2 575519972 AZAPTUYMABEFHZ-MHTLYPKNSA-N 185.183 -1.278 50 10 AAGE O=C(NCB(O)O)c1nc[nH]n1 706530543 PWPYDDBBIKSSSN-UHFFFAOYSA-N 169.937 -2.454 50 10 AAGE N#CC1=C(N2CCNCC2)NNC#C1 885541426 AHGJYQUPKXHRIM-UHFFFAOYSA-N 189.222 -1.305 50 10 AAGE NNC(=O)[C@]12C[C@H](N)[C@@H]1C2 1953189873 UFECFSPTYHDILU-RVJQKOHUSA-N 141.174 -1.286 50 10 AAGE OCCSc1cc(B(O)O)ccn1 2209388308 TZRODLVGKBDTQX-UHFFFAOYSA-N 199.040 -1.154 50 10 AAGE CCC1(O)CN(C(=O)C#CB(O)O)C1 2241468253 KFNMXBQADCRYCD-UHFFFAOYSA-N 196.999 -2.015 50 10 AAGE NNC(=O)N1CCCC[C@H]1C(N)=O 42407427 VUEXUEQWYVSHTJ-YFKPBYRVSA-N 186.215 -1.091 50 10 AAGE OB(O)c1cnc2nccnc2c1 198805189 ALHRJBIHMIAJAA-UHFFFAOYSA-N 174.956 -1.295 50 10 AAGE NNC(=O)[C@](O)(CO)C[C@@H](O)CO 238557405 MIRMJUUYKXXXNV-INEUFUBQSA-N 194.187 -3.557 50 10 AAGE N#CSC1C(=O)NC(=O)NC1=O 238635386 LBKNANFFMAQWGJ-UHFFFAOYSA-N 185.164 -1.065 50 10 AAGE C[C@@H]1OCCN[C@H]1C(=O)NN(C)C 306277806 OLAYIDQOUHRIRW-NKWVEPMBSA-N 187.243 -1.044 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-] 306436803 GUEPGURDXRZUGQ-GBXIJSLDSA-N 145.118 -1.359 50 10 AAGE O=[N+]([O-])c1ccc(O)cc1B(O)O 307010288 NSLBNCKOZBHJFD-UHFFFAOYSA-N 182.928 -1.020 50 10 AAGE O=[N+]([O-])c1cnc(B(O)O)cn1 307117684 UVVHCWBEUYRKEK-UHFFFAOYSA-N 168.905 -1.935 50 10 AAGE CN1CCN(C(=O)NN)[C@@H](CO)C1 606260831 XZMATPPAEIVGMX-ZCFIWIBFSA-N 188.231 -1.822 50 10 AAGE CO[C@H](C)CCC(=O)NCB(O)O 702022238 SIPXIMAHYWPOEH-ZCFIWIBFSA-N 189.020 -1.070 50 10 AAGE CNNC(=O)Cn1nc(O)ccc1=O 704665099 JGXWLRLFQMSEPD-UHFFFAOYSA-N 198.182 -1.801 50 10 AAGE C[C@H](C(=O)NN)N1CC([N+](=O)[O-])C1 1883146975 QHRALOYJYILZFE-SCSAIBSYSA-N 188.187 -1.674 50 10 AAGE CN(N)C(=O)[C@@H]1Cc2nncn2C1 1953875797 YNZHZBROTZOZLQ-RXMQYKEDSA-N 181.199 -1.218 50 10 AAGE O=C(F)N1CC[C@@](O)(CO)[C@@H](O)C1 2209148141 YFILRXCQICIRKP-CAHLUQPWSA-N 193.174 -1.134 50 10 AAGE C[C@H](N)COc1cc(B(O)O)ccn1 2210061692 XUEFZPBCBHBDNR-LURJTMIESA-N 196.015 -1.513 50 10 AAGE O=C(C#CB(O)O)N1CCC[C@@H]1CO 2241479096 RFEJQASJIKUEIH-SSDOTTSWSA-N 196.999 -2.015 50 10 AAGE N[C@H]1C[C@H](NC(=O)C2(B(O)O)CC2)C1 2241480208 GCPFYIGUVQOMIO-IZLXSQMJSA-N 198.031 -1.401 50 10 AAGE NNC(=O)[C@@H]1CNC=N1 104690506 PGNCVGUCPLSEDQ-VKHMYHEASA-N 128.135 -2.024 50 10 AAGE NNC(=O)CN1C[C@@H](O)[C@H](O)C1 236238592 YZDYVEPNOIZKJX-RFZPGFLSSA-N 175.188 -2.986 50 10 AAGE NNC(=O)C[S@](=O)CCC(=O)O 526874533 RNUQRFSOWVPHAL-GFCCVEGCSA-N 194.212 -1.800 50 10 AAGE CCO[C@@H]1CNC[C@H]1C(=O)NN 690069198 VXCXKBBHZIUKFL-PHDIDXHHSA-N 173.216 -1.399 50 10 AAGE OB(O)c1ccn(C[C@@H]2CCCO2)n1 694277915 VSECCQAHXVGZLM-ZETCQYMHSA-N 196.015 -1.258 50 10 AAGE NNC(=O)N1C[C@@H]2NC(=O)O[C@@H]2C1 1881801857 UKPGYSHHCHNXIU-IUYQGCFVSA-N 186.171 -1.638 50 10 AAGE COCC(=O)N[C@H]1CCC=C1B(O)O 1892920290 QBVKROLVLJMFFS-ZETCQYMHSA-N 199.015 -1.150 50 10 AAGE O=CNCCc1cccc(B(O)O)c1 1904783977 XDZWRAOWHDVDIV-UHFFFAOYSA-N 193.011 -1.345 50 10 AAGE NNC(=O)N1C[C@@H]2C(CO)[C@H]2C1 1929053792 CQVLJLXWAAMWTM-WHFBIAKZSA-N 171.200 -1.260 50 10 AAGE CN1CCC[C@@H]1C(=O)NNC(N)=O 1931433219 PRZCKAUKAZUEIT-RXMQYKEDSA-N 186.215 -1.220 50 10 AAGE NC(=O)NNC(=O)c1ccnnc1O 2209984228 VITITWGCPHSLKW-UHFFFAOYSA-N 197.154 -1.505 50 10 AAGE CNC(=O)c1ccc(B(O)O)o1 2241480193 FWDZBXVWCUPXHQ-UHFFFAOYSA-N 168.945 -1.681 50 10 AAGE CCOC(=O)c1ncc(B(O)O)[nH]1 199021493 BCLLRVGBGDSIPR-UHFFFAOYSA-N 183.960 -1.734 50 10 AAGE CO[C@@H](C)C(=O)NNC(=O)CCO 308385581 WRBDFWAGLXTQAP-YFKPBYRVSA-N 190.199 -1.449 50 10 AAGE CN1N=C([C@H](O)C2=C=S=C=N2)NN1 642816065 AISNEMXXNYHAPV-RXMQYKEDSA-N 197.223 -1.448 50 10 AAGE NNC(=O)CN1C[C@H]2CC[C@H]1C[C@H]2O 1887414153 HIKYQWPZHCVVCE-GJMOJQLCSA-N 199.254 -1.179 50 10 AAGE NC(=O)NN=C1CCNC(=O)C1 1953492809 HPNINJUZTGYNEP-UHFFFAOYSA-N 170.172 -1.079 50 10 AAGE Cc1nc(NC=O)ncc1B(O)O 2241556436 XQBAFZPADCYUIK-UHFFFAOYSA-N 180.960 -1.967 50 10 AAGE Cc1nccc(CO)c1B(O)O 238489952 SKRGBNLZKBPSBS-UHFFFAOYSA-N 166.973 -1.438 50 10 AAGE NNC(=O)OC[C@H](N)C(=O)O 238662700 NWKNFSNTFZZTLY-REOHCLBHSA-N 163.133 -2.002 50 10 AAGE NC(=O)C(=O)NNC(=O)C1CCC1 306360201 LXWVDQFXXYOAKY-UHFFFAOYSA-N 185.183 -1.581 50 10 AAGE N#C[C@@H]1C(=O)N[C@@H](N)N[C@H]1Cl 306371134 IXYQRNOIJKOMGK-LWKDLAHASA-N 174.591 -1.347 50 10 AAGE C#CC(=O)NNC(=O)[C@H]1CCOC1 306449019 XTAQCONXNRVQPK-LURJTMIESA-N 182.179 -1.197 50 10 AAGE CCOCC(=O)NNC=O 306958333 VJUYSQBLZQRNOM-UHFFFAOYSA-N 146.146 -1.200 50 10 AAGE C/C(=N\N)[C@@H](C#N)C(=O)NN 307492220 GYVVTNCGABLFNY-UGTDVNPESA-N 155.161 -1.549 50 10 AAGE CCn1c(C)cc(B(O)O)cc1=O 307538857 KPLNDXNHBHNQEH-UHFFFAOYSA-N 181.000 -1.144 50 10 AAGE C[C@H](O)[C@H](O)[C@@H](O)[C@H](O)C(=O)NN 308176531 APMGLRZHDSCHJE-KLVWXMOXSA-N 194.187 -3.560 50 10 AAGE COCC(=O)NN[C@@H](C)C(=O)OC 379392243 RLGGXGPAUKAOSS-YFKPBYRVSA-N 190.199 -1.185 50 10 AAGE C[N+]1=C=C([C@@H](O)C#N)NN1 642815110 LXYUCXCEOZSDFA-YFKPBYRVSA-N 139.138 -1.910 50 10 AAGE NNC(=O)CN1CC[C@@H](N2CCC2)C1 702303409 XRQPNJVLTWHSBB-MRVPVSSYSA-N 198.270 -1.244 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2COCC[C@H]21 1890150825 JNQHQPJAOYTXPF-PHDIDXHHSA-N 199.210 -1.776 50 10 AAGE NNC(=O)[C@@H](N)C[C@H]1CCCO1 1926582513 IKWCQLMSAIAWHD-RITPCOANSA-N 173.216 -1.127 50 10 AAGE NNC(=O)[C@@]12CC[C@H]1CNC2 1931427834 OFPPCLYGIFUWML-CAHLUQPWSA-N 155.201 -1.024 50 10 AAGE CNNC(=O)C1(C)CS(=O)(=O)C1 1933080225 XBFYLQXIDMKOHL-UHFFFAOYSA-N 192.240 -1.328 50 10 AAGE NNC(=O)N1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 1954501746 CHQUSKOSLYVITN-DPYQTVNSSA-N 187.199 -2.004 50 10 AAGE C[C@H](C(=O)NN)N1CCN(C)[C@H]2C[C@H]21 1956635682 CSCVVKQZNSXIEO-GJMOJQLCSA-N 198.270 -1.247 50 10 AAGE CON(C)C(=O)c1cc(B(O)O)c[nH]1 2241479537 ZYXXAEVPJBHHHZ-UHFFFAOYSA-N 197.987 -1.672 50 10 AAGE O=C(NC[C@H]1CCO1)C1(B(O)O)CC1 2241481225 QLMGANFDVFLGJU-ZCFIWIBFSA-N 199.015 -1.102 50 10 AAGE OB(O)c1ncc(OC(F)F)cn1 2241989202 GTMCMXAVTPXJQA-UHFFFAOYSA-N 189.914 -1.242 50 10 AAGE NNC(=O)N1CCCC[C@@H]1C(N)=O 42407429 VUEXUEQWYVSHTJ-RXMQYKEDSA-N 186.215 -1.091 50 10 AAGE O=C1N[C@H]2C(=O)OC(=O)[C@@H]2N1 169187813 IWWJKYUSLCVQBT-JCYAYHJZSA-N 156.097 -1.880 50 10 AAGE OCc1cc(CO)cc(B(O)O)c1 204720954 KNFKZGFXTGFVNJ-UHFFFAOYSA-N 181.984 -1.649 50 10 AAGE CC[C@@H](N)B(O)O 220627577 JFEHBKFDKBNKAT-GSVOUGTGSA-N 102.930 -1.264 50 10 AAGE CNNC(=O)[C@@H](N)[C@@H]1CCN(C)C1 259017185 IHCWDTPQHRJYOS-RQJHMYQMSA-N 186.259 -1.484 50 10 AAGE O=C(F)N[C@@H]1C[C@H](O)[C@H](O)[C@@H]1O 1881051317 LJBUFLRSGWYIIJ-LECHCGJUSA-N 179.147 -1.480 50 10 AAGE NNC(=O)[C@@H](N)C[C@@H]1CCCO1 1926582514 IKWCQLMSAIAWHD-WDSKDSINSA-N 173.216 -1.127 50 10 AAGE O=C(NNCCO)C1[C@@H]2COC[C@@H]12 1929832542 UUGKGQQXMAGWHD-PHDIDXHHSA-N 186.211 -1.508 50 10 AAGE O=C(NNCCO)[C@H]1C[C@H]1C(=O)O 1929832775 YKZKYAWJRWDXLT-CRCLSJGQSA-N 188.183 -1.680 50 10 AAGE Cn1nncc1[C@@H](N)[C@H](O)C#N 1953065868 DDCZUPTWMOFZQT-PHDIDXHHSA-N 167.172 -1.301 50 10 AAGE C[C@H]1COCC(=O)N1CC(=O)NN 1954177957 NKLPJAKRABTNMR-YFKPBYRVSA-N 187.199 -1.776 50 10 AAGE C=C(F)CS(=O)(=O)NCB(O)O 2209079590 TWSCGZBFZRIDRI-UHFFFAOYSA-N 196.996 -1.599 50 10 AAGE NNC(=O)CN1C[C@H](O)C[C@@H](F)C1 2209174041 DTVGVTZCUBEBEQ-PHDIDXHHSA-N 191.206 -1.619 50 10 AAGE COCCNC(=O)C#CB(O)O 2241468241 JWCRZKSYQHQZKW-UHFFFAOYSA-N 170.961 -2.236 50 10 AAGE O=C(C#CB(O)O)NC[C@@H](O)CF 2241468819 VLKVAYHRQMUIIZ-YFKPBYRVSA-N 188.951 -2.552 50 10 AAGE C[C@@H]1NCC[C@@H]1NC(=O)C#CB(O)O 2241476414 RWUNJVJZZQJJLJ-BQBZGAKWSA-N 196.015 -2.132 50 10 AAGE CCN(CC(=O)O)C(=O)C#CB(O)O 2241583580 AARLLRFCYJOTMJ-UHFFFAOYSA-N 198.971 -2.065 50 10 AAGE O=C(CCO)NCCC#CB(O)O 2241906640 DQAANEDXAPNODP-UHFFFAOYSA-N 184.988 -2.110 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@@H](O)[C@@H]1C 2242172531 QTIYPDGGRSXPFC-LYFYHCNISA-N 187.243 -1.180 50 10 AAGE N#CCN(CC#N)CC(=O)NN 58839243 XOERFRUVHKPWKR-UHFFFAOYSA-N 167.172 -1.675 50 10 AAGE NNC(=O)c1cn(CCS)nn1 82473273 HZVLXRHOABAXGV-UHFFFAOYSA-N 187.228 -1.189 50 10 AAGE O[C@@H]1[C@H](CCl)O[C@@H](O)[C@H](O)[C@@H]1O 105358004 QMWDIHPSUCUMFU-YDMGZANHSA-N 198.602 -1.975 50 10 AAGE NNC(=O)Cn1cnnc1 143059588 RGDUIJJNZXFKJZ-UHFFFAOYSA-N 141.134 -1.732 50 10 AAGE COCCNc1ncc(B(O)O)cn1 170023390 MMSPFXCOMVSROI-UHFFFAOYSA-N 197.003 -1.785 50 10 AAGE NP(=O)(NCO)NCO 206291078 FIEWPFXMRPXBBM-UHFFFAOYSA-N 155.094 -1.868 50 10 AAGE CCOC(OCC)[C@@H](N)C(=O)NN 238311740 BKCDYWCDYJPQQL-YFKPBYRVSA-N 191.231 -1.297 50 10 AAGE Nc1cnc(B(O)O)c(F)c1 238572807 MGCIARPERGDIMA-UHFFFAOYSA-N 155.925 -1.517 50 10 AAGE NNC(=O)[C@H]1NCCn2ccnc21 306230066 KBKXJCXLXGUCGD-YFKPBYRVSA-N 181.199 -1.483 50 10 AAGE NNC(=O)N1CC[C@@H](O)[C@@H](CO)C1 306910979 QGBTXNPVUZXOPE-PHDIDXHHSA-N 189.215 -1.755 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@H]2C1 307541297 XMPWFBUQTSJFOA-OLQVQODUSA-N 155.201 -1.072 50 10 AAGE C[C@H](F)[C@H](N)C(=O)NN 1879975827 QOOVEXMLZOVSCW-HRFVKAFMSA-N 135.142 -1.338 50 10 AAGE O=C1OC(=O)c2cc(B(O)O)ccc21 1885667888 JMJBODWMLQZVOW-UHFFFAOYSA-N 191.935 -1.323 50 10 AAGE N#C[C@@H](O)[C@H](N)c1nn[nH]n1 1952896666 SKBQPZTVEOLFHI-GBXIJSLDSA-N 154.133 -1.916 50 10 AAGE C[C@H]1CC(=O)N1CCC(=O)NN 1953458478 RWDMTQYIVDQYEB-YFKPBYRVSA-N 171.200 -1.013 50 10 AAGE CN(CCC(=O)NN)Cc1ncon1 1955514828 DGYVOGZCMOFZRZ-UHFFFAOYSA-N 199.214 -1.119 50 10 AAGE Cc1nc(N2CCC2)ncc1B(O)O 1956955071 GYRHQQVZACAXBX-UHFFFAOYSA-N 193.015 -1.325 50 10 AAGE CCCOc1c(B(O)O)cnn1C 2059979972 MAYNPTUACDAEFC-UHFFFAOYSA-N 184.004 -1.111 50 10 AAGE CNNC(=O)C(C)(CO)CO 2241246410 NVJMSJFYEIYIKI-UHFFFAOYSA-N 162.189 -1.772 50 10 AAGE O=C(C#CB(O)O)N1CCSCC1 2241468394 NJQTZFVERKHJMU-UHFFFAOYSA-N 199.040 -1.423 50 10 AAGE CN(O)C(=O)c1ncccc1B(O)O 2241481942 XPAQTIGKPNYFCE-UHFFFAOYSA-N 195.971 -1.777 50 10 AAGE N#CNC(=O)c1nccnc1B(O)O 2241505293 CLOICBMBAWNFRT-UHFFFAOYSA-N 191.943 -2.633 50 10 AAGE O=C(NCCC#CB(O)O)C(F)F 2241909695 DXCJDSUUYPEVRR-UHFFFAOYSA-N 190.942 -1.227 50 10 AAGE OC[C@@H]1O[C@@H](O)[C@@H](O)[C@H](Cl)[C@H]1O 44699235 CRJLKIILIKSPDH-BYIBVSMXSA-N 198.602 -1.975 50 10 AAGE in-vitro NNC(=O)NCC(=O)N1CCCC1 161683345 QGGBSVKPUNHJEI-UHFFFAOYSA-N 186.215 -1.218 50 10 AAGE COC(=O)/C=C(\N)NNC(C)=O 210528269 UOJAXLZKYKWSAP-HWKANZROSA-N 173.172 -1.400 50 10 AAGE Cc1nnc(NNC(N)=O)nc1O 238521565 TUFVWLHPESCBJE-UHFFFAOYSA-N 184.159 -1.119 50 10 AAGE N#C[C@H](O)[C@@H]1NC(=O)CNC1=O 260720951 JATAXIPSPLTZCL-UCORVYFPSA-N 169.140 -2.515 50 10 AAGE CN1CCC[C@H]1C[N+]1=C=C(C=O)NN1 885687914 OPHIBUZWJIOYBP-VIFPVBQESA-N 195.246 -1.132 50 10 AAGE COCC(=O)NCC#CB(O)O 1881441542 DBBMCBXMTDZEKG-UHFFFAOYSA-N 170.961 -2.236 50 10 AAGE COCc1ncc(B(O)O)n1C 1887753872 QUHZRHFCWJSXLZ-UHFFFAOYSA-N 169.977 -1.754 50 10 AAGE NNC(=O)NC1(C(N)=O)CC1 1953250295 BBVIPGXIFPPVBP-UHFFFAOYSA-N 158.161 -1.823 50 10 AAGE O=C(C#CB(O)O)Nn1cccc1 2241468137 ICESCAJJLZCJLY-UHFFFAOYSA-N 177.956 -1.426 50 10 AAGE O=C(NOCCF)[C@@H]1C[C@@H]1B(O)O 2241481229 QMRJMCRWEFQBQC-UHNVWZDZSA-N 190.967 -1.133 50 10 AAGE CCn1cc(C(=O)O)nc1B(O)O 2241492393 BEWJYXDLKQLTAD-UHFFFAOYSA-N 183.960 -1.719 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2 133224930 URLCYCYCPADVKM-HSUXUTPPSA-N 199.210 -1.588 50 10 AAGE N#C[C@@](O)(CC(=O)O)C(=O)O 238660418 XSIHMJJQOLITFS-YFKPBYRVSA-N 159.097 -1.200 50 10 AAGE NNC(=O)CNC(=O)NC1CC1 306271572 SRECSUGOUMSWKW-UHFFFAOYSA-N 172.188 -1.562 50 10 AAGE CC(=O)N1CC[C@H](C(=O)NN)C1 306629428 KAEHYEDMGUWQDV-LURJTMIESA-N 171.200 -1.155 50 10 AAGE NNC(=O)N[C@@H]1CCNC(=O)CC1 306917660 ZVBKMFUDWSYBID-YFKPBYRVSA-N 186.215 -1.172 50 10 AAGE C/C(=C/C(=O)NNC(N)=O)C(=O)O 307639384 ZYWRZJQHDJOXEF-IHWYPQMZSA-N 187.155 -1.283 50 10 AAGE CONC(=O)c1c(B(O)O)ncn1C 1887430151 FNOVOQGFQNYXTN-UHFFFAOYSA-N 198.975 -2.609 50 10 AAGE CCNC(=O)c1c(B(O)O)ncn1C 1887431300 WPJQXJJWUNVMRG-UHFFFAOYSA-N 197.003 -2.150 50 10 AAGE N#C[C@@]1(O)COC[C@@H]1N 1930130182 HZBUNVGXNIAQPO-CRCLSJGQSA-N 128.131 -1.401 50 10 AAGE NNC(=O)C(=O)N[C@@H]1[C@@H]2CCOC[C@H]21 1930467104 PNVVOIPOYSGTKB-HSUXUTPPSA-N 199.210 -1.873 50 10 AAGE O=C(C#CB(O)O)N1CCC1=O 2241467943 DUAXHRMWNPMOMG-UHFFFAOYSA-N 166.929 -2.239 50 10 AAGE CN(C)NC(=O)[C@H]1C[C@H](O)CN1 147292973 AFHZREBOVGZUJO-NTSWFWBYSA-N 173.216 -1.698 50 10 AAGE O=C(CO)NNC(=O)[C@H]1CCO1 306236643 FBZHKCTWWCPFCO-SCSAIBSYSA-N 174.156 -2.085 50 10 AAGE CC(=O)N1CCNC[C@@H]1C(=O)NN 307199532 ZXTAAWURNPGDGW-ZCFIWIBFSA-N 186.215 -2.203 50 10 AAGE CN(CC(=O)NN)Cc1ccncn1 396621342 IWFMDWLVIWSWDX-UHFFFAOYSA-N 195.226 -1.102 50 10 AAGE CC[C@@]1(O)CCN(CC(=O)NN)C1 1930890294 OYNULZDTOSFBBQ-MRVPVSSYSA-N 187.243 -1.177 50 10 AAGE C#CCNc1ncccc1B(O)O 2209388361 UQWXGJQDIFZDME-UHFFFAOYSA-N 175.984 -1.194 50 10 AAGE O=C(C#CB(O)O)NCCO 2241468454 OPWWAPOJVMGZKF-UHFFFAOYSA-N 156.934 -2.890 50 10 AAGE O=C(C#CB(O)O)N[C@H]1[C@H]2COC[C@H]21 2241475826 GETVHUZLGZAKLV-UQWHLADISA-N 194.983 -2.237 50 10 AAGE CC(C)(NC(=O)C#CB(O)O)C(=O)O 2241583766 CYFNEFCWKIDBFG-UHFFFAOYSA-N 198.971 -2.019 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]2NCC[C@H]21 2241863061 URSUXRNBDAMLRZ-JKUQZMGJSA-N 155.201 -1.026 50 10 AAGE O[C@H]1[C@H](O)[C@@H](O)[C@H](O)O[C@H]1CCl 29309374 QMWDIHPSUCUMFU-DSOBHZJASA-N 198.602 -1.975 50 10 AAGE NNC(=O)[C@@H]1CN1CCO 39064505 JTQUDWBAPNSZEQ-WSAWMEMJSA-N 145.162 -2.347 50 10 AAGE C#CC[C@](C)(O)C(=O)NN 196014412 YKSRBFQGPVQHJK-LURJTMIESA-N 142.158 -1.249 50 10 AAGE CC(=O)c1cc(B(O)O)cc(N)n1 206086554 UNBKVQKQMKBVNR-UHFFFAOYSA-N 179.972 -1.454 50 10 AAGE CC(C)[C@H](CO)NC(=O)C(=O)NN 221773646 TYKCMBZUDBNLHW-YFKPBYRVSA-N 189.215 -1.891 50 10 AAGE CN(C)NC(=O)[C@@H](O)C(C)(C)CO 231479065 SHJWKXIBXIGJAP-ZCFIWIBFSA-N 190.243 -1.041 50 10 AAGE NNC(=O)C[C@H](O)NN 238575678 AWPNYSUDCNQOHH-REOHCLBHSA-N 134.139 -2.852 50 10 AAGE C=C[C@](C)(O)C(=O)NNC(=O)CO 857171217 VXXCETSBUGZCHS-ZETCQYMHSA-N 188.183 -1.937 50 10 AAGE O=C(CCO)NNCCO 1880071909 ICEGSRFAFKPSRN-UHFFFAOYSA-N 148.162 -2.018 50 10 AAGE C[C@H]1C[C@H]1C(=O)NCC#CB(O)O 1883751465 XFQCYBTZHFTGKT-NKWVEPMBSA-N 181.000 -1.226 50 10 AAGE CN(C)NC(=O)[C@H](N)[C@H]1CCOC1 1929928542 ZRAPHXOTRDTQEC-NKWVEPMBSA-N 187.243 -1.057 50 10 AAGE Cc1nc2n(c1B(O)O)CCC2 1931276657 VVELDKOXWGWZMC-UHFFFAOYSA-N 165.989 -1.182 50 10 AAGE CN(N)C(=O)[C@H]1COCCN1C 1934628059 QUBGKYCQNJKNHP-ZCFIWIBFSA-N 173.216 -1.351 50 10 AAGE NNC(=O)N1C[C@@H](O)C[C@@H](O)C1 1953525455 CVKKGMXEYNSYMG-SYDPRGILSA-N 175.188 -2.003 50 10 AAGE CN1C(=O)CC[C@H]1CC(=O)NN 33607237 CGUACKQQJOZZGP-YFKPBYRVSA-N 171.200 -1.013 50 10 AAGE C[C@H](CC(=O)NN)NCCN(C)C 58847107 IZQQGKDJZSVWRM-SSDOTTSWSA-N 188.275 -1.094 50 10 AAGE O=C(O)C[C@H](B(O)O)C(=O)O 196994485 YODYEUYTCHDAHA-REOHCLBHSA-N 161.906 -1.611 50 10 AAGE C[C@H](CN1CC[C@@H](O)C1)C(=O)NN 216477017 SUAKAGCEJFMTKA-RNFRBKRXSA-N 187.243 -1.321 50 10 AAGE Cc1ccnc(C#N)c1B(O)O 238465929 ASZOQGHKNNSQJB-UHFFFAOYSA-N 161.957 -1.059 50 10 AAGE Nc1ccnc(O)c1B(O)O 238659114 GIRAMMOBRDLMOD-UHFFFAOYSA-N 153.934 -1.951 50 10 AAGE O=CNNC(=O)c1cncnc1 306481333 GSYHBJXVAMXXDY-UHFFFAOYSA-N 166.140 -1.133 50 10 AAGE COc1cnc(B(O)O)cc1F 307483642 HOTQFJOONBSYHX-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE CC1(C)CN(C(=O)C(=O)NN)C1 307719080 MJPBDDGAESSZFV-UHFFFAOYSA-N 171.200 -1.155 50 10 AAGE NC[C@H](O)CC(=O)NN 575465974 NLCGJDGQUCPHFR-GSVOUGTGSA-N 133.151 -2.314 50 10 AAGE C=CCOCCn1cc(B(O)O)cn1 694513106 BQXJXKKKEDUSLI-UHFFFAOYSA-N 196.015 -1.235 50 10 AAGE C[C@H](O)C1CN([C@@H](C)C(=O)NN)C1 719806654 JTHWWEAVZVRCOM-WDSKDSINSA-N 187.243 -1.323 50 10 AAGE Cc1nc[nH]c1C(=O)NNC(=O)CO 1611094686 IUEIYRDVHGKWLP-UHFFFAOYSA-N 198.182 -1.529 50 10 AAGE Cc1ncn(C)c1C(=O)NNCCO 1887663776 JOKPGEPNEFDUCV-UHFFFAOYSA-N 198.226 -1.045 50 10 AAGE C[C@H](C(=O)NN)N1C[C@](C)(O)CO1 1930291909 RTAQGDHLAPRTLP-VDTYLAMSSA-N 189.215 -1.637 50 10 AAGE C[S@](=O)N[C@@H](CB(O)O)C(=O)O 1953523797 APBWXNZPLIGYAE-CMEQDNRLSA-N 195.005 -2.205 50 10 AAGE C[C@@H](NC(=O)C#CB(O)O)C(F)F 2241467974 FHDOQOXDAXNJOE-SCSAIBSYSA-N 190.942 -1.228 50 10 AAGE O=C(C#CB(O)O)NCCC1CNC1 2241468925 XCFZTZHMTYIOPM-UHFFFAOYSA-N 196.015 -2.273 50 10 AAGE O=C(C#CB(O)O)NC[C@H]1CCCN1 2241469016 YSKMOWOXZJEQIA-SSDOTTSWSA-N 196.015 -2.130 50 10 AAGE NC1CN(C(=O)C#CB(O)O)C1 2241479265 VCWPJVWPEKFWMG-UHFFFAOYSA-N 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NC(=O)N/N=C1\C=C/C(=N/O)N1 306588682 TXOAMNJOCQYSGN-UHFFFAOYSA-N 169.144 -1.085 50 10 AAGE C[C@@H]1OCCN(C)[C@@H]1C(=O)NN 306897265 SLDBWMIUYSRMGF-WDSKDSINSA-N 173.216 -1.305 50 10 AAGE N#C[C@]1(O)C[C@H](O)[C@@H]2O[C@H]21 307131362 ZZFYRSMSXDWPRD-UNTFVMJOSA-N 141.126 -1.227 50 10 AAGE NC(=O)NNC(=O)c1ccc(=O)oc1 606272020 MPYBTRQRSVHRDT-UHFFFAOYSA-N 197.150 -1.047 50 10 AAGE O=C(NCB(O)O)c1cnccn1 706512177 SGCUGPCSTPXQFF-UHFFFAOYSA-N 180.960 -1.782 50 10 AAGE CNNC(=O)CNC(C)=O 707670520 CTXYAVQGTDIYBJ-UHFFFAOYSA-N 145.162 -1.627 50 10 AAGE ClCS[C@H]1NN[C@H]2NCNN12 953055309 VRNJZESRJTYCFO-DMTCNVIQSA-N 195.679 -1.042 50 10 AAGE C[C@@]1(C(=O)NN)C[C@@H](O)CN1 1521508501 VJQAOITWVCXQGU-XINAWCOVSA-N 159.189 -1.911 50 10 AAGE NNC(=O)[C@@H]1NC[C@@H](O)[C@@H]1O 1880495483 KKKNJLVDAQWZLP-JJYYJPOSSA-N 161.161 -3.330 50 10 AAGE NNC(=O)[C@@H]1[C@H](C(=O)O)[C@H]2C=C[C@H]1O2 1914776369 SXIMZYIVKBIHNQ-ARQDHWQXSA-N 198.178 -1.370 50 10 AAGE NNC(=O)C1(C(=O)O)CCOCC1 1954396898 TVPGPAGGJJTSKK-UHFFFAOYSA-N 188.183 -1.142 50 10 AAGE OB(O)c1cnn(CCC2COC2)c1 1955561186 CVTBVIXTPASFMA-UHFFFAOYSA-N 196.015 -1.401 50 10 AAGE NNC(=O)C(=O)N(C1CC1)C1COC1 1955667094 VVBNCTBKEPKVIX-UHFFFAOYSA-N 199.210 -1.634 50 10 AAGE COc1ccc(B(O)O)cc1CN 2086854507 KCYIDWVFMVVGFW-UHFFFAOYSA-N 181.000 -1.166 50 10 AAGE NNC(=O)CCN1CC[C@@]2(O)C[C@@H]2C1 2241317359 NFARHBWMFDRYLQ-VXNVDRBHSA-N 199.254 -1.177 50 10 AAGE O=C([C@@H]1C[C@@H]1B(O)O)N1CC(O)C1 2241474803 LHVLGYFZUSJIJJ-RITPCOANSA-N 184.988 -1.948 50 10 AAGE C[C@H]1CNC[C@@H]1C(=O)NN 69635722 NNFYDICAWJLAEU-WHFBIAKZSA-N 143.190 -1.168 50 10 AAGE CO[C@@H]1CN[C@H](C(=O)NN)C1 69635738 CSEXZYAVMYMKHC-WHFBIAKZSA-N 159.189 -1.647 50 10 AAGE NNC(=O)CCN1CCCNCC1 82470524 SGRUCJCPWYYVLI-UHFFFAOYSA-N 186.259 -1.338 50 10 AAGE CN(C)NC(=O)COCC(=O)O 134000695 NNWJVNFHJKKPFP-UHFFFAOYSA-N 176.172 -1.320 50 10 AAGE CO[C@H]1CN[C@H](C(=O)NN(C)C)C1 147239678 DQCBPCPPFPTUBB-RQJHMYQMSA-N 187.243 -1.044 50 10 AAGE NNC(=O)N1CC[C@](O)(CO)C1 306164106 OJJHTVDCIGLZRW-ZCFIWIBFSA-N 175.188 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AAGE NC(=O)CN1CC[C@@H](B(O)O)C1 1891559653 LEIZLWDVUZVWLO-RXMQYKEDSA-N 171.993 -1.980 50 10 AAGE COC(=O)NNC1=N[C@H]2C[C@H]2N1 1923833880 SYEPZIUJQAGCII-ZXZARUISSA-N 170.172 -1.053 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H](O)C2(CC2)C1 1930236141 WHQZRXZHTBIGDN-RNFRBKRXSA-N 199.254 -1.179 50 10 AAGE NNC(=O)N1C[C@@H]2C[C@H](O)[C@H]2C1 1931412680 KQDQPAHJLYZOEK-ZLUOBGJFSA-N 171.200 -1.118 50 10 AAGE O=C(NCB(O)O)[C@@]12CC[C@@H]1C2 1935498963 CXJNRALLZUZJJB-IYSWYEEDSA-N 168.989 -1.085 50 10 AAGE NNC(=O)CCN1CCO[C@H]2C[C@@H]21 1954052400 IZAWOHUROGJUNS-BQBZGAKWSA-N 185.227 -1.161 50 10 AAGE C=C1CN(c2ncc(B(O)O)cn2)C1 2210061039 PQEQXHBZOHVJHV-UHFFFAOYSA-N 190.999 -1.467 50 10 AAGE C#C[C@@H]1CCN(C(=O)C#CB(O)O)C1 2241468444 OLAFGBONSWRZPU-MRVPVSSYSA-N 190.995 -1.517 50 10 AAGE C[C@@H]1CN(C(=O)C#CB(O)O)C[C@H]1F 2241468463 OUYUKISNLDGBPL-RNFRBKRXSA-N 198.990 -1.182 50 10 AAGE CN(C(=O)C#CB(O)O)C(C)(C)CN 2241468820 VLQOCNFAMUBMEF-UHFFFAOYSA-N 198.031 -1.803 50 10 AAGE C[C@H](N)CCNC(=O)C#CB(O)O 2241478638 JGWGYAUAFUUULL-LURJTMIESA-N 184.004 -2.145 50 10 AAGE COC(=O)CN(C)C(=O)C#CB(O)O 2241479399 XHSYYXOEBYVJMR-UHFFFAOYSA-N 198.971 -2.367 50 10 AAGE COC1CN(C(=O)[C@H]2C[C@@H]2B(O)O)C1 2241481580 WNCRAXXQRWAWIH-BQBZGAKWSA-N 199.015 -1.294 50 10 AAGE CCc1nn(C)c(C(=O)O)c1B(O)O 2241494463 YKKUTOVCGWYURL-UHFFFAOYSA-N 197.987 -1.640 50 10 AAGE CCn1ncc(B(O)O)c1C(=O)NN 2241496272 QTDLPEDEARVOSJ-UHFFFAOYSA-N 197.991 -2.814 50 10 AAGE NNC(=O)c1cc(NN)ccn1 1728923 VBVMUEIRJABWRG-UHFFFAOYSA-N 167.172 -1.029 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](O)[C@H](O)[C@@H]1Cl 306312988 UDOJFSFHKNQOHC-BSQWINAVSA-N 198.602 -1.975 50 10 AAGE CN(NC(=O)c1nc[nH]n1)C(N)=O 306794789 UBCFYHWKXFLACX-UHFFFAOYSA-N 184.159 -1.540 50 10 AAGE CC(=O)N(C)CC(=O)NCB(O)O 701957321 CUUMLNYOPUJNFG-UHFFFAOYSA-N 187.992 -2.407 50 10 AAGE N=c1nc(B(O)O)[nH]s1 1879984379 DZHNJQPTFQIEDK-UHFFFAOYSA-N 144.952 -2.370 50 10 AAGE C[C@H](C(N)=O)N1CC[C@@H](B(O)O)C1 1891559135 GVUCEDIQSANCOW-PHDIDXHHSA-N 186.020 -1.591 50 10 AAGE NNC(=O)CN1CC(n2ccnn2)C1 1956761966 WKRRAYVYTCIPAS-UHFFFAOYSA-N 196.214 -1.875 50 10 AAGE COc1cc(B(O)O)ccc1CN 2086850096 COYUXTXSIROHLB-UHFFFAOYSA-N 181.000 -1.166 50 10 AAGE C=C(F)Cn1cc(B(O)O)cnc1=O 2210081561 OFOPXDUVFQPHQG-UHFFFAOYSA-N 197.962 -1.594 50 10 AAGE O=C(C#CB(O)O)NCc1ncco1 2241468837 VQEBWSJPPOCUQR-UHFFFAOYSA-N 193.955 -1.694 50 10 AAGE CC(C)N(CCO)C(=O)C#CB(O)O 2241478299 BSYDXUJVMAZZMA-UHFFFAOYSA-N 199.015 -1.769 50 10 AAGE C[C@@H](CC(N)=O)NC(=O)C#CB(O)O 2241478884 MUPNSCWZLQJAOF-YFKPBYRVSA-N 197.987 -2.618 50 10 AAGE O=C(NC1COC1)C1CC(B(O)O)C1 2241495832 NGFOXVHHUQCGPU-UHFFFAOYSA-N 199.015 -1.246 50 10 AAGE CNC(=O)c1nccc(C)c1B(O)O 2241496475 SWAVTMBUSDHLBV-UHFFFAOYSA-N 193.999 -1.571 50 10 AAGE COC1(OC)NC=C(C=O)C(=O)N1 35003408 VHFBYABLLCKDIW-UHFFFAOYSA-N 186.167 -1.307 50 10 AAGE C=C(C#N)C[C@@H](O)[C@@H](O)C(=O)CO 214277565 OKEYZYDECWWZDQ-HTRCEHHLSA-N 185.179 -1.261 50 10 AAGE N#Cc1c(N)cncc1B(O)O 238602731 AZIGICOGWGGTMD-UHFFFAOYSA-N 162.945 -1.785 50 10 AAGE CN1CC[C@@H]([C@H](N)CC(=O)NN)C1 259017131 IGQOGBXRRFVNGG-RNFRBKRXSA-N 186.259 -1.355 50 10 AAGE NNC(=O)c1ncoc1C(=O)NN 306675327 SGKREOYDDMOYNT-UHFFFAOYSA-N 185.143 -2.118 50 10 AAGE CNC(=O)CC(=O)NNC(=O)OC 308255605 IYDUEOVWGMJOED-UHFFFAOYSA-N 189.171 -1.490 50 10 AAGE CNC(=O)C[S@](=O)CC(=O)NN 526889523 RSXJDNRUGGECPJ-LBPRGKRZSA-N 193.228 -2.529 50 10 AAGE OB(O)c1ccn(COCC2CC2)n1 694229179 OOHSZJXKAQEUCQ-UHFFFAOYSA-N 196.015 -1.053 50 10 AAGE CC[S@](=O)NCB(O)O 701948605 BGHPYMAMBHKUSM-VIFPVBQESA-N 150.996 -1.728 50 10 AAGE CCn1cnc2c(B(O)O)ncnc21 1884748649 SGEQPGYRTXREKB-UHFFFAOYSA-N 191.987 -1.474 50 10 AAGE NNC(=O)[C@@H]1COC[C@H]1C(=O)O 1887855932 ZOAJMRPDZYMWKV-QWWZWVQMSA-N 174.156 -1.677 50 10 AAGE Cn1cc(C(=O)NNCCO)cn1 1929831764 HURYAOUDQQGRQB-UHFFFAOYSA-N 184.199 -1.353 50 10 AAGE NC(=O)[C@@H]1CCN1C(=O)C#CB(O)O 2241470832 CLVDWOXNZSJMTF-YFKPBYRVSA-N 195.971 -2.912 50 10 AAGE NC(=O)c1c(F)cccc1B(O)O 2241473142 DOTLWMWOKFGQMR-UHFFFAOYSA-N 182.947 -1.396 50 10 AAGE OC[C@@H]1O[C@@H](O)[C@@H](O)[C@@H](Cl)[C@H]1O 33744995 CRJLKIILIKSPDH-GKFJPSPNSA-N 198.602 -1.975 50 10 AAGE in-vitro NNC(=O)c1cncc(C(=O)NN)c1 39119615 BSXGNABNXBZDAE-UHFFFAOYSA-N 195.182 -1.711 50 10 AAGE C[C@]1(C(=O)NN)COC[C@@H]1N 85395511 ZXLWCUAMVVTRKW-NJGYIYPDSA-N 159.189 -1.660 50 10 AAGE CC[C@@H](N)C(=O)N(C)[C@H](C)B(O)O 222268414 XLDOIPBSVVFRIC-PHDIDXHHSA-N 188.036 -1.417 50 10 AAGE NNC(=O)C1(C(=O)O)CC(CO)C1 238654673 DKCVZWFLERPZPL-UHFFFAOYSA-N 188.183 -1.550 50 10 AAGE CS(=O)(=O)c1ncc(B(O)O)o1 306761893 GEPSJUZUOHTVAO-UHFFFAOYSA-N 190.973 -2.242 50 10 AAGE NC(=O)NNC(=O)[C@@H]1[C@H]2COC[C@H]21 306800547 OTRDWPGFQHVPOW-SCDXWVJYSA-N 185.183 -1.422 50 10 AAGE N#CCc1cc(NN)ccc1B(O)O 306944249 XIPHEIRZEWXTKL-UHFFFAOYSA-N 190.999 -1.282 50 10 AAGE CC(=O)NNC(=O)CNCC(N)=O 308133063 CGQWVXCUVAWQLQ-UHFFFAOYSA-N 188.187 -2.771 50 10 AAGE O[C@H]1O[C@@H](CCl)[C@@H](O)[C@H](O)[C@@H]1O 605693498 QMWDIHPSUCUMFU-GNFDWLABSA-N 198.602 -1.975 50 10 AAGE in-vitro O=C(COC1CC1)NCB(O)O 716963044 JWUWHXVGQMBINP-UHFFFAOYSA-N 172.977 -1.706 50 10 AAGE Cn1cnnc1C=CB(O)O 1880135074 ZWAJCUVQJLQMFL-UHFFFAOYSA-N 152.950 -1.160 50 10 AAGE CC[C@@H](C(=O)NN)N1CC=C[C@@H]1CO 1884400144 PAAGDUMVACEXGX-SFYZADRCSA-N 199.254 -1.012 50 10 AAGE OB(O)c1cnn(C[C@H]2CCO2)c1 1888592889 ZCBCCGPHTAIMBY-SSDOTTSWSA-N 181.988 -1.648 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1CN1CC[C@H]1CO 1929741541 QXWDLOKKXNMSTF-GJMOJQLCSA-N 199.254 -1.321 50 10 AAGE N#C[C@@H](O)[C@H](N)CCn1cnnn1 1952976872 UMTAQDXQFLPCBO-PHDIDXHHSA-N 182.187 -1.725 50 10 AAGE CN(C)NC(=O)[C@H](F)C1(O)CNC1 1954067019 SVDKAGMCKLLIQS-YFKPBYRVSA-N 191.206 -1.748 50 10 AAGE Cn1ccnc1NC(=O)C#CB(O)O 2241468333 LWTWQSMIOSIQFM-UHFFFAOYSA-N 192.971 -1.626 50 10 AAGE O=C(C#CB(O)O)Nc1nn[nH]n1 2241468578 QSIZBAKSYMDPPG-UHFFFAOYSA-N 180.920 -2.846 50 10 AAGE NC(=S)NNC(=O)[C@@H]1CCOC1 83590875 UXCHULOXQIOBMB-SCSAIBSYSA-N 189.240 -1.113 50 10 AAGE CC(=O)OC(=O)[C@@H](N)CCO 116062927 YEBVYYAFTIJSHY-YFKPBYRVSA-N 161.157 -1.214 50 10 AAGE CCNNC(=O)NN 141755033 JYZVAJRSNNFELK-UHFFFAOYSA-N 118.140 -1.316 50 10 AAGE O=Cc1c(O)cncc1B(O)O 206094176 IDWOJELLZIRHFK-UHFFFAOYSA-N 166.929 -1.721 50 10 AAGE CCOC(=O)CNNC(=O)[C@H](C)N 238289096 GTFKAJMTAMPXBC-YFKPBYRVSA-N 189.215 -1.483 50 10 AAGE Cc1ncc(B(O)O)cc1C#N 238571228 WDWSKYCPVBZGNF-UHFFFAOYSA-N 161.957 -1.059 50 10 AAGE NC(=O)NNCCC[C@@H](N)C(=O)O 379349531 PEWZEOGLRHLMPG-SCSAIBSYSA-N 190.203 -1.649 50 10 AAGE Cc1n[nH]c(C)c1C(=O)NCB(O)O 701957752 GEMOJWIEIJTWBE-UHFFFAOYSA-N 197.003 -1.232 50 10 AAGE Cn1cc(B(O)O)c(CO)n1 1880463452 VESMGZHCRRUJHB-UHFFFAOYSA-N 155.950 -2.408 50 10 AAGE CC(=O)NNC(=O)CN1CC(C#N)C1 1892436608 SBEHXCKKRFNACI-UHFFFAOYSA-N 196.210 -1.391 50 10 AAGE CN(CCN)CC(=O)NN(C)C 1932529606 GNKGKGAOXNETOY-UHFFFAOYSA-N 174.248 -1.530 50 10 AAGE Cc1cnc(B(O)O)c(C)n1 1933212890 QJPLIOCFWPJGQW-UHFFFAOYSA-N 151.962 -1.227 50 10 AAGE NNC(=O)CN1CC[C@@H]1c1ncon1 1955512365 FZMPSTLCMYYYAA-RXMQYKEDSA-N 197.198 -1.194 50 10 AAGE C[C@@H](N)COc1cc(B(O)O)ccn1 2210061722 XUEFZPBCBHBDNR-ZCFIWIBFSA-N 196.015 -1.513 50 10 AAGE CN[C@@H](C)CNC(=O)C#CB(O)O 2241468354 MIKQRWGGZVDLJD-LURJTMIESA-N 184.004 -2.274 50 10 AAGE O=C(C#CB(O)O)N1CCOCCN1 2241468878 WFBUDRYUBUTKQJ-UHFFFAOYSA-N 197.987 -2.635 50 10 AAGE O=C(C#CB(O)O)N[C@@]12COC[C@H]1C2 2241479082 QZLKVICPBRDSKJ-SVRRBLITSA-N 194.983 -2.093 50 10 AAGE CC(=O)NC(=O)[C@H]1C[C@H](B(O)O)C1 2241479957 CDXOBJZXQBKION-IZLXSQMJSA-N 184.988 -1.098 50 10 AAGE NC(CO)(CO)CNC(=O)F 2241809944 ZTZKUKSQXQQECV-UHFFFAOYSA-N 166.152 -1.652 50 10 AAGE CN1C(=O)C(N)=C(C#N)C1=O 164047971 VFDLFGKNOBMOBK-UHFFFAOYSA-N 151.125 -1.279 50 10 AAGE CCCNCC(=O)N(C)CB(O)O 238250336 PGBXCLPUBNKZID-UHFFFAOYSA-N 188.036 -1.544 50 10 AAGE O=c1[nH]ncc2cc(B(O)O)ccc12 238648154 OSKFZXDEHVVWDY-UHFFFAOYSA-N 189.967 -1.397 50 10 AAGE O=C(O)[C@@H]1CN[C@H]2[C@@H](Cl)C(=O)N12 238665088 SWPPKWGZGHMTRY-PZGQECOJSA-N 190.586 -1.182 50 10 AAGE Cn1nnc(/C=N/NC(N)=O)n1 306412820 QVPRSNWXMICBMX-QHHAFSJGSA-N 169.148 -1.788 50 10 AAGE CC(=O)NN=C[C@H](O)CO 307839237 UHCNQERPHHUVDK-YFKPBYRVSA-N 146.146 -1.539 50 10 AAGE N#C/C=C\[C@@H](O)[C@H](O)[C@H](O)CO 379320704 YCBYRDXNEGJSQS-JXXMSZCLSA-N 173.168 -1.859 50 10 AAGE NC(=O)CC(=O)NNC(=O)C1CCC1 1322224140 DGAYFTKZEBDGAJ-UHFFFAOYSA-N 199.210 -1.191 50 10 AAGE NNC(=O)N1CC[C@H](O)[C@@H](O)C1 1881080005 DSJSNVJBFBVISR-WHFBIAKZSA-N 175.188 -2.003 50 10 AAGE NNC(=O)CCN1CC[C@@H]2[C@H](O)C[C@H]21 1885074500 GSPOLSGBNSDSFF-XLPZGREQSA-N 199.254 -1.179 50 10 AAGE OB(O)c1nccn2nccc12 1928428898 NLPAKSJOCGXZFX-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE N#C[C@H](O)[C@@H](N)c1c[nH]c(=O)cn1 1952958054 JBWDMBCPORSRDR-FSPLSTOPSA-N 180.167 -1.346 50 10 AAGE CCOc1c(B(O)O)c(C)nn1C 2059954558 CUKFJVLEQIHBOW-UHFFFAOYSA-N 184.004 -1.193 50 10 AAGE C[C@H](O)CN=c1ncc(B(O)O)c[nH]1 2210061659 XDCFBJNXGCKISK-YFKPBYRVSA-N 197.003 -2.629 50 10 AAGE O=C(NO)c1ncc(B(O)O)cn1 2241583648 BBQGKWYQCKYNQI-UHFFFAOYSA-N 182.932 -2.725 50 10 AAGE NNC(=O)c1cocc1C(=O)NN 1603378 NDGYPSDHWVYRKD-UHFFFAOYSA-N 184.155 -1.513 50 10 AAGE CC1(NC(=O)C(=O)NN)CC1 142855404 QYOKLFPDYCVGGZ-UHFFFAOYSA-N 157.173 -1.355 50 10 AAGE COc1cc(C#N)ncc1B(O)O 238331449 NXNDPLZZKJICKU-UHFFFAOYSA-N 177.956 -1.358 50 10 AAGE CN1CCc2ncc(B(O)O)cc2C1 238341466 VJEMNWHOGSJDTA-UHFFFAOYSA-N 192.027 -1.251 50 10 AAGE NNC(=O)NNC(=O)[C@H]1CCCN1 238661456 VCFDUQMKNMERTO-SCSAIBSYSA-N 187.203 -2.058 50 10 AAGE OCc1cc2nc[nH]c2cc1B(O)O 306726357 ZESJQCUOTCAWJH-UHFFFAOYSA-N 191.983 -1.265 50 10 AAGE C[C@H]1CN(CCC(=O)NN)C[C@@H]1O 307589656 AVPXVNPTNKTVSN-BQBZGAKWSA-N 187.243 -1.321 50 10 AAGE CO[C@@H](C)CN(C)CC(=O)NN 379317748 HLKARUSUZYNWCB-LURJTMIESA-N 175.232 -1.057 50 10 AAGE CN(CC(=O)NN)C[C@@H]1CCOC1 398961529 ZJNDZNBUNOFIHH-ZETCQYMHSA-N 187.243 -1.055 50 10 AAGE NNC(=O)C[S@](=O)CCF 526906556 HFTZNKMUBQKEMM-SNVBAGLBSA-N 168.193 -1.306 50 10 AAGE CN(C(=O)NN)[C@H]1C[C@@H](C(N)=O)C1 703506651 XQMWPHMZKSPIPY-SYDPRGILSA-N 186.215 -1.235 50 10 AAGE NNC(=O)N1CCC1(CO)CO 1881290388 RCRJUPZAHLXASP-UHFFFAOYSA-N 175.188 -2.001 50 10 AAGE COC(=O)Nc1ncc(B(O)O)cn1 1955275714 ZWNGVWMXUIUXOU-UHFFFAOYSA-N 196.959 -1.665 50 10 AAGE Cc1ncc(C(=O)NNCCO)n1C 1956923913 UXMZQCJIMBYDNB-UHFFFAOYSA-N 198.226 -1.045 50 10 AAGE N[C@@H](CCCCN(N)C=O)C(=O)O 2069607817 RMQKNUGPOJDEPU-LURJTMIESA-N 189.215 -1.099 50 10 AAGE CN(CCCO)C(=O)C#CB(O)O 2241468705 SPOXHFYRZCMIOD-UHFFFAOYSA-N 184.988 -2.157 50 10 AAGE C[C@H](O)C[C@@H](C)NC(=O)C#CB(O)O 2241471218 HDMYFRYEYWJTBX-RQJHMYQMSA-N 199.015 -1.723 50 10 AAGE CNC(=O)c1cn(C)nc1B(O)O 2241496713 VQJCUYZSZSOZJP-UHFFFAOYSA-N 182.976 -2.541 50 10 AAGE CC(C)[C@H](NC(=O)[C@H](C)N)B(O)O 195071311 CYSODVAPDPNLDY-WDSKDSINSA-N 188.036 -1.514 50 10 AAGE CN(C)NC(=O)[C@H]1CCN1 307113529 MRYALOBDTBPMLY-RXMQYKEDSA-N 143.190 -1.059 50 10 AAGE C[C@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)C#N 308204628 HABJMIHBEMYZOB-RRNSMKEASA-N 191.183 -2.666 50 10 AAGE NNC(=O)CCN1C#CNN1 885250131 GEXSXHUWSMOEME-UHFFFAOYSA-N 155.161 -2.390 50 10 AAGE CNC(=O)NNC(=O)c1nnn(C)n1 1597341972 SLQWKVQDLFXAPU-UHFFFAOYSA-N 199.174 -2.216 50 10 AAGE NC(=O)C(NC(=O)F)C(N)=O 1880317376 XAPYKCFYVIUBTI-UHFFFAOYSA-N 163.108 -1.995 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H]2[C@H]1CO 1896394695 FCUULEUTVAZJQI-KVQBGUIXSA-N 199.210 -2.185 50 10 AAGE NNC(=O)[C@@H]1NC[C@H]2CC[C@@H]21 1935243597 RLKBTRAWLIFOMY-NGJCXOISSA-N 155.201 -1.026 50 10 AAGE CO[C@H]1C[C@H](O)CN(C(=O)NN)C1 1954843093 DAPSYYYJUBQLRY-WDSKDSINSA-N 189.215 -1.349 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2C[C@H]1[C@@H]1C[C@H]21 1955370187 VJOPVIUPOLJXBY-VZFHVOOUSA-N 195.222 -1.157 50 10 AAGE Nc1nc(B(O)O)ccc1Cl 2208980212 ZYRZKBPOQGPFOB-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE C[C@@H](N)CN=c1ccc(B(O)O)c[nH]1 2210068183 NOGVWYOYRDWABW-ZCFIWIBFSA-N 195.031 -2.058 50 10 AAGE O=C(NC[C@@H]1CCN1)[C@@H]1C[C@@H]1B(O)O 2241496491 SXEFLWLBSKKEKI-XVMARJQXSA-N 198.031 -1.673 50 10 AAGE CN(C=O)Cc1ccccc1B(O)O 2241562839 URQSQWILYXZTRN-UHFFFAOYSA-N 193.011 -1.045 50 10 AAGE CN(C)NC(=O)CCO 141367737 CNSLWCCLZVKPNA-UHFFFAOYSA-N 132.163 -1.038 50 10 AAGE COc1cc(C=O)c(B(O)O)cn1 238385480 CKFNIUREJCLPNS-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE OB(O)c1ccc(F)c(O)n1 306915526 VCLSXWHHQCAZGG-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE COCC(=O)NN=c1cc[nH]n1C 308411644 LTFPHABBIUJQCQ-UHFFFAOYSA-N 184.199 -1.069 50 10 AAGE NC(=O)NNC(=O)[C@@]12COC[C@H]1C2 575519970 AZAPTUYMABEFHZ-FBCQKBJTSA-N 185.183 -1.278 50 10 AAGE O=C(F)NCB(O)O 1879943918 PVMDQYAZLCYZLZ-UHFFFAOYSA-N 120.876 -1.323 50 10 AAGE O=C(NNCCO)[C@@H]1[C@H]2CCO[C@H]21 1881756459 KXEZXIQVYWDLAJ-FSDSQADBSA-N 186.211 -1.366 50 10 AAGE CN(C)c1ncc(F)cc1B(O)O 1882884137 GRHLKUXKCYVRHZ-UHFFFAOYSA-N 183.979 -1.034 50 10 AAGE NNC(=O)CN1CC[C@@H](O)[C@H]1C1CC1 1887034520 HTHBVADZZPGJIV-VXNVDRBHSA-N 199.254 -1.179 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2C[C@H]1CN2C 1887148211 LXEPTYRDGQNKTL-FXQIFTODSA-N 198.270 -1.247 50 10 AAGE CN(N)C(=O)C1(S(C)(=O)=O)CC1 1953397287 NREOUWLNFRDCLM-UHFFFAOYSA-N 192.240 -1.104 50 10 AAGE CN(c1ncc(B(O)O)cn1)C1CC1 1956956934 GDTXDOSSDPSCAT-UHFFFAOYSA-N 193.015 -1.245 50 10 AAGE O=C(NO)c1ccc(B(O)O)cc1O 2241584335 MKQYYTPIZLINHP-UHFFFAOYSA-N 196.955 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307906594 RBEGMPAFDRYYIG-OMMKOOBNSA-N 198.602 -2.132 50 10 AAGE NCCNNC(=O)[C@@H]1COCCN1 308553923 YPEFOHOFEXHUOI-LURJTMIESA-N 188.231 -2.446 50 10 AAGE CCc1nnc2ccc(B(O)O)cn12 584883215 JBGRYYFSLPVTOC-UHFFFAOYSA-N 190.999 -1.029 50 10 AAGE COCC[C@H](C)C(=O)NCB(O)O 702018626 XCBFBZCFGHJADZ-LURJTMIESA-N 189.020 -1.213 50 10 AAGE Cn1nnc(C[N+]2=C=C(C=O)NN2)n1 885611597 DLMJOBGMJSPSCI-UHFFFAOYSA-N 194.178 -2.502 50 10 AAGE C[C@@H](O)C(=O)NNC(=O)c1cnn[nH]1 1144479720 AOJHINDSOCUUNU-GSVOUGTGSA-N 199.170 -2.054 50 10 AAGE CC(=O)NNC(=O)C[C@H]1CC(=O)N1 1463828150 KRKVENXKSYWMGZ-RXMQYKEDSA-N 185.183 -1.568 50 10 AAGE CNC(=O)NNC(=O)Cn1ncnn1 1542262802 WFPLEYAZKKTCTH-UHFFFAOYSA-N 199.174 -2.367 50 10 AAGE O=C(NCB(O)O)c1ncc[nH]1 1881445755 NGQYJWREMDDXLB-UHFFFAOYSA-N 168.949 -1.849 50 10 AAGE CC[C@H](O)C(=O)NNCCO 1888715052 WQJMUDSTLKZAMG-YFKPBYRVSA-N 162.189 -1.630 50 10 AAGE OB(O)c1cccnc1OC1COC1 1956967565 FRUNRTRNBOKOME-UHFFFAOYSA-N 194.983 -1.461 50 10 AAGE ONc1ncc(B(O)O)cn1 2208978001 JUHXGUGDXQFMDQ-UHFFFAOYSA-N 154.922 -2.043 50 10 AAGE O=C(NC1COC1)[C@@H]1C[C@@H]1B(O)O 2241496572 VCIICPPWBXPBSF-RITPCOANSA-N 184.988 -1.636 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@H](O)[C@@H]1C 2242160542 QTIYPDGGRSXPFC-ACZMJKKPSA-N 187.243 -1.180 50 10 AAGE Cn1cnnc1SCC(=O)NN 82471941 MTCVFLKWLZFXKD-UHFFFAOYSA-N 187.228 -1.103 50 10 AAGE NN(C=O)C=O 113654261 XHRLHFIZYKNVGV-UHFFFAOYSA-N 88.066 -1.525 50 10 AAGE NNC(=O)CCON 139843911 QYUGQJWUWNDOLO-UHFFFAOYSA-N 119.124 -1.743 50 10 AAGE O=C1NC(=O)[C@@H](Cl)[C@H](NO)N1 167570108 JXZRXCWDXFCZOD-LWMBPPNESA-N 179.563 -1.262 50 10 AAGE N#Cc1ccnc(C#N)c1B(O)O 238612139 ZTTDIXUMIIBTII-UHFFFAOYSA-N 172.940 -1.495 50 10 AAGE Nc1ccnc(Cl)c1B(O)O 238658067 FMMLSIJJQJMMNC-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE OC[C@@H]1O[C@H](CCl)[C@@H](O)[C@@H]1O 238670939 AFEGDRDJPMKARR-JGWLITMVSA-N 182.603 -1.293 50 10 AAGE C[C@H]1CO[C@@H](C(=O)NCB(O)O)C1 718526345 LMBQHEZKCAQSTH-PHDIDXHHSA-N 187.004 -1.460 50 10 AAGE COc1nsc(OC)c1B(O)O 885536071 YVCRNMOQPADVEH-UHFFFAOYSA-N 189.001 -1.160 50 10 AAGE NNC(=O)CN1CC[C@H]2COC[C@@H]21 1883765352 SQVXJPBXRJEXDR-BQBZGAKWSA-N 185.227 -1.303 50 10 AAGE NNC(=O)[C@@H]1CN[C@H]2C[C@@H]21 1923215729 GIKOVJFYGLEFGF-WDCZJNDASA-N 141.174 -1.416 50 10 AAGE NNC(=O)C1=CCNC1 1923216094 IKFFZPGCCYJKQN-UHFFFAOYSA-N 127.147 -1.494 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2CCC[C@H]21 1928999767 QGNIXWJBYFDKIX-NTSWFWBYSA-N 183.211 -1.013 50 10 AAGE CCCNC(=O)c1cc(B(O)O)c[nH]1 2241468918 WZFJADFSUKONOL-UHFFFAOYSA-N 196.015 -1.166 50 10 AAGE NC(=O)c1csnc1B(O)O 2241479985 CQAWLJYWTHAZHL-UHFFFAOYSA-N 171.974 -2.078 50 10 AAGE Cc1cc(C(N)=O)c(B(O)O)s1 2241496765 WECJTMSRIALSFS-UHFFFAOYSA-N 185.013 -1.165 50 10 AAGE CNCC(F)(F)C(=O)NN 2242453600 YFVCMTKKXYUTCN-UHFFFAOYSA-N 153.132 -1.169 50 10 AAGE NNC(=O)c1nnc(O)[nH]c1=O 62718408 GLEOXVMHIWPFKM-UHFFFAOYSA-N 171.116 -2.526 50 10 AAGE O=C1Cc2nc(B(O)O)ccc2N1 217658619 JYMHUXHDTMNKPF-UHFFFAOYSA-N 177.956 -1.744 50 10 AAGE O=c1nc[nH]c2c(B(O)O)cccc12 223732686 BUTLWKMDNDTNCR-UHFFFAOYSA-N 189.967 -1.397 50 10 AAGE COc1cc(C(=O)O)ncc1B(O)O 238361815 MOXGLZMGEDYBFS-UHFFFAOYSA-N 196.955 -1.532 50 10 AAGE Nc1cc(N)c(B(O)O)cn1 238695824 FIRXTOSOVNEXOM-UHFFFAOYSA-N 152.950 -2.074 50 10 AAGE O=C(CO)NNC(=O)c1nc[nH]n1 307203330 GWKBZCDMRRPTJL-UHFFFAOYSA-N 185.143 -2.442 50 10 AAGE C[C@H](CC(=O)NN)N1CC(C)(O)C1 307569668 XQCQVSFYRFYIAS-ZCFIWIBFSA-N 187.243 -1.179 50 10 AAGE COC[C@@H](NC(C)=O)C(=O)NN 399522820 OZOIBCYGNHWNQD-RXMQYKEDSA-N 175.188 -1.873 50 10 AAGE C[C@@H]1CN(CC(=O)NN)C[C@H]1CO 708061898 GMSPVPCXNNGBPQ-RQJHMYQMSA-N 187.243 -1.464 50 10 AAGE C[C@@H](ON)C(=O)NN(C)C 708729229 CQLAVXCTGBEJHU-SCSAIBSYSA-N 147.178 -1.142 50 10 AAGE C[C@H](N)[C@H](O)C(=O)NN 1879953306 WZDGGBRQVHSJHQ-HRFVKAFMSA-N 133.151 -2.316 50 10 AAGE O=C(F)N[C@@H]1CS(=O)(=O)C[C@H]1O 1881055882 WTUDEMAHVOTVBA-QWWZWVQMSA-N 197.187 -1.177 50 10 AAGE CN(C[C@@H]1C[C@@H]1C(=O)NN)C1COC1 1915659352 YRMUPYBBQLGZCK-XPUUQOCRSA-N 199.254 -1.057 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CCNC1=O 2241468446 OLBGBDREMJWSDT-RXMQYKEDSA-N 195.971 -2.994 50 10 AAGE C=C[C@@H](C)ONC(=O)C#CB(O)O 2241478202 ADANQYMINAPQKF-ZCFIWIBFSA-N 182.972 -1.376 50 10 AAGE O=C(O)c1cnsc1B(O)O 2297002093 IOPUHMWEKLEXQG-UHFFFAOYSA-N 172.958 -1.479 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@@H](CN)C1 216306374 WXMMMANJYIFDPL-RQJHMYQMSA-N 186.259 -1.355 50 10 AAGE C#CC[C@H](NC(=O)NN)C(=O)NN 238661643 BALJUPHRBXUXBP-BYPYZUCNSA-N 185.187 -2.459 50 10 AAGE N[S@](=O)c1ccc(B(O)O)cc1 306524841 OHCFEDLDHLJTKN-GFCCVEGCSA-N 185.013 -1.652 50 10 AAGE NNC(=O)[C@H]1CC(F)(F)CN1 306997658 XAKUYJDYUYUOCB-GSVOUGTGSA-N 165.143 -1.027 50 10 AAGE CN(C)C[C@H](N)C(=O)NN(C)C 702343048 SVEARCPJUOMDLM-LURJTMIESA-N 174.248 -1.532 50 10 AAGE CO[C@H]1CCN[C@H](C(=O)NN)C1 1881069042 KOKSXBTYMGMEAT-WDSKDSINSA-N 173.216 -1.257 50 10 AAGE C[C@@H]1CCN(C(=O)NN)[C@@H]1C(N)=O 1928670812 CXTUJJMNPGIOAT-UHNVWZDZSA-N 186.215 -1.235 50 10 AAGE N#CC1CN(CCC(=O)NN)C1 1953612647 ORKOHCHTDMJWHA-UHFFFAOYSA-N 168.200 -1.178 50 10 AAGE OB(O)c1cnc(=NCCCF)[nH]c1 2210061867 ZNRXHLAIDATWEE-UHFFFAOYSA-N 198.994 -1.650 50 10 AAGE O=C([C@H]1C[C@H](B(O)O)C1)N1CCCN1 2241495890 OBUZSLYQQJSSAG-LJGSYFOKSA-N 198.031 -1.024 50 10 AAGE NNC(=O)[C@@H]1CCCN1 34213766 CMCFIGZTTYAYIZ-BYPYZUCNSA-N 129.163 -1.272 50 10 AAGE NNC(=O)c1ccc[n+]([O-])c1 39257337 DVPDFNLVFDDUKE-UHFFFAOYSA-N 153.141 -1.077 50 10 AAGE C[C@H](CN1CC[C@H](O)C1)C(=O)NN 82468728 SUAKAGCEJFMTKA-RQJHMYQMSA-N 187.243 -1.321 50 10 AAGE CC[C@H]1C(=O)NCCN1C(=O)NN 82477256 GLSZFXUCQUQHTR-YFKPBYRVSA-N 186.215 -1.220 50 10 AAGE CN1CC(C#N)=C(NC(=N)N)C1=O 238329079 QXKRNWAGCMOGQM-UHFFFAOYSA-N 179.183 -1.281 50 10 AAGE CNC(=O)CNC(=O)NNC(C)=O 306214140 WHEPSCWPHXIHQW-UHFFFAOYSA-N 188.187 -1.917 50 10 AAGE CC(=O)NNC(=O)CNC(N)=O 306332820 FAMBMJDFCUVHDR-UHFFFAOYSA-N 174.160 -2.178 50 10 AAGE Nc1ccc(B(O)O)c2[nH]cnc12 306723811 STDOYSGTRQOPTQ-UHFFFAOYSA-N 176.972 -1.175 50 10 AAGE OB(O)c1ccn(CC[C@H]2CO2)n1 718493511 TXRDHRMYIXCAAF-LURJTMIESA-N 181.988 -1.648 50 10 AAGE COCn1cccc(B(O)O)c1=O 1882115709 OMGKWYJBKLWIGP-UHFFFAOYSA-N 182.972 -1.868 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@@]2(CO)C1 1899623119 UNOYXMNUMRBIJR-XNCJUZBTSA-N 199.210 -2.183 50 10 AAGE C[C@@]1(C(=O)NN)C[C@H](N)CCO1 1929653708 OCDYNTVNPPTBDG-VDTYLAMSSA-N 173.216 -1.127 50 10 AAGE CC(C)(O)[C@H](N)[C@@H](O)C#N 1952793419 LMSZQJAHGFNHGB-CRCLSJGQSA-N 144.174 -1.031 50 10 AAGE Cc1c[nH]c(=NC(=O)C(=O)NN)cn1 2209897366 KURYSCHXYJMRGH-UHFFFAOYSA-N 195.182 -1.865 50 10 AAGE N[C@@H](C(=O)O)[C@@H](O)CCl 5131834 CETUIFTXYGHITB-STHAYSLISA-N 153.565 -1.002 50 10 AAGE in-vitro NCc1ccc(=O)n(CC(=O)NN)c1 76731381 AZSHKWXKCSHVNN-UHFFFAOYSA-N 196.210 -1.703 50 10 AAGE C[C@@H](B(O)O)N1CC[C@@](C)(N)C1=O 195847418 ATJSDXPLQQPXNL-CAHLUQPWSA-N 186.020 -1.663 50 10 AAGE COCCO[C@H](COC)C(=O)NN 232417497 BZNCRUVSXMVWSF-ZCFIWIBFSA-N 192.215 -1.346 50 10 AAGE CN1CCc2cc(B(O)O)cnc21 238313182 DEYNJUQTXKDMHS-UHFFFAOYSA-N 178.000 -1.246 50 10 AAGE Cc1c(B(O)O)c(=O)n(C)c(=O)n1C 238500180 RXBOJUCEHFEDTC-UHFFFAOYSA-N 197.987 -2.928 50 10 AAGE OB(O)c1ccnc(-n2cccn2)c1 238652058 ASKLLRLVYOPYQT-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE O=C(O)C=NNC(=O)C(=O)O 394817758 FEFBIXONKGJRSF-UHFFFAOYSA-N 160.085 -1.742 50 10 AAGE CNC(=O)CCCNC(=O)NN 397997653 LKQPFJPGPFUAFH-UHFFFAOYSA-N 174.204 -1.315 50 10 AAGE CCNC(=O)NCB(O)O 575457658 FBXHCGKYZVMRAT-UHFFFAOYSA-N 145.955 -1.683 50 10 AAGE NNC(=O)CN1C[C@@H](O)C[C@@H]1CO 699289762 UFPCIJNNSUXGHD-RITPCOANSA-N 189.215 -2.596 50 10 AAGE NNC(=O)C(=O)NC[C@H]1CC1(F)F 717107742 HYFKBDYQSJDVBR-GSVOUGTGSA-N 193.153 -1.252 50 10 AAGE NNC(=O)[C-]1N=C=C(CO)S1 885340901 HXZKJZPTOOFMCI-UHFFFAOYSA-N 172.189 -1.242 50 10 AAGE Cc1cc(B(O)O)cc(=O)o1 1880308938 BOMDSDBVUHLLBI-UHFFFAOYSA-N 153.930 -1.372 50 10 AAGE NNC(=O)C1=C[C@H](O)[C@@H](N)C1 1880336880 ZLAJVUTYHQTPDU-WHFBIAKZSA-N 157.173 -2.005 50 10 AAGE NNC(=O)Cn1cnnc1O 1923843940 QKONOEPSPCFTLW-UHFFFAOYSA-N 157.133 -2.026 50 10 AAGE NNC(=O)[C@@H]1NC[C@@H]2CC[C@H]21 1935243596 RLKBTRAWLIFOMY-KVQBGUIXSA-N 155.201 -1.026 50 10 AAGE OCC1(O)CN(C[C@H](O)CCl)C1 1953699390 FGUAVRITEZKVKQ-ZCFIWIBFSA-N 195.646 -1.375 50 10 AAGE N[C@H]1C[C@@H](NC(=O)[C@H]2C[C@@H]2B(O)O)C1 2241478911 NLPFQJHVFWVMOT-VZFHVOOUSA-N 198.031 -1.545 50 10 AAGE CN(O)C(=O)[C@H]1C[C@@H]1B(O)O 2241494656 AUBSFFPWUYOREM-IMJSIDKUSA-N 158.950 -1.303 50 10 AAGE O=CNc1ncc(B(O)O)s1 2241554793 HKGNEEYNVUAAEG-UHFFFAOYSA-N 171.974 -1.609 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2COC[C@H]1C2 2241893563 KVGVMRWGVNUFOF-NTSWFWBYSA-N 199.210 -1.776 50 10 AAGE NNC(=O)c1n[nH]nc1S 39065403 DNLPTPNUHDOMCQ-UHFFFAOYSA-N 159.174 -1.303 50 10 AAGE NNC(=O)C[C@H](O)[C@@H](O)[C@H](O)CO 224160043 BECUBMLLHUYFKV-MRKVFDINSA-N 194.187 -3.559 50 10 AAGE Cc1ccnc(N)c1B(O)O 238470493 WSNVAASGJOSMJI-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE O=C(O)c1cc(O)ncc1B(O)O 238635402 LBZOPNQHOUCKPB-UHFFFAOYSA-N 182.928 -1.835 50 10 AAGE CNNC(=O)[C@@H](N)C1CCOCC1 258948876 ATMNKVNUNYLQLC-ZETCQYMHSA-N 187.243 -1.009 50 10 AAGE Cc1cnc(B(O)O)c(O)c1 306563535 DGBDMNLLORBUSJ-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE C[C@@H]1NC(=O)[C@@H](Cl)[C@@H](O)N1 306786047 KHVWBDHZOIDPHQ-YVZJFKFKSA-N 164.592 -1.022 50 10 AAGE NNC(=O)CCOC1CNC1 307730121 KDBNEAQKGCCWMN-UHFFFAOYSA-N 159.189 -1.645 50 10 AAGE NN=C1NN[C@H](Cl)C[C@@H]1N 575627774 JBMCIZPHDIEWFH-HRFVKAFMSA-N 163.612 -1.351 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]2CC[C@@H]21 1924442467 NYVZZPVLVKZZET-RITPCOANSA-N 183.211 -1.013 50 10 AAGE C[C@@H]1CN(C(=O)NN)CCN1 1953245718 YBXRFMOCHSUMRV-RXMQYKEDSA-N 158.205 -1.137 50 10 AAGE C[C@]12CN(CC(=O)NN)C[C@@]1(CO)C2 1956312270 NYLKZOXHQUEFAL-DTWKUNHWSA-N 199.254 -1.319 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@H]2C[C@@]2(O)C1 1956823769 JVUJPHGKUSHZNF-BKPPORCPSA-N 199.254 -1.179 50 10 AAGE CCS(=O)(=O)CNC(=O)NNC 2208992761 GTHDWOMHHVCPPF-UHFFFAOYSA-N 195.244 -1.188 50 10 AAGE O=C(NCC=CB(O)O)c1ccno1 2209955565 CFSLKOKZBHSDOT-UHFFFAOYSA-N 195.971 -1.027 50 10 AAGE COc1ccc(B(O)O)c(N(C)C)n1 2241391998 JLSUNBMOVJVSTF-UHFFFAOYSA-N 196.015 -1.164 50 10 AAGE C[C@@H](C[C@@H](C)O)NC(=O)C#CB(O)O 2241471215 HDMYFRYEYWJTBX-NKWVEPMBSA-N 199.015 -1.723 50 10 AAGE O=C(NC1(CO)CC1)C1(B(O)O)CC1 2241480361 HHRBEYKWFQVMKC-UHFFFAOYSA-N 199.015 -1.366 50 10 AAGE O=C(NCCF)[C@H]1C[C@@H]1B(O)O 2241495893 OCAXRBFDDSDRFP-WHFBIAKZSA-N 174.968 -1.065 50 10 AAGE NNc1cc(B(O)O)c(F)cn1 2297008224 DWGWSBFWSGGPET-UHFFFAOYSA-N 170.940 -1.814 50 10 AAGE CCNC(=O)COCC(=O)NN 58840376 XFWXUBXSYALKEQ-UHFFFAOYSA-N 175.188 -1.871 50 10 AAGE CN(C)/C=C(/C=O)C(=O)NC=O 101450751 JKPMVRAEOJPKEZ-UTCJRWHESA-N 170.168 -1.097 50 10 AAGE NC(=O)NNC(=O)CO 104570807 GVGZGSBGWSICRH-UHFFFAOYSA-N 133.107 -2.322 50 10 AAGE NC/C(CO)=N/NC(N)=O 212002649 DJKCKLRJHUYTRX-CLTKARDFSA-N 146.150 -2.038 50 10 AAGE CN1C(=O)Cc2ccc(B(O)O)cc21 219327511 RXZAMZIQYGRSKS-UHFFFAOYSA-N 190.995 -1.115 50 10 AAGE C[C@@]1(C(N)=O)CCN(C(=O)NN)C1 235395928 XZIAZBNKJBPRSK-SSDOTTSWSA-N 186.215 -1.233 50 10 AAGE COc1cnc(B(O)O)c(F)c1 238389258 QKHLQHWFRROVCQ-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE NC(=O)N/N=C/C[C@@H](N)CO 238580075 QMWLTUZGHKLXJZ-ORGSOSLOSA-N 160.177 -1.650 50 10 AAGE NNC(=O)N[C@@H](CO)C(=O)NN 238661721 SZWDZLUOEMQNPJ-REOHCLBHSA-N 177.164 -3.490 50 10 AAGE Cc1ccc(B(O)O)cc1C(N)=O 306452994 IDCGSYFSXOFIBR-UHFFFAOYSA-N 178.984 -1.226 50 10 AAGE CNC(=O)C[C@H]1NC(=O)OC1=O 306471765 BGPBAFJKMIYLKS-GSVOUGTGSA-N 172.140 -1.243 50 10 AAGE COC[S@](=O)CC(=O)NN 526873559 YVQMEYVPYRJMHJ-SNVBAGLBSA-N 166.202 -1.671 50 10 AAGE NNC(=O)C1=[S+]C=C[C@H]1[N+](=O)[O-] 725541999 WLTICCXYUJUCMY-GSVOUGTGSA-O 188.188 -1.596 50 10 AAGE N[C@]1(B(O)O)[C@H]2C[C@H]2[C@H]2C[C@H]21 1953209793 LNPWIKUUMQXSBT-GGTDAZAQSA-N 152.990 -1.018 50 10 AAGE CN(C)c1ncncc1B(O)O 1953708933 UPTXKSRUHDHHRZ-UHFFFAOYSA-N 166.977 -1.778 50 10 AAGE CNC1(C(=O)NN(C)C)COC1 1953718729 XUOMFMONVREADS-UHFFFAOYSA-N 173.216 -1.432 50 10 AAGE NNC(=O)N1CC(=O)N[C@@H]2CC[C@@H]21 1953947979 ZKEQGGVIRXVUOG-UHNVWZDZSA-N 184.199 -1.468 50 10 AAGE NNC(=O)C(=O)NCC1[C@@H]2CC[C@@H]12 1954465501 IALFZNINLFCFMK-RFZPGFLSSA-N 183.211 -1.252 50 10 AAGE C[C@@H]1CNC(=O)C[C@](N)(B(O)O)C1 1954486337 QTGNQUPAMAYLRE-FSPLSTOPSA-N 186.020 -1.758 50 10 AAGE NNC(=O)N1CCC[C@H]2CNC(=O)[C@H]21 2241249876 AKWROBBFVNXTCV-WDSKDSINSA-N 198.226 -1.220 50 10 AAGE CCn1ncc(B(O)O)c1C(=O)O 2241494245 WBKNBHCFMWSJNQ-UHFFFAOYSA-N 183.960 -1.719 50 10 AAGE CN=c1cc(B(O)O)c(Cl)c[nH]1 2242391461 FOELABOPPBFQHQ-UHFFFAOYSA-N 186.407 -1.122 50 10 AAGE NNC(=O)Cc1cc(O)no1 39112997 GUQGQUIANSLOMD-UHFFFAOYSA-N 157.129 -1.087 50 10 AAGE NNC(=O)CNC(CO)(CO)CO 58845285 MKKFCCIJBSOPCP-UHFFFAOYSA-N 193.203 -3.718 50 10 AAGE NNC(=O)CN1C(=O)CSC1=O 82468308 JGMISOQQUFRPAJ-UHFFFAOYSA-N 189.196 -1.328 50 10 AAGE COc1nc(OC)nc(B(O)O)n1 197892068 FUIPMSLQLPEKQC-UHFFFAOYSA-N 184.948 -2.431 50 10 AAGE O=C1NCc2cc(F)c(B(O)O)cc21 199808541 LPSOOAFMZBYESR-UHFFFAOYSA-N 194.958 -1.251 50 10 AAGE OB(O)c1cnc(F)cc1O 238634614 CTFCZMCFPSKTON-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE C[C@H]1CCN(CC(=O)NN)[C@H]1CO 299911599 OAKIORFSJXAQBB-BQBZGAKWSA-N 187.243 -1.321 50 10 AAGE O=C(CCl)N[C@@H]1C(=O)OC[C@@H]1O 675078901 BBUFMJHMKSFHLZ-UCORVYFPSA-N 193.586 -1.372 50 10 AAGE NNC(=O)CCN1CC[C@H]1C(N)=O 757145939 MBQQTICCTMBTSI-YFKPBYRVSA-N 186.215 -2.074 50 10 AAGE C[C@@H]1[C@H](O)CN1C[C@H]1C[C@H]1C(=O)NN 1885887368 FQXWYVMJXOIPBH-WCTZXXKLSA-N 199.254 -1.323 50 10 AAGE C[C@H]1[C@H](O)CCN1[C@H](C)C(=O)NN 1914256384 QTIYPDGGRSXPFC-RRKCRQDMSA-N 187.243 -1.180 50 10 AAGE O=C(C#CB(O)O)N1C[C@H](O)[C@H](O)C1 2241478772 LDFKYCRZIXVPHC-OLQVQODUSA-N 198.971 -3.434 50 10 AAGE COC(=O)/C=N/NC(=O)CN(C)C 95698634 ZGEVXMOHSIPVKY-XBXARRHUSA-N 187.199 -1.177 50 10 AAGE N#C[C@@H](O)c1cn(CCO)nn1 117139288 XCRSOSYEPKZSAG-ZCFIWIBFSA-N 168.156 -1.173 50 10 AAGE Cc1cn[nH]c1B(O)O 203565960 IVUNNICUBVWZDT-UHFFFAOYSA-N 125.924 -1.602 50 10 AAGE CC1(C)[C@@H](C(=O)NN)[C@@H]1C(=O)NN 216139665 CJSONMREASNKSX-QWWZWVQMSA-N 186.215 -1.762 50 10 AAGE O=C1NCc2c(B(O)O)cncc21 238637059 AEOXYKVIYUUMQT-UHFFFAOYSA-N 177.956 -1.995 50 10 AAGE Cn1cc(C(=O)NN)c(O)nc1=O 306345170 DDTZBMDMHTUQET-UHFFFAOYSA-N 184.155 -1.911 50 10 AAGE O=CNNC(=O)c1csnn1 307179233 KDCNQVRBCAYSPF-UHFFFAOYSA-N 172.169 -1.071 50 10 AAGE O=C1COc2c(cccc2B(O)O)N1 584647013 OGWMCRCWMVSFQN-UHFFFAOYSA-N 192.967 -1.303 50 10 AAGE CO[C@@H]1C[C@@H]1C(=O)NNC(N)=O 689975880 NBXIEDNMDQGJED-IUYQGCFVSA-N 173.172 -1.279 50 10 AAGE CNC(=O)c1c(B(O)O)nc(C)n1C 1887430538 LLWOYGMLJLZDSI-UHFFFAOYSA-N 197.003 -2.232 50 10 AAGE CC(C)OCC(=O)NCC#CB(O)O 1895239565 OOKCOAILDWVNJU-UHFFFAOYSA-N 199.015 -1.457 50 10 AAGE CCN=c1[nH]ccc(B(O)O)c1F 2209388157 REJRWQGEKGUXKX-UHFFFAOYSA-N 183.979 -1.246 50 10 AAGE N[C@H]1C[C@H]1Nc1ncccc1B(O)O 2210067789 FRZCZQCMUOXUSU-NKWVEPMBSA-N 193.015 -1.727 50 10 AAGE NC[C@@H]1CCCN1C(=O)C#CB(O)O 2241468232 JRTGSTVDSRJIIC-ZETCQYMHSA-N 196.015 -2.049 50 10 AAGE NC(=O)NNC(=O)c1ncncc1F 2242187111 IMZLDBQBKSTCLI-UHFFFAOYSA-N 199.145 -1.071 50 10 AAGE ONc1cc(B(O)O)c(F)cn1 2297008062 AKFOKQFGYNUVEJ-UHFFFAOYSA-N 171.924 -1.298 50 10 AAGE C#CCNCC(=O)NN(C)C 147288770 RNDJLMNDIRUSJI-UHFFFAOYSA-N 155.201 -1.198 50 10 AAGE CC(C)NNC(=O)[C@@H]1NCC[C@@H]1O 238197144 PWLDFDWAJAUNIM-NKWVEPMBSA-N 187.243 -1.262 50 10 AAGE COc1cc(F)c(B(O)O)cn1 238344243 FDXKOQWIUUEECK-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE C[C@H](O)[C@H](N)C(=O)N(C)CB(O)O 238484849 MSRHVSXKXKQMNK-WHFBIAKZSA-N 190.008 -2.835 50 10 AAGE NC(=O)N/N=C1/NC(=O)CS1 307113374 RGODEERLVUJGTP-UHFFFAOYSA-N 174.185 -1.211 50 10 AAGE NNC(=O)C(=O)NC1(C(F)F)CC1 697349326 FHYNJNSEXIGPNB-UHFFFAOYSA-N 193.153 -1.110 50 10 AAGE C[C@@H](CN(C)C)N(C)CC(=O)NN 1893429150 PMPGCTWNXJKLHP-ZETCQYMHSA-N 188.275 -1.142 50 10 AAGE C[C@]12CCO[C@@H]1[C@](N)(B(O)O)C2 1933397705 KMJOXVWHLMBRFO-XVMARJQXSA-N 171.005 -1.105 50 10 AAGE Cn1c(Cl)cnc1B(O)O 1953148377 WHYQESKREZFEIF-UHFFFAOYSA-N 160.369 -1.247 50 10 AAGE CO[C@H](C(=O)NN)C1CNC1 1953324402 JKCKSDFLORWXDT-YFKPBYRVSA-N 159.189 -1.789 50 10 AAGE CNNC(=O)[C@@H](C)CO 2241248430 YYMYIQCMARRTPD-BYPYZUCNSA-N 132.163 -1.135 50 10 AAGE CNCCN(C)C(=O)C#CB(O)O 2241468236 JUPTXUQSWLIWDZ-UHFFFAOYSA-N 184.004 -2.320 50 10 AAGE C=C[C@H](C)CNC(=O)C#CB(O)O 2241471407 JENYLTHTQGWUPI-ZETCQYMHSA-N 181.000 -1.060 50 10 AAGE C#CCNC(=O)C1(B(O)O)CC1 2241473116 CZKVSDIMFHBDLL-UHFFFAOYSA-N 166.973 -1.257 50 10 AAGE NNC(=O)c1ncncc1B(O)O 2241473300 HRJKUSFOQMSTFJ-UHFFFAOYSA-N 181.948 -3.240 50 10 AAGE CCN(O)C(=O)c1ccc(B(O)O)o1 2241479078 QYECUEXRACOPDM-UHFFFAOYSA-N 198.971 -1.189 50 10 AAGE N#CCNC(=O)[C@@H]1C[C@@H]1B(O)O 2241481042 QJEPYONJVAIPJJ-UHNVWZDZSA-N 167.961 -1.511 50 10 AAGE CCNC(=O)CNC(=O)C(=O)NN 36779916 AQFOHSIENVZGIF-UHFFFAOYSA-N 188.187 -2.771 50 10 AAGE O=C(CCl)N[C@H](O)C(=O)O 104735440 YULYKRNXBRMJQU-GSVOUGTGSA-N 167.548 -1.256 50 10 AAGE C[C@@H](O)B(O)O 200984044 YSYBKRZEMGFYIC-UWTATZPHSA-N 89.887 -1.621 50 10 AAGE O=C(O)[C@@H]1CN[C@@H]2[C@@H](Cl)C(=O)N12 238665029 SWPPKWGZGHMTRY-NUNKFHFFSA-N 190.586 -1.182 50 10 AAGE C[C@H](O)[C@](O)(CO)[C@H](O)C(=O)NN 388696790 MHMQNUPOMLUWHA-MRKVFDINSA-N 194.187 -3.559 50 10 AAGE CNNC(=O)c1n[nH]c(C)n1 575555135 XXLYGNKDCQUSEK-UHFFFAOYSA-N 155.161 -1.023 50 10 AAGE N#C[C@@H]1CCN(CC(=O)NN)C1 606250967 TXOHWWMBAWJUSQ-LURJTMIESA-N 168.200 -1.178 50 10 AAGE N#C/C(=C1\NCCN1CCN)[N+](=O)[O-] 687728008 SYKXKLXLRKNSDL-SREVYHEPSA-N 197.198 -1.180 50 10 AAGE NNC(=O)CCCN1CCNC1=O 696376548 PLUPHAWIHUOJCL-UHFFFAOYSA-N 186.215 -1.218 50 10 AAGE C[C@@H](C(=O)NN)N1CC2(COC2)C1 697131538 CFDKLECSYKGDJJ-LURJTMIESA-N 185.227 -1.303 50 10 AAGE O=C(NCB(O)O)[C@H]1CC12CC2 705162019 VXNJKBCLQSCBJS-RXMQYKEDSA-N 168.989 -1.085 50 10 AAGE CC(C)(CN1C#CNN1)C(=O)NN 885429532 CEVCCLZUZDSYCI-UHFFFAOYSA-N 183.215 -1.754 50 10 AAGE C[C@@H](CN1CC=C[C@H]1CO)C(=O)NN 1884401047 WPBGEWGPFVVXSD-YUMQZZPRSA-N 199.254 -1.155 50 10 AAGE C[C@]12CCO[C@H]1[C@](N)(B(O)O)C2 1933397703 KMJOXVWHLMBRFO-QYNIQEEDSA-N 171.005 -1.105 50 10 AAGE NNC(=O)N1CC=C[C@H](O)C1 1953296660 VPEKKWZZIJFUDY-YFKPBYRVSA-N 157.173 -1.198 50 10 AAGE NC1CN(c2ccc(B(O)O)cn2)C1 2210060972 OWPMMHLIYVFQFG-UHFFFAOYSA-N 193.015 -2.091 50 10 AAGE O=C(C#CB(O)O)N=c1cc[nH][nH]1 2241468514 PTUVQNFSCOHHBO-UHFFFAOYSA-N 178.944 -2.215 50 10 AAGE NNC(=O)N1CC[C@H]1[C@@H](O)CO 2241829263 BBCVUKGTWWNXRA-WHFBIAKZSA-N 175.188 -2.003 50 10 AAGE CNC(NC)(NC)C(=O)N(N)Cl 149870216 RXRQNXIOKHDSKK-UHFFFAOYSA-N 195.654 -1.846 50 10 AAGE NC(=O)c1cc(B(O)O)co1 199829623 KEYLIIQLEZJRIP-UHFFFAOYSA-N 154.918 -1.942 50 10 AAGE C[C@@H](CC(=O)NN)NC(=O)NN 238390844 GTVUVBHZQAMWTR-VKHMYHEASA-N 175.192 -2.072 50 10 AAGE OOB(O)O 263589769 RKKOMEIYHHASIN-UHFFFAOYSA-N 77.832 -1.555 50 10 AAGE C[C@@H](O)C(=O)NNC(=O)CCO 308177572 ZXXJWUWJJOSVIR-SCSAIBSYSA-N 176.172 -2.103 50 10 AAGE NC(=O)NN=C1CCC1=NNC(N)=O 308280371 XMEBMUFBWGYCLY-UHFFFAOYSA-N 198.186 -1.171 50 10 AAGE COCn1ccc(B(O)O)n1 575472486 HANUGYNSFVKWLG-UHFFFAOYSA-N 155.950 -1.833 50 10 AAGE O=C(NCB(O)O)[C@@H]1CCCCO1 702028220 DJBUHIKAXDKWGC-LURJTMIESA-N 187.004 -1.316 50 10 AAGE NNC(=O)CCN1CC[C@@H]1C(N)=O 757145920 MBQQTICCTMBTSI-RXMQYKEDSA-N 186.215 -2.074 50 10 AAGE O=C(NCB(O)O)[C@@H]1C[C@@H]1Cl 1880450716 OKCBTAQRLWQMKL-DMTCNVIQSA-N 177.396 -1.258 50 10 AAGE NNC(=O)CN1C[C@@H]2[C@@H](CO)[C@@H]2C1 1882367399 MIAOMWUJWVXRTI-ZMONIFLSSA-N 185.227 -1.854 50 10 AAGE NNC(=O)CN1C[C@H]2COCC[C@@H]21 1883242717 CICICQARAHNSBO-BQBZGAKWSA-N 185.227 -1.303 50 10 AAGE C=C(Cn1nc(C)n(C)c1=O)B(O)O 1895191106 KJAUYGDYONYTOA-UHFFFAOYSA-N 197.003 -1.542 50 10 AAGE Cc1nc(=NC(=O)C(=O)NN)n(C)[nH]1 1905143689 SCQPGLBOMUAEKT-UHFFFAOYSA-N 198.186 -2.526 50 10 AAGE CN1CC[C@H](CC(=O)NN)C1=O 1923853546 CFMFIDQJRKLRNZ-RXMQYKEDSA-N 171.200 -1.155 50 10 AAGE C[C@H]1CN[C@H](C(=O)NN)C1 1953183592 NXWPVDAKROTQBW-UHNVWZDZSA-N 143.190 -1.026 50 10 AAGE O=C(NCCO)[C@H]1C[C@H](B(O)O)C1 2241496043 OTRONANXKKKJPJ-IZLXSQMJSA-N 187.004 -1.652 50 10 AAGE O=C(C#CB(O)O)NCC[C@H]1CCO1 2242543981 CTHRQIMMSBMXJZ-ZETCQYMHSA-N 196.999 -1.703 50 10 AAGE NNC(=O)CNCC(=O)NN 3069174 SGGJEQOWVMBRHU-UHFFFAOYSA-N 161.165 -3.444 50 10 AAGE C[C@@H](C(=O)NN)N1CCC(O)CC1 82465918 JPRFTUKPARNZFK-LURJTMIESA-N 187.243 -1.179 50 10 AAGE CNC(=O)CCN(C)C(=O)NN 234331582 CSTMFTFMKZQXGQ-UHFFFAOYSA-N 174.204 -1.362 50 10 AAGE O[B-](O)(O)c1cccc(Cl)n1 238852668 GZSGITFEBCXLCU-UHFFFAOYSA-N 174.372 -1.142 50 10 AAGE C[C@@H](C(=O)NN)S(N)(=O)=O 306677058 XYPWJSOQAGGDHK-REOHCLBHSA-N 167.190 -2.347 50 10 AAGE NNC(=O)COC1CNC1 307713240 ZXOWTCZXECLRSN-UHFFFAOYSA-N 145.162 -2.035 50 10 AAGE CC[S@@](=O)CC(=O)NNC(C)=O 307948537 AQMVJUGNXNQOCW-GFCCVEGCSA-N 192.240 -1.078 50 10 AAGE CN(C)NC(=O)CCOCCN 388425026 JXOINSFKJYNEHH-UHFFFAOYSA-N 175.232 -1.055 50 10 AAGE NNC(=O)N1CC2(COC2)C1 606246871 SGDBJZDVTMLIPN-UHFFFAOYSA-N 157.173 -1.098 50 10 AAGE CN(C1=C(C#N)NC#CN1)C1CNC1 885543272 YXJDRQJSWULHIU-UHFFFAOYSA-N 189.222 -1.306 50 10 AAGE CC1=C=C([N+]2=C=C(C=O)NN2)NN1C 885573175 QSQWVCZKWVHDKL-UHFFFAOYSA-N 192.202 -1.432 50 10 AAGE C[C@H](O)C(=O)N(C)N 1879942268 NFRXVCWXCNVUHB-VKHMYHEASA-N 118.136 -1.301 50 10 AAGE C[C@@H](C(=O)NN)N(C)[C@H]1C[C@H](O)C1 1882176917 LEQLHPWNURBZEA-ACZMJKKPSA-N 187.243 -1.180 50 10 AAGE NNC(=O)CN1C[C@@H](O)CC12CCC2 1934430325 KQICBTUMPSKCRJ-ZETCQYMHSA-N 199.254 -1.034 50 10 AAGE CS(=O)(=O)CC[C@@H](N)[C@H](O)C#N 1952815486 NVUKUPSYFFIAPQ-PHDIDXHHSA-N 192.240 -1.367 50 10 AAGE N#C[C@H](O)[C@@H](N)c1nn[nH]n1 1952896669 SKBQPZTVEOLFHI-STHAYSLISA-N 154.133 -1.916 50 10 AAGE OB(O)c1cnccc1OC1COC1 1956968091 IWVSAWBQFVSKPT-UHFFFAOYSA-N 194.983 -1.461 50 10 AAGE NNC(=O)CN1[C@H]2CC[C@@H](O)[C@H]1CC2 2209963041 XDWIBFMQZQHELQ-BWZBUEFSSA-N 199.254 -1.036 50 10 AAGE C[C@H]1C[C@H]1NC(=O)C#CB(O)O 2241468065 GUEXUTHXGZVMOT-NTSWFWBYSA-N 166.973 -1.474 50 10 AAGE O=C(C#CB(O)O)NCC1OCCO1 2241468321 LNAAQDDQIMWYMU-UHFFFAOYSA-N 198.971 -2.509 50 10 AAGE N#CCNC(=O)c1cc(B(O)O)c[nH]1 2241479311 VWUVILVSJRIVET-UHFFFAOYSA-N 192.971 -2.052 50 10 AAGE C=C(CS(N)(=O)=O)B(O)O 2241479765 ALNZJBZOHVSRHL-UHFFFAOYSA-N 164.979 -2.157 50 10 AAGE O=C(O)c1sncc1B(O)O 2241492914 HGQFKAHCXFVLDV-UHFFFAOYSA-N 172.958 -1.479 50 10 AAGE Cc1cnc(=O)n(CC(=O)NN)c1 82471732 BEYFIXOZPXOXHL-UHFFFAOYSA-N 182.183 -1.458 50 10 AAGE C[C@H](N)[C@@H](C)C(=O)NN 165471592 POKZIRUVBNMKSK-DMTCNVIQSA-N 131.179 -1.040 50 10 AAGE NNC(=O)c1ccc(C(N)=O)cn1 238560156 FMLCVALWWQJQOJ-UHFFFAOYSA-N 180.167 -1.216 50 10 AAGE O=Cc1ccnc(C=O)c1B(O)O 238612326 LZOCFVKADRHUSH-UHFFFAOYSA-N 178.940 -1.614 50 10 AAGE NNC(=O)NNC1=NC(=O)SC1 307116031 XEPNOLVEGIDVOI-UHFFFAOYSA-N 189.200 -1.071 50 10 AAGE COCC[C@]1(C(=O)NN)CCNC1 379649570 CWAMTBVGHVIDDH-MRVPVSSYSA-N 187.243 -1.008 50 10 AAGE NNC(=O)[C@@H](N)Cc1cc[n+]([O-])cc1 687728483 GSYSQXDURZNISZ-ZETCQYMHSA-N 196.210 -1.820 50 10 AAGE CN(N)C(=O)CCSCC(N)=O 704672097 BQEFMOWTELXTNE-UHFFFAOYSA-N 191.256 -1.073 50 10 AAGE C[C@@H](CC(=O)NN)N1C#[N+]C(=C=N)N1 885670804 AXVCWFABGNVIRS-YFKPBYRVSA-O 195.206 -1.045 50 10 AAGE NC(=O)NNC(=O)[C-]1C#CC(=O)NN1 885840937 ZWVHWHYXFOTEQB-UHFFFAOYSA-N 196.146 -3.144 50 10 AAGE NC[C@@H](CO)C(=O)NN 1879973341 ITLBGFCVTFOQPS-VKHMYHEASA-N 133.151 -2.457 50 10 AAGE Cc1nc(B(O)O)oc1C 1880030531 MOSABNFYHYEGIS-UHFFFAOYSA-N 140.935 -1.029 50 10 AAGE CC(C)(O)[C@@](C)(N)C(=O)NN 1880202661 QPNCTDCTUJOAHJ-LURJTMIESA-N 161.205 -1.535 50 10 AAGE O=C(NCC#CB(O)O)C1[C@H]2CC[C@H]12 1895048674 CFQIPNNGDVHHTC-BQBZGAKWSA-N 193.011 -1.226 50 10 AAGE O=C(NCC#CB(O)O)N1CCCC1 1895076609 XVIUZAFKVIKUQK-UHFFFAOYSA-N 196.015 -1.193 50 10 AAGE NNC(=O)CN1Cc2cncnc2C1 1905637993 OANJSIUQLAEBDB-UHFFFAOYSA-N 193.210 -1.218 50 10 AAGE O=CNNC(=O)[C@H]1C[C@H]1[N+](=O)[O-] 1923790671 ZAYGEBJMKAWZTF-IUYQGCFVSA-N 173.128 -1.571 50 10 AAGE CN(C)NC(=O)CC1(O)CNC1 1953381117 IVLLJBBVZKRCDR-UHFFFAOYSA-N 173.216 -1.696 50 10 AAGE O=CN1CC[C@@H](B(O)O)C1 2208925494 GNMRFINTHJXEPO-RXMQYKEDSA-N 142.951 -1.309 50 10 AAGE C[C@H]1C[C@@H]1Nc1ncc(B(O)O)cn1 2210068627 WQBWBSFPGZGSOO-FSPLSTOPSA-N 193.015 -1.023 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@H](C1)[C@@H]2O 2241815771 SFINWZBQMIHZDQ-QMSLJYSESA-N 199.254 -1.321 50 10 AAGE CC(C)NNC(=O)[C@@H](N)CO 1678585 NIPOJNNSFDRMQO-YFKPBYRVSA-N 161.205 -1.665 50 10 AAGE O=CC1=CNC(O)(O)C1=O 39061253 JRUGFXYUROZUQE-UHFFFAOYSA-N 143.098 -2.120 50 10 AAGE NC(=O)OCc1ccc(B(O)O)cc1 196788005 XSXGGUVGOHDUPF-UHFFFAOYSA-N 194.983 -1.038 50 10 AAGE O=Cc1ccc(O)cc1B(O)O 211491631 JQHGZDHVLBYBBQ-UHFFFAOYSA-N 165.941 -1.116 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@@H](CN)C1 216306412 WXMMMANJYIFDPL-BQBZGAKWSA-N 186.259 -1.355 50 10 AAGE NNC(=O)CCN1C[C@H](O)[C@@H](O)C1 236234347 BWPVRXSXUFSTLS-WDSKDSINSA-N 189.215 -2.596 50 10 AAGE NC[C@H](O)CSS(=O)(=O)O 238806055 PIVWUOGPDNCRQS-VKHMYHEASA-N 187.242 -1.158 50 10 AAGE Cn1nnc([C@@H](Cl)C(N)=O)n1 575471918 WEIWGTTZRXTRRZ-REOHCLBHSA-N 175.579 -1.025 50 10 AAGE O=C(O)C(=O)N([N+](=O)[O-])[N+](=O)[O-] 687727748 SWYIWZPMOHLOER-UHFFFAOYSA-N 179.044 -1.717 50 10 AAGE NNC(=O)C(=O)NC[C@H]1CC12CC2 697513661 ADCFMWYJFMEGTF-RXMQYKEDSA-N 183.211 -1.107 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@@H]2C1=O 715706374 ZNXJSZZWMLZAOX-WDSKDSINSA-N 183.211 -1.155 50 10 AAGE CC#CC(=O)NNC(=O)c1ncon1 1636447177 CQPUSQLRHQCIHC-UHFFFAOYSA-N 194.150 -1.146 50 10 AAGE N#C[C@@H](O)[C@H]1CNCCO1 1880121162 OSPAPYZOHAITAV-PHDIDXHHSA-N 142.158 -1.141 50 10 AAGE NNC(=O)CN1C[C@@H](CO)[C@@H](F)C1 1881832941 LUSXHMQEIVAGMS-WDSKDSINSA-N 191.206 -1.762 50 10 AAGE CC1(C)CNC(=O)CN1C(=O)NN 1881903096 XPWZVORVKMTILE-UHFFFAOYSA-N 186.215 -1.220 50 10 AAGE NNC(=O)CCN1[C@H]2COC[C@H]1C2 1883761088 NWIHSQRJCUNBSX-RNFRBKRXSA-N 185.227 -1.161 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@H](O)C[C@H]2C1 1886544658 WMRYMCAZJBXYAT-JIGDXULJSA-N 199.254 -1.321 50 10 AAGE O=C1CC[C@@H](C(=O)NNCCO)N1 1929831535 DEOYPPCNQGGQQZ-YFKPBYRVSA-N 187.199 -2.122 50 10 AAGE NNC(=O)CN1C[C@@H](F)C[C@@H](O)C1 2209178636 DTVGVTZCUBEBEQ-NTSWFWBYSA-N 191.206 -1.619 50 10 AAGE NCCOc1ncc(B(O)O)cn1 2209387194 HZXQDPDHVXAXPS-UHFFFAOYSA-N 182.976 -2.506 50 10 AAGE C[C@@H](CF)Nc1ncc(B(O)O)cn1 2210061766 YAPKPAYUCSRBES-YFKPBYRVSA-N 198.994 -1.074 50 10 AAGE CCN(C)C(=O)c1cc(B(O)O)n[nH]1 2241474305 AIQZAYQUSXTHOW-UHFFFAOYSA-N 197.003 -1.819 50 10 AAGE C[C@H]1CNCCN1C(=O)C#CB(O)O 2241479335 WEYHJLHLWLRREZ-ZETCQYMHSA-N 196.015 -2.178 50 10 AAGE CCN(CCCO)C(=O)C(=O)NN 124593589 WTOVOUKBYUWDMJ-UHFFFAOYSA-N 189.215 -1.793 50 10 AAGE O=Cc1cncc(O)c1B(O)O 238614350 NJQMYFFHWQPKLT-UHFFFAOYSA-N 166.929 -1.721 50 10 AAGE OCc1ccc(B(O)O)c2nc[nH]c12 306565248 QZYDOMSRUWAMHG-UHFFFAOYSA-N 191.983 -1.265 50 10 AAGE C[C@H](O)[C@@H](O)/C=C\C=NNC(N)=O 308083561 SWKXUMHVDGLSRT-KDAAUJGBSA-N 187.199 -1.062 50 10 AAGE CN(C)NC(=O)[C@@H](O)CN 1880007975 VPOUPMORTWDKDF-BYPYZUCNSA-N 147.178 -2.101 50 10 AAGE NNC(=O)N1CC=C[C@H]1CO 1880145698 JQXPXRXDTBVZOA-YFKPBYRVSA-N 157.173 -1.198 50 10 AAGE NNC(=O)[C@H]1CCC2(CNC2)O1 1881582929 RDQDPXCCMMCXLS-RXMQYKEDSA-N 171.200 -1.503 50 10 AAGE C[C@]1(B(O)O)CCN(CC(N)=O)C1 1891492233 MZFAWZUNRPDOJK-ZETCQYMHSA-N 186.020 -1.590 50 10 AAGE C[C@@H](CC(=O)NN)N1CC(CO)C1 1929742904 JSNZSXHTCMJGDE-LURJTMIESA-N 187.243 -1.321 50 10 AAGE CCS(=O)(=O)C[C@@](C)(N)B(O)O 1953677558 GDWVFBHEORPLHT-RXMQYKEDSA-N 195.049 -1.850 50 10 AAGE CC(C)OCCNC(=O)C#CB(O)O 2241472789 XTRRHEANXUTASM-UHFFFAOYSA-N 199.015 -1.457 50 10 AAGE CCNC(=O)c1ncncc1B(O)O 2241475012 OXNKTRZNYMWMOB-UHFFFAOYSA-N 194.987 -2.094 50 10 AAGE NCC1CN(C(=O)[C@H]2C[C@H]2B(O)O)C1 2241496799 WRAPNFRTMYRYDH-NKWVEPMBSA-N 198.031 -1.734 50 10 AAGE O=CNCCc1ccccc1B(O)O 2241554995 JBDTUKVWXSDRDQ-UHFFFAOYSA-N 193.011 -1.345 50 10 AAGE N#CNCc1ccccc1B(O)O 2241559729 PGVHCJXQMKNMCE-UHFFFAOYSA-N 175.984 -1.063 50 10 AAGE O=C(NCCO)c1cocc1B(O)O 2241751981 KJVNSZXLEQPITF-UHFFFAOYSA-N 198.971 -2.319 50 10 AAGE CNC(=O)[C@H](C)NC(=O)NN 42576265 BRCUGZKNYRMBAO-VKHMYHEASA-N 160.177 -1.706 50 10 AAGE CN(C)NC(=O)[C@@H]1CNCCO1 147281562 QSRCKSXYXHDLQD-LURJTMIESA-N 173.216 -1.432 50 10 AAGE O=Cc1cc(B(O)O)cc(C=O)n1 206086649 IAPKNJILUPRPJE-UHFFFAOYSA-N 178.940 -1.614 50 10 AAGE Nc1nc(C(=O)O)ccc1B(O)O 238641352 BVWHDLRRPMWJEQ-UHFFFAOYSA-N 181.944 -1.958 50 10 AAGE NNC(=O)N1CCC[C@](O)(CO)C1 306181532 UWDKCRXHANPXPI-SSDOTTSWSA-N 189.215 -1.611 50 10 AAGE Cn1cnc(C(=O)NNC=O)c1 307744294 OHPCUMCABAVFOB-UHFFFAOYSA-N 168.156 -1.189 50 10 AAGE NNC(=O)N[C@@H]1CCN(C2CC2)C1=O 606272925 IGWGRLPZKKFYCJ-ZCFIWIBFSA-N 198.226 -1.077 50 10 AAGE COCCC(=O)NCC=CB(O)O 1883502695 VAOTZQIJLDXIBG-UHFFFAOYSA-N 187.004 -1.293 50 10 AAGE C[C@@H]1[C@H](O)CN1C[C@@H]1C[C@@H]1C(=O)NN 1885887367 FQXWYVMJXOIPBH-VGRMVHKJSA-N 199.254 -1.323 50 10 AAGE O=C(N[C@@H]1CCNC1)C1(B(O)O)CC1 2241481316 RAOBHUWAKQWEQA-ZCFIWIBFSA-N 198.031 -1.529 50 10 AAGE CNC(=O)c1c(B(O)O)nnn1C 2241481783 VMRIBJXGUYKWRT-UHFFFAOYSA-N 183.964 -3.146 50 10 AAGE O=C(NCCC#CB(O)O)C1CC1 2241906515 BKNNXCNBOYIMES-UHFFFAOYSA-N 181.000 -1.082 50 10 AAGE O=C(O)[C@@H](OO)[C@@H](OO)C(=O)O 100879198 CVKNOSPZPWFPFV-XIXRPRMCSA-N 182.084 -1.128 50 10 AAGE CN(C)NC(=O)C(=O)NCCN 133905361 PVIABNNSQWJCNZ-UHFFFAOYSA-N 174.204 -2.346 50 10 AAGE CC(C)NNC(=O)[C@H](N)[C@@H](C)O 238197277 SIDGJGKJWHMEIW-PHDIDXHHSA-N 175.232 -1.276 50 10 AAGE Cc1cn(C[C@H](O)C#N)c(=O)[nH]c1=O 238492824 QPUQMUBZOYUIHA-ZCFIWIBFSA-N 195.178 -1.271 50 10 AAGE N[C@H]1[C@H](Cl)[C@H](N)[C@@H](O)[C@H](O)[C@H]1O 306983191 SMAXJMCZRABISI-LKPKBOIGSA-N 196.634 -2.655 50 10 AAGE O=C(F)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO 379364923 IJPVCOQVFLNLAP-TXICZTDVSA-N 198.146 -3.082 50 10 AAGE COCC1(O)CN(CC(=O)NN)C1 384165438 SLDMLVKDVHQCDI-UHFFFAOYSA-N 189.215 -2.331 50 10 AAGE COC(=O)c1nc(B(O)O)ccc1C 521400883 GPFFAYRJCCCUFX-UHFFFAOYSA-N 194.983 -1.144 50 10 AAGE O[C@H]1[C@H](O)[C@@H](O)[C@@H](O)O[C@H]1CCl 605693499 QMWDIHPSUCUMFU-ZSNZIGRDSA-N 198.602 -1.975 50 10 AAGE in-vitro NC[C@H]1[C@H](C(=O)NN)C1(F)F 715076797 BPIFNSQLKITELD-STHAYSLISA-N 165.143 -1.184 50 10 AAGE O=C(NCB(O)O)C12CC(CO1)C2 1883223511 RJIZGSUWLLCOQD-UHFFFAOYSA-N 184.988 -1.706 50 10 AAGE OB(O)c1ccc(C2(O)COC2)cc1 1886268323 SYDDNLSSFDWMKP-UHFFFAOYSA-N 193.995 -1.416 50 10 AAGE NNC(=O)CN1C[C@H]2[C@@H](C1)[C@@H]2C(N)=O 1900594202 YYNDJMUDHXLXSX-KCQQBQQISA-N 198.226 -2.361 50 10 AAGE NNC(=O)CCN1C[C@H]2C(CO)[C@@H]2C1 1929055355 SZBUEYRJJZPIAC-RNFRBKRXSA-N 199.254 -1.464 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CCOC1 2241468618 RFPASOMSIVDLJX-ZCFIWIBFSA-N 182.972 -2.093 50 10 AAGE Cc1nsc(B(O)O)c1C(N)=O 2241478797 LMEUPPHUJYVKQT-UHFFFAOYSA-N 186.001 -1.770 50 10 AAGE NNC(=O)CN1CC(O)(CCO)C1 2241812327 ZVCGVNRBBXMBHL-UHFFFAOYSA-N 189.215 -2.595 50 10 AAGE NNC(=O)NCC(N)=O 36948176 GZDYIIYDXXGUAG-UHFFFAOYSA-N 132.123 -2.355 50 10 AAGE Cc1cc(B(O)O)c2nnnn2c1 170000950 CHMWVEMZUIIZRX-UHFFFAOYSA-N 177.960 -1.887 50 10 AAGE O=C1O[C@H]([C@H](O)CCl)C(=O)C1=O 210177219 MWGHCIMLVHHKJH-DUZGATOHSA-N 192.554 -1.350 50 10 AAGE OB(O)c1cnccc1C1OCCO1 238637699 OMCGCNBCCXKJMP-UHFFFAOYSA-N 194.983 -1.193 50 10 AAGE OC[C@H]1O[C@@H](CCl)[C@@H](O)[C@@H]1O 238658969 AFEGDRDJPMKARR-SLPGGIOYSA-N 182.603 -1.293 50 10 AAGE NNC(=O)[C@@H]1[C@H]2CN3CC[C@@H](O2)[C@@H]13 306588999 TZTAPDGMEFSGAS-GBNDHIKLSA-N 183.211 -1.552 50 10 AAGE OB(O)c1cccc2c1[C@H](O)O[C@@H]2O 306675119 RWLPMOWUUIBSRG-JGVFFNPUSA-N 195.967 -1.622 50 10 AAGE OB(O)c1cnn(C[C@@H]2CCCO2)c1 306913262 SVQCIMOGEHSIFS-QMMMGPOBSA-N 196.015 -1.258 50 10 AAGE NNC(=O)CCN1CCS1(=O)=O 306994322 NFFZCHOOHPULSL-UHFFFAOYSA-N 193.228 -1.988 50 10 AAGE COC[C@@H](C(=O)NN)N1C[C@H]2C[C@H]2C1 380334559 DZNVCGHAVUHMJR-RNJXMRFFSA-N 199.254 -1.057 50 10 AAGE C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C#N 388117878 HABJMIHBEMYZOB-MLKOFDEISA-N 191.183 -2.666 50 10 AAGE COCCn1nccc1B(O)O 388390258 BEKXTGKKQAOTFH-UHFFFAOYSA-N 169.977 -1.791 50 10 AAGE COCCONC(=O)NNC(C)=O 388580801 FBRZFPCVUAELAI-UHFFFAOYSA-N 191.187 -1.085 50 10 AAGE COC[C@@H](C)n1cc(B(O)O)cn1 694514555 LCZGFJRMUISWFY-ZCFIWIBFSA-N 184.004 -1.230 50 10 AAGE O=C(NCC=CB(O)O)C1(O)CC1 1888980698 MGNVVSLWGDGBBU-UHFFFAOYSA-N 184.988 -1.804 50 10 AAGE C[C@H]1C(NC(=O)C(=O)NN)[C@@H]1C 1953548244 RKTYMRDVQITIQE-QWWZWVQMSA-N 171.200 -1.253 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2C[C@H]1[C@H]1C[C@@H]21 1955370183 VJOPVIUPOLJXBY-BWBBJGPYSA-N 195.222 -1.157 50 10 AAGE OCCN=c1ccc(B(O)O)c[nH]1 2209386904 HFRIKFHNYYQMKN-UHFFFAOYSA-N 181.988 -2.413 50 10 AAGE N[C@@H]1C[C@H]1NC(=O)[C@H]1C[C@@H](B(O)O)C1 2241475426 XKVAKBBMOAWJSY-XZBKPIIZSA-N 198.031 -1.545 50 10 AAGE CN1CC(N(C)C(=O)C#CB(O)O)C1 2241479475 YTSONLMGFPPTMQ-UHFFFAOYSA-N 196.015 -2.226 50 10 AAGE O=C1NCCN1C(=O)C1(B(O)O)CC1 2241481326 RCMHCWBJISXKMK-UHFFFAOYSA-N 197.987 -1.455 50 10 AAGE O=C=NCNC(=O)N1CC(O)C1 170294064 DPUSRUDWUUCQAJ-UHFFFAOYSA-N 171.156 -1.334 50 10 AAGE NCc1ccncc1B(O)O 238690963 RLMYSMBYDXUKTE-UHFFFAOYSA-N 151.962 -1.780 50 10 AAGE CN1CC[C@@H]([C@H](N)C(=O)NN)C1 259082659 ZVVPMHIPTBOXAD-RITPCOANSA-N 172.232 -1.745 50 10 AAGE CC(=O)NNC(=O)C(=O)NC1CC1 306215611 OSWKSLIJFZRPQV-UHFFFAOYSA-N 185.183 -1.568 50 10 AAGE CC[C@H](C(=O)NN)N1C[C@@H](O)[C@H]1C 1882448777 ZNQUPCJHIDLGTO-FSDSQADBSA-N 187.243 -1.180 50 10 AAGE NNC(=O)[C@@]12C[C@@H](N)[C@@H]1C2 1953189872 UFECFSPTYHDILU-RPDRRWSUSA-N 141.174 -1.286 50 10 AAGE C[C@@H]1C[C@@H]1Oc1ncncc1B(O)O 1956971317 WNFRTKNPDDOFKC-VDTYLAMSSA-N 193.999 -1.056 50 10 AAGE C[C@@H]1COCCN1C(=O)C#CB(O)O 2241468892 WMWZTDGKGUUWTJ-SSDOTTSWSA-N 196.999 -1.751 50 10 AAGE O=C(C#CB(O)O)NC1[C@H]2CC[C@H]12 2241478237 AWJRJWFTRDWEDV-WDSKDSINSA-N 178.984 -1.474 50 10 AAGE CCC[C@H](O)CNC(=O)C#CB(O)O 2241479267 VDXXHSJPZUVEMQ-ZETCQYMHSA-N 199.015 -1.721 50 10 AAGE CNCCN(C)CC(=O)NN 70987708 CNZLUCPNVRANMR-UHFFFAOYSA-N 160.221 -1.873 50 10 AAGE Cc1cn(CC(=O)NN)c(=O)[nH]c1=O 83825749 NBVHCQNPCVDWLJ-UHFFFAOYSA-N 198.182 -2.165 50 10 AAGE CNC(=NNC(C)=O)NC 104625737 LSURWGCCALZYIO-UHFFFAOYSA-N 144.178 -1.168 50 10 AAGE CNNC(=O)CO 146260774 LQDDREQIYMGKEU-UHFFFAOYSA-N 104.109 -1.771 50 10 AAGE NNC(=O)[C@H]1OCO[C@H]1C(=O)NN 210740135 QVFQZVMCMZRMGZ-WSOKHJQSSA-N 190.159 -3.292 50 10 AAGE C[C@@H](N)C(=O)NN(CCO)CCO 238406136 AFKQKUNLLYIMFD-ZCFIWIBFSA-N 191.231 -2.349 50 10 AAGE C[C@H]1CN(CC(=O)NN)CC[C@H]1O 253171496 ALXXMWQCIOXTEF-NKWVEPMBSA-N 187.243 -1.321 50 10 AAGE CC(C)(CC(=O)NN)CC(=O)NN 379384473 OJDTZEPPSNOZLR-UHFFFAOYSA-N 188.231 -1.227 50 10 AAGE COC(=O)NN=C[C@H](O)CO 1084051760 NQBVMLLROROKJK-BYPYZUCNSA-N 162.145 -1.319 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]2[C@@H]1C[C@H]2O 1885072212 GFLQIMCGJZKFLH-HCWXCVPCSA-N 199.210 -2.042 50 10 AAGE NNC(=O)[C@@H]1CO[C@H]2CNC[C@@H]12 1953514055 BCRWHJVVXAOCHY-JKUQZMGJSA-N 171.200 -1.789 50 10 AAGE NNC(=O)C(=O)N1CCC[C@H]1CF 1954050537 CJQIUFDBZYSHIU-YFKPBYRVSA-N 189.190 -1.063 50 10 AAGE N[C@H]1C[C@@H]1Nc1ncccc1B(O)O 2210067788 FRZCZQCMUOXUSU-BQBZGAKWSA-N 193.015 -1.727 50 10 AAGE NC1CN(c2ncc(B(O)O)cn2)C1 2210068740 YNKXSGWSPMBUEM-UHFFFAOYSA-N 194.003 -2.696 50 10 AAGE C=C(CS(=O)(=O)NO)B(O)O 2241584984 WPYDJIKRYCUQRY-UHFFFAOYSA-N 180.978 -2.137 50 10 AAGE CC(C)(NC(=O)NN)C(N)=O 17537083 PXFGDCNKXOTTLL-UHFFFAOYSA-N 160.177 -1.577 50 10 AAGE CNC(=O)[C@H](O)C#N 104693687 FIYUTZRHNUKXGE-GSVOUGTGSA-N 114.104 -1.383 50 10 AAGE C[C@H](CC(=O)NN)N1CC[C@@H](O)C1 216476912 QZEWQUBOVMXGKP-RNFRBKRXSA-N 187.243 -1.179 50 10 AAGE Nc1cnc(C=O)c(B(O)O)c1 238583737 GERXDIXVVAIRKV-UHFFFAOYSA-N 165.945 -1.844 50 10 AAGE NNC(=O)[C@H](N)Cc1ccc[nH]1 259041412 SZPJTGPOCXIFMB-ZCFIWIBFSA-N 168.200 -1.126 50 10 AAGE NNC(=O)[C@@H](F)C1CNC1 307679669 MVQWXXCTTBMOBH-BYPYZUCNSA-N 147.153 -1.466 50 10 AAGE CN1C#CN[C-]1/C=N/NC(=O)CO 642851882 AMHYQKZPWXDBTP-RUDMXATFSA-N 181.175 -1.976 50 10 AAGE NC(=O)N/C=C(\C=O)[N+](=O)[O-] 687728216 IAKRYLWELASMKP-HNQUOIGGSA-N 159.101 -1.028 50 10 AAGE CCOCn1ccc(B(O)O)n1 694267079 BVZMYOUXSBZBFL-UHFFFAOYSA-N 169.977 -1.443 50 10 AAGE Cc1c(C(=O)NCB(O)O)cnn1C 701957831 HHAONRKWADWDFM-UHFFFAOYSA-N 197.003 -1.530 50 10 AAGE O=C(NCB(O)O)[C@@H]1CCOC1 706543845 YLDHXZMRTXIJPM-RXMQYKEDSA-N 172.977 -1.849 50 10 AAGE CN(C)NC(=O)[C@@H]1OCC[C@@H]1CN 715292557 CIDFXKDXCDOLIH-RNFRBKRXSA-N 187.243 -1.057 50 10 AAGE N#CC1=C(O[C@H]2CNOC2)NC#CN1 885589649 USJYFNOIZDYYCJ-LURJTMIESA-N 192.178 -1.290 50 10 AAGE N[C@@H](B(O)O)[C@H]1COCCO1 1880462440 HLFIYZZPQANTRZ-RFZPGFLSSA-N 160.966 -2.259 50 10 AAGE C[C@]12C[C@](NC(=O)C(=O)NN)(CO1)C2 1902120314 NIOCDIUVOOOIBS-ZKCHVHJHSA-N 199.210 -1.586 50 10 AAGE C[C@@H](C(=O)NN)N1CC(CO)C1 1929744230 YXMZNRYPLIRSKI-YFKPBYRVSA-N 173.216 -1.711 50 10 AAGE O=C(NCB(O)O)[C@@H]1C[C@@H]2C[C@H]2CO1 1931603806 JUQVXUDTUGXFDX-ACZMJKKPSA-N 199.015 -1.460 50 10 AAGE N#C[C@@H](O)[C@@H](N)CCn1cnnn1 1952976871 UMTAQDXQFLPCBO-NTSWFWBYSA-N 182.187 -1.725 50 10 AAGE N[C@@H]1C[C@H]1Nc1ccc(B(O)O)cn1 2210060424 KEOBVLMWCOTXIS-RNFRBKRXSA-N 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196.015 -2.130 50 10 AAGE O=C(N1CC(O)C1)C1(B(O)O)CCC1 2241471299 IKMJYUYFYIPFIE-UHFFFAOYSA-N 199.015 -1.413 50 10 AAGE O=C(C#CB(O)O)N1CC(CCF)C1 2241478327 CDJXVFFKVPUCFX-UHFFFAOYSA-N 198.990 -1.180 50 10 AAGE C#CCN(C)C(=O)[C@H]1C[C@@H]1B(O)O 2241481090 REIFIWWCQBATIR-BQBZGAKWSA-N 181.000 -1.059 50 10 AAGE NNC(=O)c1ccc(B(O)O)cc1O 2241482159 BDQJPMMDLOXYAR-UHFFFAOYSA-N 195.971 -2.325 50 10 AAGE O=C(CO)[C@H](O)[C@H](O)CCl 104688465 BRPVATGUACRJDP-NQXXGFSBSA-N 168.576 -1.492 50 10 AAGE Nc1c(B(O)O)ccnc1C(=O)O 206091337 FBWYIBCFZKFYPT-UHFFFAOYSA-N 181.944 -1.958 50 10 AAGE CN(CB(O)O)C(=O)[C@@H]1CCCN1 207112187 XFUYMDPMNRVKLQ-LURJTMIESA-N 186.020 -1.791 50 10 AAGE C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)C(=O)F 308010732 PDNVQOUXEOAXBR-QMKXCQHVSA-N 182.147 -2.054 50 10 AAGE CNNC(=O)CNS(C)(=O)=O 704681176 HVUUSZFGGKWGJA-UHFFFAOYSA-N 181.217 -2.214 50 10 AAGE C#CC(=O)NNc1cnnn1C 1183572735 XSKRDJZDLCTZHF-UHFFFAOYSA-N 165.156 -1.109 50 10 AAGE NNC(=O)[C@H]1C[C@@H]1CN1CCC1=O 1928994033 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NNC(=O)CN1C(=O)[C@@H]2C[C@@H]2[C@H]2C[C@@H]21 1957166014 XZTDPOWMQNNVOY-GBNDHIKLSA-N 195.222 -1.157 50 10 AAGE CN(C(=O)C#CB(O)O)C1(C)COC1 2241478274 BHHAERYZNLJBJO-UHFFFAOYSA-N 196.999 -1.751 50 10 AAGE C#CC1(CNC(=O)C#CB(O)O)CC1 2241479032 QCBWDYCAHQHGOW-UHFFFAOYSA-N 190.995 -1.469 50 10 AAGE C=C[C@@H](CO)NC(=O)C1(B(O)O)CC1 2241479839 BGASOTQGQDNSFF-LURJTMIESA-N 199.015 -1.344 50 10 AAGE CCn1cc(C(=O)OC)nc1B(O)O 2241492589 CSAWYPJDTAPFQN-UHFFFAOYSA-N 197.987 -1.631 50 10 AAGE C[C@@H](O)CN(C)CC(=O)NN 82471102 WGLZKSOGYNJINL-RXMQYKEDSA-N 161.205 -1.711 50 10 AAGE Cn1ccn(CC(=O)NN)c(=O)c1=O 82471720 RDPUCUJBCYABPL-UHFFFAOYSA-N 198.182 -2.463 50 10 AAGE O=C(O)c1cc(B(O)O)[nH]n1 195769978 GUYCLYJWXICSGN-UHFFFAOYSA-N 155.906 -2.212 50 10 AAGE NNC(=O)CN1C[C@@H](O)[C@H](CO)C1 306172598 BGBYKGMZWKSGJC-NTSWFWBYSA-N 189.215 -2.739 50 10 AAGE OB(O)Cn1cccn1 306604137 YIVGYMSUFHDZBW-UHFFFAOYSA-N 125.924 -1.105 50 10 AAGE C[C@@H](CN1CC(C)(O)C1)C(=O)NN 306717544 GRQHYUAEDVXAPN-LURJTMIESA-N 187.243 -1.321 50 10 AAGE OB(O)c1cnn([C@@H]2CCNC2)c1 306873378 XJLVDIOHKNCPKR-SSDOTTSWSA-N 181.004 -1.903 50 10 AAGE CC=NNC(=O)C(=O)NC(N)=O 307884464 QNIJQETXYMEFON-UHFFFAOYSA-N 172.144 -1.697 50 10 AAGE Cc1c(B(O)O)cnc2[nH]nnc12 716784416 QNTKLHAVMCJSDA-UHFFFAOYSA-N 177.960 -1.659 50 10 AAGE O=C(CO)NN/C=C1/N=C=[C]N1 885195611 ONWXEUYFCUOYHL-UHFFFAOYSA-N 167.148 -2.012 50 10 AAGE C[S@](=O)N[C@H]1CCC=C1B(O)O 1881335129 GHNFAPZXMHMKLZ-QTTZVWFDSA-N 189.045 -1.030 50 10 AAGE O=C(NCC#CB(O)O)NC1CC1 1883739379 SSBHRQOGVKBAJD-UHFFFAOYSA-N 181.988 -1.537 50 10 AAGE O=CNNC(=O)[C@H]1C[C@@H]1[N+](=O)[O-] 1923790670 ZAYGEBJMKAWZTF-IMJSIDKUSA-N 173.128 -1.571 50 10 AAGE NNC(=O)C(=O)NC1(C(N)=O)CC1 1954429120 AKCWZQRHIVDFHR-UHFFFAOYSA-N 186.171 -2.890 50 10 AAGE CON(CC(=O)NN)[C@H]1CCOC1 1954816217 YUNWENCLOBADBD-LURJTMIESA-N 189.215 -1.371 50 10 AAGE NC[C@H]1C[C@@H]1CNC(=O)C#CB(O)O 2241468002 FTAQVAYLSVLRDN-RNFRBKRXSA-N 196.015 -2.287 50 10 AAGE O=C(C#CB(O)O)N1CCOC1 2241472482 SHAPOMNRKVMVIC-UHFFFAOYSA-N 168.945 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131.179 -1.026 50 10 AAGE NNC(=O)CCN1C(=O)CCCC1=O 59713682 ZKMONPZTLUWXRK-UHFFFAOYSA-N 199.210 -1.095 50 10 AAGE O=C1C=CC(=O)C(B(O)O)=C1 203932343 GGIFIFAUDRVWNX-UHFFFAOYSA-N 151.914 -1.367 50 10 AAGE CC(=O)NNC(=O)[C@@H]1CNC(=O)N1 306324684 KWPUKCIYAJVUBV-BYPYZUCNSA-N 186.171 -2.165 50 10 AAGE NC(=O)/C=N/NC(=O)C(N)=O 306376497 NFPOQBZHLURBHU-LREOWRDNSA-N 158.117 -2.941 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1CO 307067592 SPGRNZAIMIKBQM-QWWZWVQMSA-N 130.147 -1.395 50 10 AAGE CCN1C[C@H](NC(=O)NN)CC1=O 307587104 RUPKJXNJBVNSCI-RXMQYKEDSA-N 186.215 -1.220 50 10 AAGE O=CC1=C=[N+](C2COC2)NN1 885243812 OJVILTRTLOYMLN-UHFFFAOYSA-N 154.149 -1.827 50 10 AAGE C[C@@H]1[C@@H](O)CN1CC(=O)NN 1880270998 DUIIWAVQIPWFEZ-UHNVWZDZSA-N 159.189 -1.959 50 10 AAGE CNNC(=O)N[C@H](C)S(C)(=O)=O 1881558870 YIQXCDXJEBMPFB-BYPYZUCNSA-N 195.244 -1.189 50 10 AAGE O=C(C#CB(O)O)NC[C@H]1CCOC1 2241468352 MGUOYNJGVQXNCB-SSDOTTSWSA-N 196.999 -1.846 50 10 AAGE CCONC(=O)C(=O)NN 59032478 MSAVEWQEIOUMKZ-UHFFFAOYSA-N 147.134 -1.956 50 10 AAGE NNC(=O)C(=O)N1CCCOCC1 61938159 JYLYLGXNRBIULB-UHFFFAOYSA-N 187.199 -1.775 50 10 AAGE NNC(=O)c1nccnc1NN 104540210 FLSPIPSBDQWROJ-UHFFFAOYSA-N 168.160 -1.634 50 10 AAGE CC(C)n1ncc(N)c1B(O)O 204470625 WLFWXBZNLJPAAL-UHFFFAOYSA-N 168.993 -1.274 50 10 AAGE OB(O)c1cnc2n1CCCN2 238655367 UMNPWWBQNWPQQC-UHFFFAOYSA-N 166.977 -1.622 50 10 AAGE NCc1ccnc(F)c1B(O)O 238690312 WQHHRZNUDAFJEK-UHFFFAOYSA-N 169.952 -1.641 50 10 AAGE O=C[C@H](Cl)[C@H](O)[C@@H](O)[C@@H](O)CO 238712774 RBEGMPAFDRYYIG-BXKVDMCESA-N 198.602 -2.132 50 10 AAGE NNC(=O)N1C[C@@H](CO)[C@@H](O)C1 306596436 VIXUQKSYXJFUIP-WHFBIAKZSA-N 175.188 -2.145 50 10 AAGE O=C(NCB(O)O)[C@@]12COC[C@H]1C2 701932973 UACUFIPNMVVNJB-VDTYLAMSSA-N 184.988 -1.849 50 10 AAGE CC(C)C#CC(=O)NCB(O)O 1923620794 WZBLUSKQQGPVNO-UHFFFAOYSA-N 168.989 -1.226 50 10 AAGE CSCC(=O)NNC(=O)CCO 1923922381 JSGWBJBDOWMZLA-UHFFFAOYSA-N 192.240 -1.121 50 10 AAGE NC[C@@H](C(=O)NN)[C@H]1CCOC1 1930479473 FHIHOYYSMHXTIS-NTSWFWBYSA-N 173.216 -1.412 50 10 AAGE CO[C@@]1([C@@H](N)B(O)O)CCOC1 1931461881 UMKDIHCRJYULPI-RITPCOANSA-N 174.993 -1.869 50 10 AAGE CCCNC(=O)C#CB(O)O 2241468125 HVBAICGCYZKKQE-UHFFFAOYSA-N 154.962 -1.472 50 10 AAGE O=C(C#CB(O)O)N1CCC[C@H](O)C1 2241468319 LLBWNXJZAUBKNA-ZETCQYMHSA-N 196.999 -2.015 50 10 AAGE C[C@H](O)[C@H]1C[C@@H]1NC(=O)C#CB(O)O 2241468791 UZYJLORTNBAKEP-XVMARJQXSA-N 196.999 -2.113 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CONC1=O 2241472796 XVGWVCJDMDBWGH-SCSAIBSYSA-N 197.943 -3.452 50 10 AAGE COC(=O)c1cocc1B(O)O 2241751708 HISNRPUQWQIVCT-UHFFFAOYSA-N 169.929 -1.254 50 10 AAGE CNC(=O)N/N=C/NNC(=O)NC 238348351 HWNMSLAGBHYNMN-UHFFFAOYSA-N 188.191 -1.708 50 10 AAGE NNC(=O)[C@H]1CO[C@H](CCO)C1 238556659 JFWGSCGSYHKHOX-PHDIDXHHSA-N 174.200 -1.236 50 10 AAGE NNC(=O)CN1CC(=O)NC1=O 306642559 UBGFBFVSSWDVSU-UHFFFAOYSA-N 172.144 -2.472 50 10 AAGE CC1(C(=O)NNC(=O)CO)COC1 307507107 MJEOFGHZLRJUJJ-UHFFFAOYSA-N 188.183 -1.837 50 10 AAGE COC(=O)NNC(=O)NCCO 379328681 QSWHYDBZWDZUSU-UHFFFAOYSA-N 177.160 -1.451 50 10 AAGE ClCS[C@H]1NN[C@@H]2NCNN21 953055310 VRNJZESRJTYCFO-IMJSIDKUSA-N 195.679 -1.042 50 10 AAGE NNC(=O)C[C@H]1C[C@@H](N)CCO1 1881069150 LWYCKGPSRQTABH-NTSWFWBYSA-N 173.216 -1.127 50 10 AAGE CCS(=O)(=O)N(C)NC(N)=O 1888571454 IFVLPFNDTPKAQW-UHFFFAOYSA-N 181.217 -1.149 50 10 AAGE CN(CC(=O)NN)CC1(O)CCC1 1914571196 ASYWIRFFZRBNSO-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE NNC(=O)C(=O)NC1CC(F)C1 1929676262 CCQKFPUAJGWCGR-UHFFFAOYSA-N 175.163 -1.407 50 10 AAGE NNC(=O)[C@H]1CNC[C@@H](O)C1 1934304500 DXLWWILOJAONHF-UHNVWZDZSA-N 159.189 -2.053 50 10 AAGE O=C(C#CB(O)O)NC1[C@@H]2CCC[C@@H]12 2241468239 JVFGYNDJQPQEHP-RNFRBKRXSA-N 193.011 -1.084 50 10 AAGE CCC[C@@H](N)CNC(=O)C#CB(O)O 2241478197 AAIOEKASVDPKNM-SSDOTTSWSA-N 198.031 -1.755 50 10 AAGE O=C(C#CB(O)O)NC1[C@H]2CNC[C@H]12 2241479104 RJCYAIFTGXVESM-WDSKDSINSA-N 193.999 -2.664 50 10 AAGE O=C(NC1COC1)[C@H]1C[C@@H]1B(O)O 2241496573 VCIICPPWBXPBSF-WDSKDSINSA-N 184.988 -1.636 50 10 AAGE C[C@](O)(NNC(N)=O)C(N)=O 39136043 QGWVPTGECXGCMZ-SCSAIBSYSA-N 162.149 -2.647 50 10 AAGE CC(C)N(CCO)C(=O)C(=O)NN 42481955 MTAQZNKIEUCKLA-UHFFFAOYSA-N 189.215 -1.794 50 10 AAGE Cc1ncc(CC(=O)NN)c(=O)[nH]1 238468731 TZDOQGIVBWKEFT-UHFFFAOYSA-N 182.183 -1.389 50 10 AAGE NNC(=O)[C@H]1CCC(=O)NC1 238556444 MRXNKVWAFOKYRR-BYPYZUCNSA-N 157.173 -1.498 50 10 AAGE O=C1NCc2cncc(B(O)O)c21 238657710 COKDTZDDZGQIQN-UHFFFAOYSA-N 177.956 -1.995 50 10 AAGE O=C(CCl)NC[C@@H](O)C(=O)O 238707832 FQXIFBBJKPLFOM-GSVOUGTGSA-N 181.575 -1.213 50 10 AAGE NNc1ccc(C=O)c(B(O)O)c1 306835695 ROOWBYXIDUMGPI-UHFFFAOYSA-N 179.972 -1.536 50 10 AAGE C[C@@H]1CN(C(=O)NN)C[C@H]1O 307376361 BRASMYXNGVEWGW-RFZPGFLSSA-N 159.189 -1.118 50 10 AAGE C[C@H]1CN(C(=O)NN)CC(=O)N1 307503364 WDRRHQQCOHLKTL-BYPYZUCNSA-N 172.188 -1.610 50 10 AAGE NC(=O)NNC(=O)Cn1cncn1 705968946 YFAZALDVANQSFX-UHFFFAOYSA-N 184.159 -2.022 50 10 AAGE O=S1(=O)CC(CB(O)O)C1 722921049 SMQDLQQEKCPXCZ-UHFFFAOYSA-N 163.991 -1.496 50 10 AAGE NCCN1NNN=C1C1=C=S=C=N1 885806798 FQHNAXATBMNYNT-UHFFFAOYSA-N 196.239 -1.480 50 10 AAGE NNC(=O)CCN1CC[C@@H]2[C@@H](O)C[C@@H]21 1877530592 GSPOLSGBNSDSFF-FXQIFTODSA-N 199.254 -1.179 50 10 AAGE NNC(=O)[C@H]1C=C[C@H]1C(=O)O 1880145101 CWYQDBYKJLIQED-IUYQGCFVSA-N 156.141 -1.137 50 10 AAGE N#Cc1nc(B(O)O)ccc1F 1880851030 WIKIZYCLMXEDLY-UHFFFAOYSA-N 165.920 -1.228 50 10 AAGE CN(C)NC(=O)[C@@H]1C[C@@H](O)CCN1 1881957343 UAVMZBIIKVMERY-BQBZGAKWSA-N 187.243 -1.308 50 10 AAGE O=C(F)N[C@@H]1C[C@H](CO)[C@H](O)[C@@H]1O 1882790225 VOODKVCPHUUBTM-ARQDHWQXSA-N 193.174 -1.232 50 10 AAGE COCCC(=O)NCC#CB(O)O 1883751545 YCKAYRQOTYXZHN-UHFFFAOYSA-N 184.988 -1.846 50 10 AAGE CN(C)CC[C@H](N)C(=O)NN 1927756940 BBYQBLOYANOAAP-YFKPBYRVSA-N 160.221 -1.745 50 10 AAGE CC(C)(O)[C@@H](N)[C@H](O)C#N 1952793421 LMSZQJAHGFNHGB-UHNVWZDZSA-N 144.174 -1.031 50 10 AAGE NNC(=O)CC1(O)CNC1 1953155123 XIGGARCDAGOHAT-UHFFFAOYSA-N 145.162 -2.299 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H]1[C@@H]1C[C@H]21 1955373192 NLQWWKIUZXFQJN-WNJXEPBRSA-N 195.222 -1.157 50 10 AAGE OCCN1CC[C@@H](B(O)O)C1 2208964913 WLEBTYJLRFIBEG-ZCFIWIBFSA-N 158.994 -1.473 50 10 AAGE CNCCn1cc(C(=O)NN)cn1 2209102894 NVMRSVALMJATQV-UHFFFAOYSA-N 183.215 -1.294 50 10 AAGE C[C@H]1CNC[C@@H]1NC(=O)C#CB(O)O 2241469079 ZVYFDHUAYVKWIO-BQBZGAKWSA-N 196.015 -2.274 50 10 AAGE N#CNC(=O)[C@H]1C[C@@H](B(O)O)C1 2241478223 ANBCZKAQXJJDEU-SYDPRGILSA-N 167.961 -1.163 50 10 AAGE NNC(=O)c1cccnc1C(=O)NN 1604587 HOIMEHRWLXXXOY-UHFFFAOYSA-N 195.182 -1.711 50 10 AAGE CC(=O)N[C@@H](C#N)C(=O)NN 2048235 UWUZBFUNEVIYRZ-BYPYZUCNSA-N 156.145 -1.995 50 10 AAGE C[C@@H](CNCCN(C)C)C(=O)NN 58851094 XYHWVKGVLNWHQA-ZETCQYMHSA-N 188.275 -1.236 50 10 AAGE C[C@H](CC(N)=O)NC(=O)C(=O)NN 220592098 PKJLBZWJGWTPFG-GSVOUGTGSA-N 188.187 -2.644 50 10 AAGE N[C@H](C(=O)NO)[C@@H](Cl)C(=O)NO 238618852 UHJFHOUBAICLHE-NCGGTJAESA-N 197.578 -2.068 50 10 AAGE NNC(=O)Cc1nnc(S)n1N 306674860 RLCKTYBKZKVKMX-UHFFFAOYSA-N 188.216 -2.187 50 10 AAGE Nc1ccc2[nH]cnc2c1B(O)O 306826780 FZTLOTNUIVABHS-UHFFFAOYSA-N 176.972 -1.175 50 10 AAGE C[C@H]1OCCN(C)[C@H]1C(=O)NN 306897263 SLDBWMIUYSRMGF-PHDIDXHHSA-N 173.216 -1.305 50 10 AAGE NNC(=O)C(=O)NCCOC(F)F 398297701 FLMPCYHFBVIKCO-UHFFFAOYSA-N 197.141 -1.668 50 10 AAGE CC[C@@H](Cn1ccc(B(O)O)n1)OC 694267061 BOZTUNTZZRFAIR-ZETCQYMHSA-N 198.031 -1.012 50 10 AAGE CO[C@H]1CCOC[C@H]1NC(=O)NN 725008375 ACJKBQISYQIFBG-RITPCOANSA-N 189.215 -1.037 50 10 AAGE OB(O)c1csc(F)n1 1879961517 JPHXGGBLSRUZNT-UHFFFAOYSA-N 146.939 -1.038 50 10 AAGE NNC(=O)C(=O)NCc1ncco1 1882699116 RGVGOVHVZCWCSO-UHFFFAOYSA-N 184.155 -1.719 50 10 AAGE CN(O)C(=O)c1c(B(O)O)ncn1C 1887430188 GAPMEIGKNFYMMB-UHFFFAOYSA-N 198.975 -2.439 50 10 AAGE O=C1C[C@@H](CN2CC[C@@H](B(O)O)C2)N1 1891516058 DEWCAPZREBXKSE-RQJHMYQMSA-N 198.031 -1.576 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C2C[C@@H]3C1[C@@H]3C2 1916965105 NCWVGNMEUCWTDG-RHIDBMJOSA-N 195.222 -1.253 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@H]1[C@@H]1C[C@H]21 1955373188 NLQWWKIUZXFQJN-GBNDHIKLSA-N 195.222 -1.157 50 10 AAGE O=[SH](=O)OOS(=O)(=O)OO 2080102096 OYHHTKXUTFQJAK-UHFFFAOYSA-N 194.142 -1.805 50 10 AAGE Cc1cn2ccnc(B(O)O)c2n1 2209106082 HWEDGCXCGADEEZ-UHFFFAOYSA-N 176.972 -1.282 50 10 AAGE NCCCOc1ncccc1B(O)O 2210066748 XMTPKTUUIIYVEZ-UHFFFAOYSA-N 196.015 -1.511 50 10 AAGE O=C(C#CB(O)O)NCC1(O)CCC1 2241479000 PMHBFCLHYQGQBY-UHFFFAOYSA-N 196.999 -1.967 50 10 AAGE N/C=N/c1[nH]ncc1C(=O)NN 141393972 HGXALGDCBLXKQQ-UHFFFAOYSA-N 168.160 -1.368 50 10 AAGE CN(C)C[C@H](N)B(O)O 200988497 OXUMQWGPCRAIDZ-BYPYZUCNSA-N 131.972 -2.113 50 10 AAGE CN(C(=O)NN)C(CO)CO 307734607 VWBVRMPUZXGIGZ-UHFFFAOYSA-N 163.177 -2.145 50 10 AAGE N#CC=NNC(=O)C(=O)NC1CC1 388297742 LZRCBCYFUNGZRB-UHFFFAOYSA-N 180.167 -1.109 50 10 AAGE NNC(=O)C(=O)NCC1(Cl)CC1 1881392016 KSGBKTOIQNYXNX-UHFFFAOYSA-N 191.618 -1.136 50 10 AAGE CN(C)NC(=O)[C@@H]1[C@H]2NCCO[C@@H]21 1929944537 DRBDIBUOMXAUED-FSDSQADBSA-N 185.227 -1.434 50 10 AAGE CN1CCN(C(=O)C(=O)NN)[C@@H]2C[C@@H]21 1956639443 VRJHKCSEVOXKDU-NTSWFWBYSA-N 198.226 -2.109 50 10 AAGE O=C(C#CB(O)O)NCC1CSC1 2241475971 JDCVDRQTVGLOBQ-UHFFFAOYSA-N 199.040 -1.519 50 10 AAGE COC[C@@H](C)CNC(=O)C(=O)NN 45649504 MWTAYTPJERLNQC-YFKPBYRVSA-N 189.215 -1.625 50 10 AAGE CCNC(=O)NC(=O)NN 104627429 GCVWDGVHJMXYAL-UHFFFAOYSA-N 146.150 -1.111 50 10 AAGE CNNC(=O)[C@H](N)CO 104654709 VTDPDAOAIIOCIT-GSVOUGTGSA-N 133.151 -2.443 50 10 AAGE CN(C)NC(=O)[C@@H](N)CC(N)=O 147266913 LTYLWEKNVIEZPH-BYPYZUCNSA-N 174.204 -2.218 50 10 AAGE N#C[C@@H](O)[C@@H](N)CO 217405440 FYRPWEWOPQMSFW-IUYQGCFVSA-N 116.120 -1.810 50 10 AAGE COc1nc(CO)ccc1B(O)O 225568052 KPYSMZCFXWUKML-UHFFFAOYSA-N 182.972 -1.738 50 10 AAGE C[C@H](O)[C@H](O)/C=C/C=N/NC(N)=O 238419623 SWKXUMHVDGLSRT-TZNVJXQGSA-N 187.199 -1.062 50 10 AAGE CN(CCC(N)=O)CCC(=O)NN 382058762 BWCVGJCZWARDLR-UHFFFAOYSA-N 188.231 -1.826 50 10 AAGE NC[C@@]1(C(=O)NN)CCCOC1 606253252 HEMQMSFCLMVYBE-ZETCQYMHSA-N 173.216 -1.268 50 10 AAGE NNC(=O)N1CC[C@@H](O)[C@H](F)C1 885354822 KFKKHLFQXLZZKN-RFZPGFLSSA-N 177.179 -1.026 50 10 AAGE NCc1sccc1B(O)O 1880101796 LHEAEGYIQLRSSE-UHFFFAOYSA-N 157.003 -1.113 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C[C@H](CO)C1 2241468554 QIIVXBVDWRDWSF-LJGSYFOKSA-N 196.999 -2.111 50 10 AAGE O=CNc1ncc(B(O)O)cc1F 2241557957 CSLLRPUPNDNMQW-UHFFFAOYSA-N 183.935 -1.531 50 10 AAGE OCOOCO 95720911 JLJXMZMKMRQOLN-UHFFFAOYSA-N 94.066 -1.166 50 10 AAGE CC[C@@H](NC)C(=O)NN 104621185 JLHDWLWTENYEHC-SCSAIBSYSA-N 131.179 -1.026 50 10 AAGE CC(C)NNC(=O)[C@H]1NCC[C@H]1O 238197408 PWLDFDWAJAUNIM-RQJHMYQMSA-N 187.243 -1.262 50 10 AAGE NNC(=O)CNC(=O)CCl 238657323 OAHQTPHCZWCQIH-UHFFFAOYSA-N 165.580 -1.669 50 10 AAGE Nc1cc(O)ncc1B(O)O 238703076 SHDSZEXDWNDFPC-UHFFFAOYSA-N 153.934 -1.951 50 10 AAGE N#C/C(=C\N1CCNC1=O)C(N)=O 306540670 WOAHSNZBZRHWHP-SNAWJCMRSA-N 180.167 -1.096 50 10 AAGE Nc1nc2cc(B(O)O)c(N)cc2[nH]1 307011340 OVXHRZCZQAHHEJ-UHFFFAOYSA-N 191.987 -1.593 50 10 AAGE O[C@H]1[C@@H](O)[C@H](O)[C@@H](Cl)[C@H](O)[C@@H]1O 307224638 BSMLUJHFZGTHOG-WPRNADSXSA-N 198.602 -2.588 50 10 AAGE C[C@H]1CC(=O)N[C@@H](C(=O)NN)C1 307226073 ABXFNKMVPMVLMF-RFZPGFLSSA-N 171.200 -1.109 50 10 AAGE COC(=O)[C@@H]1C[C@@H]1C(=O)NNC=O 379368146 XBCPIQQVBFQYMC-CRCLSJGQSA-N 186.167 -1.427 50 10 AAGE CN(CC[S@@](C)=O)CC(=O)NN 399869760 BFLXAUNVXPDSJW-GFCCVEGCSA-N 193.272 -1.713 50 10 AAGE CO[C@H]1C[C@@H]1C(=O)NNC(N)=S 689976658 ONJICMOEJKMRCW-IMJSIDKUSA-N 189.240 -1.114 50 10 AAGE NNC(=O)CCN1C[C@H]2C[C@H]1[C@H]2CO 1902449843 ZWNRNGDVWOECLZ-CSMHCCOUSA-N 199.254 -1.321 50 10 AAGE C[C@](N)(C(=O)NN)C(F)F 1932390084 YLIQVVMFOVFWGO-SCSAIBSYSA-N 153.132 -1.041 50 10 AAGE CN(C)CCN(CCO)C(=O)NN 1934407244 QYLUCARIPFBDHA-UHFFFAOYSA-N 190.247 -1.574 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H]1[C@H]1C[C@H]12 1955373186 NLQWWKIUZXFQJN-AXMZGBSTSA-N 195.222 -1.157 50 10 AAGE C[C@@H](CO)Nc1ccc(B(O)O)cn1 2210060382 JURMSEBNXXAXHV-LURJTMIESA-N 196.015 -1.446 50 10 AAGE C[C@@H]1C[C@H](NC(=O)C#CB(O)O)CN1 2241467857 BZDKICVKWMEDET-RQJHMYQMSA-N 196.015 -2.132 50 10 AAGE C#CCNC(=O)c1cc(B(O)O)c[nH]1 2241478780 LGLQZDVEGGWKLQ-UHFFFAOYSA-N 191.983 -1.943 50 10 AAGE CCn1cc(C(=O)NO)nc1B(O)O 2241583640 AZYURDYMIRHDHW-UHFFFAOYSA-N 198.975 -2.298 50 10 AAGE COC(=O)c1cc(B(O)O)[nH]n1 204894107 AGVQTZDDFZDWLE-UHFFFAOYSA-N 169.933 -2.124 50 10 AAGE CCN(CB(O)O)C(=O)[C@@H](C)N 216441600 LJBPQMWUPWWVGI-RXMQYKEDSA-N 174.009 -1.806 50 10 AAGE CC[C@@H]1C[C@@H]1NC(=O)C(=O)NN 233933502 ZFCRBNGZEABZDY-UHNVWZDZSA-N 171.200 -1.109 50 10 AAGE NNC(=O)[C@H]1CN2CC[C@H]1C2 306163246 ODSJBQOEMCPLBO-WDSKDSINSA-N 155.201 -1.072 50 10 AAGE CC(=O)N1CCOC[C@H]1C(=O)NN 306243656 MFTSZZAYTKQXHU-LURJTMIESA-N 187.199 -1.776 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](O)[C@@H](Cl)[C@@H]1O 306316591 CRJLKIILIKSPDH-YJRYQGEOSA-N 198.602 -1.975 50 10 AAGE CS(C)(=O)=NC(=O)C(=O)NN 307149221 QUDCKYGTFFITTH-UHFFFAOYSA-N 179.201 -1.770 50 10 AAGE C[C@@H]1CN(C(=O)C(=O)NN)C[C@@H]1O 307601871 VMOWJQUVYAUYJD-UHNVWZDZSA-N 187.199 -2.185 50 10 AAGE CN(N)C(=O)c1cnn[nH]1 575456634 PVKBZUVCMWTMJA-UHFFFAOYSA-N 141.134 -1.250 50 10 AAGE Cn1cc(C(=O)NCB(O)O)cn1 706487825 GLPPTWGUVPGXIL-UHFFFAOYSA-N 182.976 -1.838 50 10 AAGE O=C(CCl)NCC(CO)CO 1880243498 XDBRAXBVEKPOBZ-UHFFFAOYSA-N 181.619 -1.058 50 10 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-1.187 50 10 AAGE OB(O)c1ncncc1Cl 238639546 FTTFXBWCCHCPLQ-UHFFFAOYSA-N 158.353 -1.190 50 10 AAGE Nc1nccc(C=O)c1B(O)O 238698574 QDYLQSKZZPKBCR-UHFFFAOYSA-N 165.945 -1.844 50 10 AAGE CN1C[C@H](NC(=O)NN)C(=O)N1 306660775 NGETUKNVVFISKF-VKHMYHEASA-N 173.176 -2.496 50 10 AAGE NC(=O)NN=Cc1n(O)cc[n+]1[O-] 687728797 ZDVNROZGEMRMMI-UHFFFAOYSA-N 185.143 -1.639 50 10 AAGE O=C(NCB(O)O)c1ccon1 702032850 UPWUHSCYJYVYQR-UHFFFAOYSA-N 169.933 -1.584 50 10 AAGE CC(C)OCC(=O)NCB(O)O 706503810 GADNIXPAIMQZIR-UHFFFAOYSA-N 174.993 -1.460 50 10 AAGE CC1(C)OCC[C@]1(N)B(O)O 885266185 SZDCQOFNMFOGEX-ZCFIWIBFSA-N 158.994 -1.105 50 10 AAGE Cc1cnn2c(B(O)O)ccnc12 1934735156 KVLQYIPLFIXSER-UHFFFAOYSA-N 176.972 -1.282 50 10 AAGE O=C(NCB(O)O)[C@]12CC[C@H]1C2 1935498962 CXJNRALLZUZJJB-FSPLSTOPSA-N 168.989 -1.085 50 10 AAGE C[C@@H](C(=O)NN)N1CC(C#N)C1 1953611928 FBGZPMMRUWMZDF-YFKPBYRVSA-N 168.200 -1.180 50 10 AAGE CC(=O)NNC(=O)CO 36757650 GAMNJROVYITQAR-UHFFFAOYSA-N 132.119 -1.854 50 10 AAGE CCN(C)C(=O)COCC(=O)NN 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170.172 -1.053 50 10 AAGE NNC(=O)C(=O)N1CC(N2CCC2)C1 1932053184 PIUSGNJQDZPOQD-UHFFFAOYSA-N 198.226 -2.107 50 10 AAGE NNC(=O)[C@H]1CNCCSC1 1933019869 XWALLMNETPSNNZ-YFKPBYRVSA-N 175.257 -1.071 50 10 AAGE NNC(=O)C[C@@H]1CNC[C@@H]1O 1953343098 XXHDCJVKDMLHKW-UHNVWZDZSA-N 159.189 -2.053 50 10 AAGE Cn1cc(C[C@](C)(N)B(O)O)cn1 1954446638 SMTFVOGPHBTENG-ZETCQYMHSA-N 183.020 -1.308 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2OCC[C@@H]2C1 1956919902 SXXGTNGCYMFBHZ-PHDIDXHHSA-N 199.210 -1.776 50 10 AAGE C[C@H](O)CN=c1ccc(B(O)O)c[nH]1 2210060673 MMNSZJCMRWKZSY-LURJTMIESA-N 196.015 -2.024 50 10 AAGE C[C@H](N)COc1ccc(B(O)O)cn1 2210061040 PRHXWWPQRLNZOS-LURJTMIESA-N 196.015 -1.513 50 10 AAGE O=C(C#CB(O)O)N1CC=CC1 2241467828 BPQRQDWIGWTSDH-UHFFFAOYSA-N 164.957 -1.600 50 10 AAGE C[C@H](C(=O)NN)N1CCNC(=O)C1 82466268 DYLXGXTXORZURN-RXMQYKEDSA-N 186.215 -2.203 50 10 AAGE CC[C@@H](C(=O)NN)N(C)CCO 82468843 WHZMNYJSXJVISS-LURJTMIESA-N 175.232 -1.321 50 10 AAGE O=C(CO)[C@@H](O)[C@@H](O)CCl 104688456 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N[C@H](B(O)O)[C@@H]1C[C@]12CCOC2 1935082446 LIPCBFZSIQKAAX-ACZMJKKPSA-N 171.005 -1.248 50 10 AAGE O=C(O)c1cc(B(O)O)c(O)cc1O 2241489200 BDSLEGJTPZPJHF-UHFFFAOYSA-N 197.939 -1.524 50 10 AAGE NC(=O)Nc1ncc(B(O)O)cc1F 2241510189 HLEADTKCVJQBAX-UHFFFAOYSA-N 198.950 -1.609 50 10 AAGE NCC1(C(=O)NN)CC1 168728868 BYDBNLXPFLBJTI-UHFFFAOYSA-N 129.163 -1.285 50 10 AAGE N#Cc1ncc(B(O)O)cc1N 206064703 LRRHEXUECUZZJE-UHFFFAOYSA-N 162.945 -1.785 50 10 AAGE O=CNCc1cc(B(O)O)ccc1F 208611873 NLBCQCDNEWOEEG-UHFFFAOYSA-N 196.974 -1.249 50 10 AAGE CC[C@H](SCC(N)=O)C(=O)NN 300778477 UAGFXRYOHQMAPZ-BYPYZUCNSA-N 191.256 -1.027 50 10 AAGE NNC(=O)[C@@H](N)C(F)(F)F 306245710 WGFIHCAIVVBGOV-PVQJCKRUSA-N 157.095 -1.134 50 10 AAGE NNC(=O)N[C@H]1CCCCNC1=O 306757880 TUUKZTUCFCDUKL-YFKPBYRVSA-N 186.215 -1.172 50 10 AAGE O[C@H]1[C@@H](O)[C@H](O)[C@@H](Cl)[C@@H]1O 307382258 AZRSXIZEFAVCBM-HYFGLKJPSA-N 168.576 -1.949 50 10 AAGE CN1NC(CN)=C=C1C(=O)NN 885308686 UTUJDNJCTYBOOG-UHFFFAOYSA-N 169.188 -2.248 50 10 AAGE C=C[C@H](N)C(=O)NN 1879942970 ZULQFEFTYUIPSQ-VKHMYHEASA-N 115.136 -1.510 50 10 AAGE CC1(C)[C@@H](O)CN1C(=O)C(=O)NN 1883986963 KXOLEDWXRJPPLD-BYPYZUCNSA-N 187.199 -2.042 50 10 AAGE O=C(Cn1ccnc1)NNCCO 1929831897 JWPDDRBSCLCCGW-UHFFFAOYSA-N 184.199 -1.504 50 10 AAGE O=C(NNCCO)c1c[nH]c(=O)cn1 1929833871 RLVROYLJWISIFJ-UHFFFAOYSA-N 198.182 -2.003 50 10 AAGE NNC(=O)CCN1CC[C@H]2C[C@@]2(O)C1 1956824385 RDESUNVCNVBRNW-IONNQARKSA-N 199.254 -1.177 50 10 AAGE N#CN=c1ccc(Cl)c(B(O)O)[nH]1 2241555005 JCJLYUXSSSOUJJ-UHFFFAOYSA-N 197.390 -1.270 50 10 AAGE NNC(=O)CN1C(=O)CCCC1=O 82471381 JEUUGPWEVSVWJS-UHFFFAOYSA-N 185.183 -1.485 50 10 AAGE OC[C@@H]1O[C@@H](O)[C@@H](Cl)[C@H](O)[C@@H]1O 96077861 SNGNCYILSHZBLM-MDMQIMBFSA-N 198.602 -1.975 50 10 AAGE NCC(=O)NNC(N)=O 104637039 VDWCYKSLKISGTN-UHFFFAOYSA-N 132.123 -2.355 50 10 AAGE O=Cc1c[nH]cc(B(O)O)c1=O 206094283 HBFGOTWOEKYSTA-UHFFFAOYSA-N 166.929 -2.133 50 10 AAGE CC(C)[C@H](N)C(=O)N[C@H](C)B(O)O 211732005 SHQGMGKBRGBIGM-RITPCOANSA-N 188.036 -1.514 50 10 AAGE COCCC(=O)NNC=O 306482330 LXZVWDCNBVRCEN-UHFFFAOYSA-N 146.146 -1.200 50 10 AAGE O[C@H]1[C@H](O)CO[C@@H](O)[C@@H]1Cl 307213224 QBZSYPGANFVRKW-SQOUGZDYSA-N 168.576 -1.336 50 10 AAGE C[C@@H](C(=O)NN)N1C#[N+]C(=C=N)N1 885374973 XTTBJRIRRBKLLM-BYPYZUCNSA-O 181.179 -1.435 50 10 AAGE NNC(=O)COc1c[nH]ccc1=O 1857905930 DQYHFYCXIYUFTF-UHFFFAOYSA-N 183.167 -1.256 50 10 AAGE NNC(=O)[C@H]1COCC[C@H]1N 1880174592 SQNYWADFBGVPJN-CRCLSJGQSA-N 159.189 -1.660 50 10 AAGE NNC(=O)C(=O)NC[C@H]1C[C@H]1Cl 1881368084 ZSZGWIMGGCTPAO-QWWZWVQMSA-N 191.618 -1.280 50 10 AAGE C[C@@]1(CCO)CCN1CC(=O)NN 1884166423 QYGGZCPRPAFZBV-QMMMGPOBSA-N 187.243 -1.177 50 10 AAGE C=C[C@@]1(O)CCN(C(=O)C(=O)NN)C1 1891945820 NCDDAAHMMNGNEC-MRVPVSSYSA-N 199.210 -1.874 50 10 AAGE O=C(NCB(O)O)[C@@H]1[C@H]2CCOC[C@@H]21 1930430994 WNNGIVKIRIKLIP-LYFYHCNISA-N 199.015 -1.603 50 10 AAGE CON(C)c1nc(B(O)O)cs1 1953716113 YXZGAJQIGHXZCH-UHFFFAOYSA-N 188.017 -1.180 50 10 AAGE CCOCn1cc(B(O)O)cnc1=O 2210087600 YWABVOZOMDOWKH-UHFFFAOYSA-N 197.987 -2.083 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1[C@H]2CCO[C@H]21 2241479059 QQVRGVUXMZUHMD-LPBLVHEISA-N 194.983 -2.095 50 10 AAGE CCn1ccn(CC(=O)NN)c1=O 87667095 ZOKUTQNESGZRGY-UHFFFAOYSA-N 184.199 -1.340 50 10 AAGE CNC(=S)C(=O)NN 104734736 JNCIIVVSIXVVSK-UHFFFAOYSA-N 133.176 -1.477 50 10 AAGE OC[C@H](O)[C@H](O)[C@H](O)CCl 141172411 ITZUYINNFCACKN-MROZADKFSA-N 170.592 -1.700 50 10 AAGE CCC(=O)N(C)CB(O)O 195976010 ROFNKFMPSJWYCK-UHFFFAOYSA-N 144.967 -1.133 50 10 AAGE O=Cc1ccc2c(c1B(O)O)OCO2 258020361 OCFMIPAIFOHYPA-UHFFFAOYSA-N 193.951 -1.092 50 10 AAGE O[C@H](CCl)CN1C[C@@H](O)[C@H](O)C1 300059286 OBNCKRPKADTZHT-FSDSQADBSA-N 195.646 -1.377 50 10 AAGE CNC(=O)NNC(=O)CNC(N)=O 306500116 MHJPUJBNBLULLA-UHFFFAOYSA-N 189.175 -2.385 50 10 AAGE O=C[C@@H](O)[C@@H](O)[C@H](O)/C=C\B(O)O 308095739 WRTNKKAVXFZOQQ-GBWOLBBFSA-N 189.960 -3.164 50 10 AAGE NNC(=O)CCNC(=O)C1CC1 308384871 SWTYVNITZRCXLF-UHFFFAOYSA-N 171.200 -1.107 50 10 AAGE CC[C@H](C(=O)NN)N1C#[N+]C(=C=N)N1 885668919 NJWGRQHCMILOSM-RXMQYKEDSA-O 195.206 -1.045 50 10 AAGE CO[C@@H](C)n1cc(B(O)O)cn1 953036109 YCPIWMXEXVGFFT-YFKPBYRVSA-N 169.977 -1.272 50 10 AAGE NCCN=c1cc(B(O)O)c(F)c[nH]1 1892557628 RAOUMISUJOZAEP-UHFFFAOYSA-N 198.994 -2.307 50 10 AAGE CCN(C)NC(=O)CO 1923385195 RWNSXYDDAKJQOP-UHFFFAOYSA-N 132.163 -1.038 50 10 AAGE CC[C@@H](C(=O)NN)N1CC=C[C@H](O)C1 1956306181 HPLSVHOBZAJUCD-YUMQZZPRSA-N 199.254 -1.012 50 10 AAGE CC1CN(c2ncc(B(O)O)cn2)C1 1956960074 AYBAYPZRMMVEMO-UHFFFAOYSA-N 193.015 -1.388 50 10 AAGE C[C@H](N)CCNC(=O)C#CB(O)O 2241468218 JGWGYAUAFUUULL-LURJTMIESA-N 184.004 -2.145 50 10 AAGE C[C@@H](N)[C@@H](C)NC(=O)C#CB(O)O 2241468701 SPKIUSAKJPLKLF-PHDIDXHHSA-N 184.004 -2.146 50 10 AAGE C[C@@H](CC(=O)NN)n1ncn(C)c1=O 2297013457 FGMQVUFNFKJEMX-YFKPBYRVSA-N 199.214 -1.477 50 10 AAGE NNC(=O)C(=O)NCCCC(N)=O 37660823 ASFJSNOJFZQIBY-UHFFFAOYSA-N 188.187 -2.642 50 10 AAGE NNC(=O)CP(=O)(O)O 78279555 KCIZVNVHMOFBEX-UHFFFAOYSA-N 154.062 -1.846 50 10 AAGE C[C@H](C(=O)NN)n1cc(C(N)=O)cn1 82471508 DGVXEMANQNJGMO-SCSAIBSYSA-N 197.198 -1.467 50 10 AAGE CS(=O)(=O)NNC(N)=O 164564225 AVPFUEIJOSYXBS-UHFFFAOYSA-N 153.163 -1.881 50 10 AAGE NNC(=O)CC[C@H]1NC(=O)NC1=O 232676815 FSDRCRHVXULOOZ-GSVOUGTGSA-N 186.171 -2.036 50 10 AAGE NNC(=O)C[C@@H]1COCC[C@@H]1O 238658803 MBBFWTWDDMSKOT-RITPCOANSA-N 174.200 -1.236 50 10 AAGE OCc1cc2c(c(B(O)O)c1)OCO2 238680139 PVMDQDKOCGNURX-UHFFFAOYSA-N 195.967 -1.413 50 10 AAGE OCc1ccnc(Cl)c1B(O)O 238728136 NVSADYIMDOKNMF-UHFFFAOYSA-N 187.391 -1.093 50 10 AAGE CN1N=C=C(/C=N/NC(=O)CO)N1 885425389 FJKNHVINKIXZPQ-FARCUNLSSA-N 183.171 -2.001 50 10 AAGE NNC(=O)N[C@@H]1[C@H]2CCO[C@H]21 1880147375 DOIMSZMMYDDCDB-UOWFLXDJSA-N 157.173 -1.053 50 10 AAGE N#CC[C@@H](O)CN1CC[C@@H](B(O)O)C1 1891493850 YIEJNVBIVYHBNL-HTQZYQBOSA-N 198.031 -1.190 50 10 AAGE OB(O)c1ccc(O)nn1 1951334490 MYFFXJQJZGJDMH-UHFFFAOYSA-N 139.907 -2.138 50 10 AAGE N#C[C@@H](O)[C@@H](N)c1c[nH]c(=O)cn1 1952958056 JBWDMBCPORSRDR-VDTYLAMSSA-N 180.167 -1.346 50 10 AAGE CCS(=O)(=O)C[C@](C)(N)B(O)O 1953677559 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1880566446 CAFJATFLLMVRBD-UHFFFAOYSA-N 189.240 -1.113 50 10 AAGE O=C(NNCCO)[C@@H]1[C@@H]2CCO[C@@H]21 1881756462 KXEZXIQVYWDLAJ-XVMARJQXSA-N 186.211 -1.366 50 10 AAGE NNC(=O)N1C[C@H](O)[C@H](F)C1 1929911929 BPKVXTLEPHPNME-DMTCNVIQSA-N 163.152 -1.416 50 10 AAGE NC(=O)N1CC[C@H](B(O)O)C1 2208963139 IPFIWVHQNFJEFA-BYPYZUCNSA-N 157.966 -1.386 50 10 AAGE OB(O)c1cnc(=NCC2CC2)[nH]c1 2210061032 PJRUIELWQOFZGD-UHFFFAOYSA-N 193.015 -1.600 50 10 AAGE N[C@@H]1CCN(C(=O)C#CB(O)O)C1 2241468966 XUCBLYIQTCKBEB-ZCFIWIBFSA-N 181.988 -2.439 50 10 AAGE O=C(NCC=CCO)[C@H]1C[C@H]1B(O)O 2241480122 IOHCNYAFRSGDHH-NKWVEPMBSA-N 199.015 -1.486 50 10 AAGE C[C@@H]1[C@H](O)CN1C(=O)C1(B(O)O)CC1 2241481392 RXHSIPBDUFGYJA-PHDIDXHHSA-N 199.015 -1.415 50 10 AAGE CC(C(=O)NN)C(=O)NN 26892152 PFLKMBKIVOPUTK-UHFFFAOYSA-N 146.150 -2.398 50 10 AAGE O=C1C[C@H](N2CCNCC2)C(=O)O1 100283544 VHVUQOMQTHMBLL-LURJTMIESA-N 184.195 -1.266 50 10 AAGE CC[C@@H](C(=O)NN)N1CC[C@H](N)C1 203221832 DFAPRFWWQCHHTN-BQBZGAKWSA-N 186.259 -1.212 50 10 AAGE Nc1nc(F)ccc1B(O)O 221377203 XBNDKSHGBWQDHS-UHFFFAOYSA-N 155.925 -1.517 50 10 AAGE CCN(CC(N)=O)CC(=O)NN 231828501 NOVYRDIZLZOYQL-UHFFFAOYSA-N 174.204 -2.217 50 10 AAGE NNC(=O)N1C[C@@H]2C(=O)NC(=O)[C@H]2C1 306801882 SCHPKTSMXWHLEB-IMJSIDKUSA-N 198.182 -2.226 50 10 AAGE NC(=O)N/N=C/[C@@H](O)C(=O)O 307326660 NEWZAHLNBOVJRJ-FMOIZUPUSA-N 161.117 -1.914 50 10 AAGE Cn1cnnc1B(O)O 307703569 VTOXQTBTTMNSAD-UHFFFAOYSA-N 126.912 -2.505 50 10 AAGE C[C@H]1C[C@@H]1C(=O)NCB(O)O 575452336 WYWIAAUQGKFUOJ-WHFBIAKZSA-N 156.978 -1.229 50 10 AAGE CO[C@@H]1CNC[C@@H]1C(=O)NN 575481098 MOGDDHYGLTVQTO-CRCLSJGQSA-N 159.189 -1.789 50 10 AAGE CN1CC[C@H](N)C[C@H]1C(=O)NN 687728973 IQBJPAURXMYCAA-WDSKDSINSA-N 172.232 -1.602 50 10 AAGE C[C@@H](N)C(=O)NNC(=O)C1=NCC=C1 725542413 MFOWRXUOVCPGDL-RXMQYKEDSA-N 196.210 -1.508 50 10 AAGE C[C@@H](CC(=O)NN)N1C#CNN1 885308373 AXUZILRRKDNBPR-YFKPBYRVSA-N 169.188 -2.002 50 10 AAGE CC(=O)NNC(=O)Cc1nnn(C)n1 1860396613 WRAOBRXVOLTMMM-UHFFFAOYSA-N 198.186 -2.080 50 10 AAGE NNC(=O)CC[C@]1(N)CCOC1 1932473650 FDYGKEUZGCZBPU-ZETCQYMHSA-N 173.216 -1.126 50 10 AAGE O=C([C@@H]1C[C@@H]1B(O)O)N1CCNCC1 2241495027 GCAAWPSGLTXPAZ-RQJHMYQMSA-N 198.031 -1.719 50 10 AAGE O=C(NO)C1(B(O)O)CCC1 2241583854 FLUVHJFJJATBBX-UHFFFAOYSA-N 158.950 -1.111 50 10 AAGE CC(=O)NNC(=O)[C@@H]1CCCN1 49805010 DMUVDZVPSGTSHZ-LURJTMIESA-N 171.200 -1.094 50 10 AAGE C[C@H](CC(=O)NN)N1CC[C@H](O)C1 82468723 QZEWQUBOVMXGKP-RQJHMYQMSA-N 187.243 -1.179 50 10 AAGE NNC(=O)C1C[C@H](O)C(O)[C@@H](O)C1 306993890 LZUWSBBZPIKWMQ-CHJPALPBSA-N 190.199 -2.531 50 10 AAGE CC[C@@H](N)C(=O)N(CC)CB(O)O 308210990 LATSPMUNTCUXSW-ZCFIWIBFSA-N 188.036 -1.416 50 10 AAGE CC(=O)OC/C=N/NNC(N)=O 585666581 YWWGRFMLKUSVOK-FARCUNLSSA-N 174.160 -1.292 50 10 AAGE NNC(=O)CN1C[C@@H]2COC[C@H]2C1 718240975 IINQGJGSMHVWDK-RNFRBKRXSA-N 185.227 -1.446 50 10 AAGE NNC(=O)[C@]1(O)CCNC[C@H]1O 1881414579 ZHUFAALTOJGZGK-XINAWCOVSA-N 175.188 -2.938 50 10 AAGE COCCCC(=O)NCC#CB(O)O 1895148891 MMRGZLWPLFFRGA-UHFFFAOYSA-N 199.015 -1.455 50 10 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-3.048 50 10 AAGE CC1(C)CO[C@H](C(=O)NN)CN1 1953511083 XRJVDWARULGBNO-YFKPBYRVSA-N 173.216 -1.257 50 10 AAGE NNC(=O)C(=O)N1CCO[C@H]2C[C@H]21 1954050672 GTFKMPANVRYLNO-UHNVWZDZSA-N 185.183 -2.024 50 10 AAGE NNC(=O)N[C@@H]1CCO[C@H]1C(N)=O 1954182793 KTORXUURLADZKP-QWWZWVQMSA-N 188.187 -2.198 50 10 AAGE NNC(=O)CN1CC[C@H]2C[C@@H]2C1=O 2209322271 KWHDTHFTNHIGCI-WDSKDSINSA-N 183.211 -1.155 50 10 AAGE C[C@H](O)[C@@H](C)NC(=O)C#CB(O)O 2241468088 HFXSOADDDCOYAF-RITPCOANSA-N 184.988 -2.113 50 10 AAGE Cn1ncc(B(O)O)c1C(=O)NO 2241585117 YPVZNJSVKUHUIG-UHFFFAOYSA-N 184.948 -2.781 50 10 AAGE NNC(=O)[C@@H]1CCCN1C1CNC1 2241946855 SNRYVTGATUAHHS-ZETCQYMHSA-N 184.243 -1.588 50 10 AAGE NNc1cc(B(O)O)c(Cl)cn1 2242391677 JNESWGNPAQPGCB-UHFFFAOYSA-N 187.395 -1.300 50 10 AAGE C[C@@H](CN(CC#N)CC#N)C(=O)NN 58838584 FTRYWXZHKIMDJS-ZETCQYMHSA-N 195.226 -1.038 50 10 AAGE NNC(=O)N1CCN(C=O)CC1 71496671 NYHUNVWLYYANTP-UHFFFAOYSA-N 172.188 -1.656 50 10 AAGE CN(CCS(C)(=O)=O)C(=O)NN 86855554 YECAWXUORJXCOJ-UHFFFAOYSA-N 195.244 -1.454 50 10 AAGE C[C@@H](C(=O)NN)N1CCC[C@@H](O)C1 216331637 WYGBVVFLAAFWLY-NKWVEPMBSA-N 187.243 -1.179 50 10 AAGE C[C@H]1[C@@H](CO)CCN1CC(=O)NN 307290335 BKXLPOQWYKQCNI-NKWVEPMBSA-N 187.243 -1.321 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@H](O)C[C@H]1C 307573505 FSXMPSUQPDNHQQ-DSYKOEDSSA-N 187.243 -1.180 50 10 AAGE CCC(=O)NCC(=O)NN 307752969 UIPCQEHCLGLWKZ-UHFFFAOYSA-N 145.162 -1.498 50 10 AAGE NC(=O)Nc1cccc(B(O)O)n1 405190488 UEOQWYFKRRGUMY-UHFFFAOYSA-N 180.960 -1.748 50 10 AAGE NNC(=O)[C@@H]1OCC[C@@H]1N 575579054 WWXUXKKJKFGNHZ-IUYQGCFVSA-N 145.162 -1.908 50 10 AAGE Cl[C@@H]1NCN[C@H]2NCN[C@@H]12 585662215 NLYZULIEZYHYHD-VPENINKCSA-N 162.624 -1.453 50 10 AAGE O=C(NCB(O)O)c1cnsn1 702017399 MTVWIBGOQKHGCB-UHFFFAOYSA-N 186.989 -1.720 50 10 AAGE CC(=O)NCC(=O)NCB(O)O 702023790 SICOWAMIKDLAKT-UHFFFAOYSA-N 173.965 -2.749 50 10 AAGE O=C(Cn1cnnn1)NCB(O)O 702032125 HSNSZVPCOFNRJK-UHFFFAOYSA-N 184.952 -3.199 50 10 AAGE O=C(NCB(O)O)[C@]12CC[C@@H]1C2 1935498964 CXJNRALLZUZJJB-VDTYLAMSSA-N 168.989 -1.085 50 10 AAGE OB(O)c1cncc2nccnc12 1951331829 CZENKKHXHABKQT-UHFFFAOYSA-N 174.956 -1.295 50 10 AAGE C=CC1(NC(=O)C#CB(O)O)CNC1 2241468209 JDSPKOBSJPDTNK-UHFFFAOYSA-N 193.999 -2.354 50 10 AAGE C[C@H](O)CCN(C)C(=O)C#CB(O)O 2241475755 DWYJFIPRSQDSQL-ZETCQYMHSA-N 199.015 -1.769 50 10 AAGE C[C@H]1CCN1C(=O)C#CB(O)O 2241479331 WDGZMMVJASANEW-LURJTMIESA-N 166.973 -1.377 50 10 AAGE O[C@H]1O[C@H](CCl)[C@@H](O)[C@@H](O)[C@H]1O 104399155 QMWDIHPSUCUMFU-UKFBFLRUSA-N 198.602 -1.975 50 10 AAGE C[C@H](NC(N)=S)C(=O)NN 238432915 VPAUQBFGMPZIJR-REOHCLBHSA-N 162.218 -1.802 50 10 AAGE CCNNC(=O)[C@H]1COCCN1 306496705 FCKRGABMVUFTIJ-ZCFIWIBFSA-N 173.216 -1.385 50 10 AAGE C[C@@H](C(=O)NN)N(C)[C@H](C)C(N)=O 711133950 AVBFEGNMFIEWMI-UHNVWZDZSA-N 188.231 -1.830 50 10 AAGE CC1(C)OCCO[C@H]1[C@@H](N)B(O)O 1883672830 MWETZRGQKQJTGG-NTSWFWBYSA-N 189.020 -1.480 50 10 AAGE NNC(=O)[C@@H]1C=CCNC1 1953184687 GQNXFEHNZXEPEJ-RXMQYKEDSA-N 141.174 -1.248 50 10 AAGE C[C@@]1(CO)C=CCN1CC(=O)NN 2209322221 KGNSQBUYOWOATJ-QMMMGPOBSA-N 185.227 -1.401 50 10 AAGE Cn1cc(C(=O)NC#N)nc1B(O)O 2241468568 QMRBZYKZRILOPJ-UHFFFAOYSA-N 193.959 -2.689 50 10 AAGE C[C@H](CO)NC(=O)C#CB(O)O 2241468603 RATZASYTYKRKRB-RXMQYKEDSA-N 170.961 -2.501 50 10 AAGE O=C(NC1CC(O)C1)C1(B(O)O)CC1 2241474133 XFJZLLSVYPMNQP-UHFFFAOYSA-N 199.015 -1.367 50 10 AAGE NC(=O)CCNC(=O)C#CB(O)O 2241478449 FOANYOPBXCEKIC-UHFFFAOYSA-N 183.960 -3.007 50 10 AAGE O=C(C#CB(O)O)NCC1(F)CC1 2241478658 JUIZJRLSCPIWHJ-UHFFFAOYSA-N 184.963 -1.380 50 10 AAGE N[C@H]1C[C@@H](NC(=O)[C@H]2C[C@H]2B(O)O)C1 2241478910 NLPFQJHVFWVMOT-BNHYGAARSA-N 198.031 -1.545 50 10 AAGE O=C(F)N1C[C@H](O)[C@@H](O)[C@H](CO)C1 2242199509 WARIGNBPJMRWLO-ZLUOBGJFSA-N 193.174 -1.278 50 10 AAGE NNC(=O)[C@@H]1COC[C@@H]1N 85374388 SQMWJHQZPZAGAB-DMTCNVIQSA-N 145.162 -2.050 50 10 AAGE COc1cc(OC)nc(B(O)O)c1 206077941 FDJTUMSYZGVMMV-UHFFFAOYSA-N 182.972 -1.221 50 10 AAGE CC(C)[C@@H](N)C(=O)N[C@H](C)B(O)O 211731852 SHQGMGKBRGBIGM-PHDIDXHHSA-N 188.036 -1.514 50 10 AAGE Nc1nccc2cnc(B(O)O)cc12 238700246 XGOLODPIYQCQOB-UHFFFAOYSA-N 188.983 -1.108 50 10 AAGE CO[C@@H]1C[C@H](O)[C@H]([C@H](O)C#N)O1 306509190 BNEOGQHGAWCVCZ-BNHYGAARSA-N 173.168 -1.007 50 10 AAGE C[C@H]1CN(C(=O)NN)C[C@H]1O 307376360 BRASMYXNGVEWGW-CRCLSJGQSA-N 159.189 -1.118 50 10 AAGE C[C@H]1C[C@H](NC(=O)C(=O)NN)CO1 401399314 PGJPIUXUYPJOJT-WHFBIAKZSA-N 187.199 -1.730 50 10 AAGE Cl[C@@H]1NCN[C@H]2NCN[C@H]12 585662214 NLYZULIEZYHYHD-UOWFLXDJSA-N 162.624 -1.453 50 10 AAGE CS(=O)(=O)C[C@H](N=C=O)C(=O)O 757189164 RJMRPKRRWAGQIW-BYPYZUCNSA-N 193.180 -1.180 50 10 AAGE C#CC(=O)NNC(=O)c1cn(C)nn1 1559013731 HVBXJWACUBFRPA-UHFFFAOYSA-N 193.166 -1.791 50 10 AAGE O=CNNC(=O)N1CCOCC1 1858080647 LAWAVOJNFQKVBO-UHFFFAOYSA-N 173.172 -1.311 50 10 AAGE OB(O)c1cnn(C[C@@H]2C[C@H]2F)c1 1882861199 PFCIBNLVUDOVDN-CAHLUQPWSA-N 183.979 -1.079 50 10 AAGE CC1(C)OCCO[C@H]1[C@H](N)B(O)O 1883672833 MWETZRGQKQJTGG-WDSKDSINSA-N 189.020 -1.480 50 10 AAGE CC[C@H](C(=O)NN)N1CC=C[C@@H]1CO 1884400139 PAAGDUMVACEXGX-HTQZYQBOSA-N 199.254 -1.012 50 10 AAGE CC=C[C@@H](O)C(=O)NCB(O)O 1923737654 IQPWKEAZRAMSFU-RXMQYKEDSA-N 172.977 -1.948 50 10 AAGE C[C@]1(C(=O)NN)C[C@@H](N)CCO1 1929653705 OCDYNTVNPPTBDG-CAHLUQPWSA-N 173.216 -1.127 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H](O)[C@H](F)C1 1929910415 MTVYMMZHYJKXGL-HSUXUTPPSA-N 191.206 -1.621 50 10 AAGE N[C@H]1C[C@@H]1NC(=O)C#CB(O)O 2241468014 FWGHUNZBLAYMIX-WHFBIAKZSA-N 167.961 -2.782 50 10 AAGE CNCCNC(=O)C#CB(O)O 2241468210 JDYLHAVPOLIZPH-UHFFFAOYSA-N 169.977 -2.663 50 10 AAGE O=C(C#CB(O)O)Nc1cnoc1 2241468304 LBYKRIHDVTUBRN-UHFFFAOYSA-N 179.928 -1.372 50 10 AAGE CNc1cc(N)cc(B(O)O)c1 204760518 IEYSYMWGNKXLER-UHFFFAOYSA-N 165.989 -1.010 50 10 AAGE NNC(=O)CN(CCO)C1CCC1 228568861 PUQKSSGFLCKHEM-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE C[C@H](O)[C@H](O)[C@@H](O)/C=N/NC(N)=O 238421100 GNSOSMKGZQXBHQ-YAYROWISSA-N 191.187 -2.257 50 10 AAGE COc1ccc(B(O)O)c(CN)n1 238429804 IJRMMIKDOYGLIA-UHFFFAOYSA-N 181.988 -1.771 50 10 AAGE NCc1nccc(C=O)c1B(O)O 238610680 CXDZPDXZXCHHKU-UHFFFAOYSA-N 179.972 -1.967 50 10 AAGE O=C(O)c1ccc(B(O)O)c(O)n1 238621707 GZMPDPVNPXBWCA-UHFFFAOYSA-N 182.928 -1.835 50 10 AAGE C[C@@H]1OC[C@@H](C(=O)NN)O1 306280859 FAPHALWFFSVTFI-DMTCNVIQSA-N 146.146 -1.262 50 10 AAGE C[C@H](CC(=O)NN)N1CC[C@@H](N)C1 306391022 ZVGVMQPVMLRUIU-RNFRBKRXSA-N 186.259 -1.212 50 10 AAGE O[C@H]1[C@@H]2NN[C@H]1[C@H](O)[C@@H](Cl)[C@@H]2O 306930074 BLOVTHBWNQQGPI-WJVUKCJRSA-N 194.618 -2.465 50 10 AAGE O=C[C@H](Cl)[C@H](O)[C@H](O)[C@H](O)CO 307906592 RBEGMPAFDRYYIG-BGPJRJDNSA-N 198.602 -2.132 50 10 AAGE O=C[C@H](O)[C@H](O)[C@H](O)/C=C/B(O)O 308116845 WRTNKKAVXFZOQQ-KGBDDHFVSA-N 189.960 -3.164 50 10 AAGE COC(C)(C)CC(=O)NCB(O)O 702017512 NXSIZVMZSXATNQ-UHFFFAOYSA-N 189.020 -1.070 50 10 AAGE O=C1CN(C(=O)F)[C@@H](C(=O)O)CN1 1882787757 OWTBYRNGGNPMEE-GSVOUGTGSA-N 190.130 -1.039 50 10 AAGE O=C(F)N[C@@H]1C[C@H](CO)[C@@H](O)[C@@H]1O 1882790227 VOODKVCPHUUBTM-KVTDHHQDSA-N 193.174 -1.232 50 10 AAGE C[C@@]1(CNC(=O)NN)CCNC1=O 1883942824 QFJYJMOBMBUNFM-ZETCQYMHSA-N 186.215 -1.315 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@H](O)C2(CC2)C1 1930236139 WHQZRXZHTBIGDN-BQBZGAKWSA-N 199.254 -1.179 50 10 AAGE N#C[C@@H](O)[C@@H](N)c1nc(O)nc(O)n1 1953071261 LYYDVTSVZWBDKN-PWNYCUMCSA-N 197.154 -1.833 50 10 AAGE OB(O)c1cc(N2CCCC2)ncn1 1955210608 NUXBIWNQFJKYLD-UHFFFAOYSA-N 193.015 -1.243 50 10 AAGE NNC(=O)CN1C(=O)[C@@H]2C[C@@H]2[C@H]2C[C@H]21 1957166013 XZTDPOWMQNNVOY-DBRKOABJSA-N 195.222 -1.157 50 10 AAGE O=C(N[C@H]1CCNC1)[C@@H]1C[C@@H]1B(O)O 2241496518 UESJJDILQWLRKN-XVMARJQXSA-N 198.031 -1.673 50 10 AAGE CC(=O)NNS(C)(=O)=O 143528886 PPNPDPSWBIMHOA-UHFFFAOYSA-N 152.175 -1.413 50 10 AAGE CC(=O)CC(=O)N[C@H]1CC(=O)OC1=O 168772941 IRKUGXVKZCDBSN-YFKPBYRVSA-N 199.162 -1.076 50 10 AAGE O=C(O)C[C@@H](CB(O)O)C(=O)O 196426088 IUSBDGABCMSTTM-VKHMYHEASA-N 175.933 -1.365 50 10 AAGE OB(O)c1cn(C2CC2)nn1 238652317 PUJRIUJNPPCHEL-UHFFFAOYSA-N 152.950 -1.707 50 10 AAGE NC(=O)CNC(=S)NNC(N)=O 307565105 BSQPNEBZKNUMEB-UHFFFAOYSA-N 191.216 -2.481 50 10 AAGE CN1Cc2cc(B(O)O)cnc2C1=O 1384873132 APKPSZKJQLXJJG-UHFFFAOYSA-N 191.983 -1.653 50 10 AAGE CC(=O)NNC(=O)CCc1nc[nH]n1 1540576387 MAXDSSSRSJWYCJ-UHFFFAOYSA-N 197.198 -1.095 50 10 AAGE NNC(=O)[C@@H]1CNC2(CC2)CO1 1880974705 XMKKRXNZPNITJH-YFKPBYRVSA-N 171.200 -1.503 50 10 AAGE C=C[C@@]1(O)CCN(CCC(=O)NN)C1 1891926986 MKLTYRHIQNZSND-SECBINFHSA-N 199.254 -1.011 50 10 AAGE Cn1ccc(CNCB(O)O)n1 1923938421 ZCFRLXSHLOYCEP-UHFFFAOYSA-N 168.993 -1.478 50 10 AAGE CC(C)(O)[C@@H](N)[C@@H](O)C#N 1952793422 LMSZQJAHGFNHGB-WHFBIAKZSA-N 144.174 -1.031 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 1955373190 NLQWWKIUZXFQJN-UCROKIRRSA-N 195.222 -1.157 50 10 AAGE C[C@@H](N)COc1ncccc1B(O)O 2210066075 RUGSUNUZHBPJCJ-ZCFIWIBFSA-N 196.015 -1.513 50 10 AAGE CCC[C@H](N)CNC(=O)C#CB(O)O 2241478198 AAIOEKASVDPKNM-ZETCQYMHSA-N 198.031 -1.755 50 10 AAGE O=C(C#CB(O)O)N[C@H]1COC(=O)C1 2242591372 LHRPJFIBXGLMKM-RXMQYKEDSA-N 196.955 -2.567 50 10 AAGE C[C@H](O)[C@@]1(O)[C@@H](O)C(C#N)=C[C@H]1O 34414150 XTQRPPSVJOYBFK-UCVXFZOQSA-N 185.179 -1.716 50 10 AAGE NNC(=O)CCN(CCO)C1CC1 82470824 VJAFWHRYMOECQK-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE CCc1nc(C(=O)NN)n[nH]1 87445611 QNGZYSOSAVHLCT-UHFFFAOYSA-N 155.161 -1.029 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2CC[C@H]1C2 104898977 JXODXXDEFRNOHJ-WDSKDSINSA-N 183.211 -1.013 50 10 AAGE CN(CC(=O)NN)[C@@H]1CCOC1 133543780 HFWKBXXPUYOBIS-ZCFIWIBFSA-N 173.216 -1.303 50 10 AAGE O=C(CCO)OC(=O)CCO 143141760 YNDLEGJDTYJKKL-UHFFFAOYSA-N 162.141 -1.179 50 10 AAGE NC(=O)[C@H]1COCN1C(=O)CCl 205036046 YXZREQZWFIDHNN-SCSAIBSYSA-N 192.602 -1.105 50 10 AAGE CC[C@H]1C[C@@H]1NC(=O)C(=O)NN 234068406 ZFCRBNGZEABZDY-WHFBIAKZSA-N 171.200 -1.109 50 10 AAGE COc1cncc(B(O)O)c1F 238343882 ZNNUNBGFQBAZPS-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE NNC(=O)c1cnc(C(=O)NN)nc1 306173764 BSECNNQXWVUJSZ-UHFFFAOYSA-N 196.170 -2.316 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H](O)C[C@H]1C 307573514 FSXMPSUQPDNHQQ-VQVTYTSYSA-N 187.243 -1.180 50 10 AAGE C[C@@H](CCC(=O)NN)CC(=O)NN 388597221 DFUWBAKRJQJKMC-YFKPBYRVSA-N 188.231 -1.227 50 10 AAGE CO[C@@H](C)Cn1cc(B(O)O)cn1 694537686 YJGZNLRADHLWHI-LURJTMIESA-N 184.004 -1.402 50 10 AAGE O=C(NCB(O)O)C1[C@H]2COC[C@H]12 702017031 FJVMOPUNVJQHGW-WHFBIAKZSA-N 184.988 -1.993 50 10 AAGE C[C@@]1(C(=O)NN)CCC(=O)N1 1331707964 PMAAKSZNURBYPC-LURJTMIESA-N 157.173 -1.355 50 10 AAGE NNC(=O)[C@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 1346319517 KVQXNHOBPWMUMW-OLNRIVSGSA-N 195.222 -1.109 50 10 AAGE OB(O)CNCc1cocn1 1923810884 QLAGWYPWAIPYHD-UHFFFAOYSA-N 155.950 -1.224 50 10 AAGE NNC(=O)C=CCC(=O)NN 1927738651 KDWJPLHYVIJNPE-UHFFFAOYSA-N 158.161 -2.088 50 10 AAGE COc1nc(C(=O)NCB(O)O)co1 1956983371 QRMVAULKGYCEPQ-UHFFFAOYSA-N 199.959 -1.575 50 10 AAGE C[C@H]1CCN(C(=O)C#CB(O)O)C1=O 2241468757 UKZACOQSMNQRKL-LURJTMIESA-N 194.983 -1.603 50 10 AAGE Cn1nc(B(O)O)c(C(=O)NN)n1 2241474540 FQBWLOSZTGSHCI-UHFFFAOYSA-N 184.952 -3.902 50 10 AAGE N#CC1CN(C(=O)[C@H]2C[C@@H]2B(O)O)C1 2241481772 VJYYIYFDJXMWLG-BQBZGAKWSA-N 193.999 -1.169 50 10 AAGE O=C(NCC#CB(O)O)c1nn[nH]n1 2241555797 QVMGJKNOKKFHNE-UHFFFAOYSA-N 194.947 -3.055 50 10 AAGE OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1Cl 13514670 UDOJFSFHKNQOHC-FPRJBGLDSA-N 198.602 -1.975 50 10 AAGE Cc1[nH]nc(C(=O)NN)c1N 142993571 NKSOYTUCXXBBHB-UHFFFAOYSA-N 155.161 -1.096 50 10 AAGE COc1ccc(B(O)O)c(C=O)n1 206051761 RHZOAQDXHUDMLG-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE C#CC[C@H](N)CB(O)O 219631985 ALGGQPYWZFYMJF-YFKPBYRVSA-N 126.952 -1.190 50 10 AAGE C=CC(=O)[C@H](C#N)C(=O)NN 220149858 DNWQFOAJNTVXBZ-BYPYZUCNSA-N 153.141 -1.129 50 10 AAGE C[C@@]1(CC(=O)NN)NC(=O)NC1=O 238485267 GCNILAJOASESGT-LURJTMIESA-N 186.171 -2.036 50 10 AAGE C[C@@H](O)CN1C[C@H]1C(=O)NN 255984921 LDUAFGARFMSJDS-DZJKFNMESA-N 159.189 -1.959 50 10 AAGE OCc1c(B(O)O)ccc2[nH]cnc12 306568005 TZIKCTDJONGNBL-UHFFFAOYSA-N 191.983 -1.265 50 10 AAGE C[C@H]1C[C@H](O)CN1CC(=O)NN 306741263 DDYZHSVGIQQPRC-WDSKDSINSA-N 173.216 -1.569 50 10 AAGE CCOC(=O)NNC(=O)CO 307678457 OISZARUPNRCCRB-UHFFFAOYSA-N 162.145 -1.244 50 10 AAGE CCOC1CN(CC(=O)NN)C1 383055065 BMPHXRNAFPWAFP-UHFFFAOYSA-N 173.216 -1.303 50 10 AAGE COC/C=C/n1cc(B(O)O)cn1 689667288 WTNXVVGFDJICOB-NSCUHMNNSA-N 181.988 -1.320 50 10 AAGE O=C(NCB(O)O)N[C@H]1CCOC1 701942733 GGJOCSAHEAFEIJ-YFKPBYRVSA-N 187.992 -1.914 50 10 AAGE O=C(NCB(O)O)c1ccncc1O 702016993 CYVDSIIDGBIUCI-UHFFFAOYSA-N 195.971 -1.471 50 10 AAGE CN1CC[C@H]([N+]2=C=C(C=O)NN2)C1=O 885668835 FUEKHPADBJWKDA-ZETCQYMHSA-N 195.202 -1.995 50 10 AAGE Cc1nccn1CC(=O)NNCCO 1886703851 OIELFMBTXNYWDY-UHFFFAOYSA-N 198.226 -1.195 50 10 AAGE NNC(=O)CCN1C[C@H](O)C12CCC2 1900923107 VFWODHGNHSDGRD-ZETCQYMHSA-N 199.254 -1.034 50 10 AAGE NC(=O)NNC(=O)CCn1cnnn1 1928831845 BWMNCWSJOPIFEH-UHFFFAOYSA-N 199.174 -2.237 50 10 AAGE CN(C)C(=O)NCCC#CB(O)O 2241898287 BEJFMRBISLKWBI-UHFFFAOYSA-N 184.004 -1.337 50 10 AAGE CNC(=NNC=O)NC 104622299 LXWWJCUKZMEMLU-UHFFFAOYSA-N 130.151 -1.558 50 10 AAGE N#Cc1ccc2c(c1B(O)O)OCO2 258184299 WVARXNNRUTVXIW-UHFFFAOYSA-N 190.951 -1.033 50 10 AAGE OB(O)c1cccc2c1[C@@H](O)O[C@H]2O 306675120 RWLPMOWUUIBSRG-SFYZADRCSA-N 195.967 -1.622 50 10 AAGE NNC(=O)[C@@]1(O)C[C@@H](O)C=C1CO 307037854 FKSQYMLFDQCKRP-CAHLUQPWSA-N 188.183 -2.609 50 10 AAGE C[N+]1=C=C(C[C@H](Cl)C(N)=O)NN1 885533578 BWIAIPHPJQBKTH-YFKPBYRVSA-O 189.626 -1.312 50 10 AAGE O=C1C[C@@H](c2nn[nH]n2)C(=O)O1 1536215926 JZRVHCKJUIJKBP-REOHCLBHSA-N 168.112 -1.243 50 10 AAGE CN(NC(=O)CCC(N)=O)C(N)=O 1596554449 HOLOWOAURSGBHN-UHFFFAOYSA-N 188.187 -1.706 50 10 AAGE C[C@@H]1[C@H](O)CN1C(=O)C(=O)NN 1880908104 VIQTUFBMBGWWMC-QWWZWVQMSA-N 173.172 -2.432 50 10 AAGE C[C@H](C(=O)NN)N1CCO[C@@H]2C[C@H]21 1954051126 NHRDEOVWYDQPTG-FSDSQADBSA-N 185.227 -1.162 50 10 AAGE COc1nc(C)nc(C)c1B(O)O 1954086510 TUDFPOAQQJCCRI-UHFFFAOYSA-N 181.988 -1.218 50 10 AAGE NC[C@@H]1CC[C@@H](C(=O)NN)CO1 2241251554 ZWQQECXEYHOOGP-RITPCOANSA-N 173.216 -1.270 50 10 AAGE C[C@H]1CN(C(=O)C#CB(O)O)C[C@H]1N 2241468165 IKYHERZSWGMAPP-NKWVEPMBSA-N 196.015 -2.193 50 10 AAGE Cc1cc(B(O)O)c(F)c(C(N)=O)c1 2241480479 LBAAMCRQSVZPHM-UHFFFAOYSA-N 196.974 -1.087 50 10 AAGE NNC(=O)[C@H]1C[C@H](B(O)O)C1 2241495091 GWXLBWODZPXYIB-JPYJGEKTSA-N 157.966 -1.771 50 10 AAGE CCC(=O)NNC(=O)[C@H](C)N 49804688 OZYRJLIZCWPAIP-BYPYZUCNSA-N 159.189 -1.109 50 10 AAGE NNC(=O)Cc1cc(=O)[nH]cn1 146100142 DRTXMVBWQIMFGB-UHFFFAOYSA-N 168.156 -1.698 50 10 AAGE NNC(=O)[C@H](O)[C@H](O)CO 206699903 DABFVTGKRSUBNK-PWNYCUMCSA-N 150.134 -3.310 50 10 AAGE O=CC1=C[C@H]2O[C@H]1[C@@H]1C(=O)NC(=O)[C@@H]21 238706135 QLXTWVJINCBDIY-XZBKPIIZSA-N 193.158 -1.219 50 10 AAGE CN(C)C(=O)NCB(O)O 575563158 GPGWFNQWGPFGFB-UHFFFAOYSA-N 145.955 -1.730 50 10 AAGE CCCS(=O)(=O)NCB(O)O 701952991 YGNUHDLNVGNLNC-UHFFFAOYSA-N 181.022 -1.672 50 10 AAGE C[C-]1C#CN(CC(=O)NN)N1 885247655 KLCMROJHZKBUGQ-UHFFFAOYSA-N 153.165 -1.691 50 10 AAGE CN(C)NC(=O)[C@H](CN)CO 1880335163 CUZYEAZDUVRTOM-RXMQYKEDSA-N 161.205 -1.854 50 10 AAGE OB(O)c1ncn2c1CCCC2 1881081382 JTFUWILOHURVAX-UHFFFAOYSA-N 165.989 -1.101 50 10 AAGE NNC(=O)CN1CC=CC[C@H]1CO 1881716430 UEYHFSVYHXJMQL-ZETCQYMHSA-N 185.227 -1.401 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@H]1[C@@H]2CO 1884057331 MPZAACGGYPBCHM-QYNIQEEDSA-N 185.227 -1.711 50 10 AAGE CN(NC1=N[C@H]2C[C@@H]2N1)C(N)=O 1923850161 FPSYPJJZDBNKSG-IMJSIDKUSA-N 169.188 -1.398 50 10 AAGE NNC(=O)CN1CC[C@H](O)C2(CC2)C1 1930176368 XANKVVNWGQYFFM-ZETCQYMHSA-N 199.254 -1.177 50 10 AAGE CN1CCN(CC(=O)NN)[C@@H]2CC[C@@H]21 1956636739 KMAXCLBBEJMASG-JGVFFNPUSA-N 198.270 -1.245 50 10 AAGE Cc1nc(NC(=O)C#CB(O)O)no1 2241471957 OAGLPXQXWHLELX-UHFFFAOYSA-N 194.943 -1.668 50 10 AAGE CC(=O)NNC(=O)C1(B(O)O)CC1 2241472945 AEZGGIHSFFLYKX-UHFFFAOYSA-N 185.976 -1.839 50 10 AAGE NNC(=O)CNC(=O)O 117581784 AUEONSKHUQREQN-UHFFFAOYSA-N 133.107 -1.756 50 10 AAGE O[Si](O)(O)CCl 197072731 FGCRPGMPRPUCPQ-UHFFFAOYSA-N 128.587 -1.320 50 10 AAGE C#CC[C@H](N)B(O)O 219633193 MCNJJHBMXSXKSA-BYPYZUCNSA-N 112.925 -1.651 50 10 AAGE CC(C)NNC(=O)[C@@H](N)[C@@H](C)O 238196960 SIDGJGKJWHMEIW-RITPCOANSA-N 175.232 -1.276 50 10 AAGE O=Cc1ncc(CO)cc1B(O)O 238728772 RRADSXJRQNMVHH-UHFFFAOYSA-N 180.956 -1.934 50 10 AAGE CN(CCCCO)CC(=O)NN 384779973 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AAGE Cn1nccc(B(O)O)c1=O 2208960788 MRVSIJJKXBWVAD-UHFFFAOYSA-N 153.934 -2.540 50 10 AAGE O=C(c1ccoc1B(O)O)N1CCC1 2241467889 CROLPXPNTNPCHK-UHFFFAOYSA-N 194.983 -1.195 50 10 AAGE NNC(=O)[C@H]1C[C@@H](B(O)O)C1 2241474587 GWXLBWODZPXYIB-ZXZARUISSA-N 157.966 -1.771 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C=CCNC1 2241478610 IXEUDZJXBLGDFV-ZETCQYMHSA-N 193.999 -2.354 50 10 AAGE OB(O)c1nc2nccnc2s1 2241550128 SUNYSEMARKFQBU-UHFFFAOYSA-N 180.985 -1.234 50 10 AAGE C[C@H](CO)C(=O)NCC=CB(O)O 2241578877 QONNPWOMCHVARG-ZCFIWIBFSA-N 187.004 -1.701 50 10 AAGE NNC(=O)CC[C@@H]1CNCCO1 2242393300 KAHAJXFNDSFEDV-ZCFIWIBFSA-N 173.216 -1.255 50 10 AAGE CNCCN(C)CCCC(=O)NN 69801867 SJFKPDXOORLFTA-UHFFFAOYSA-N 188.275 -1.092 50 10 AAGE Nc1cc(B(O)O)ccc1O 204752771 IEMTZWFOBDOUEK-UHFFFAOYSA-N 152.946 -1.346 50 10 AAGE C[C@H](O)CN(C)[C@H](C)C(=O)NN 251094185 KYVCTRUMZLPWRG-NTSWFWBYSA-N 175.232 -1.323 50 10 AAGE C[C@H]1COC[C@@H](C(=O)NN)N1C 306718287 HDEDHOHEKFUXCP-WDSKDSINSA-N 173.216 -1.305 50 10 AAGE 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NC(=O)NNC(=O)c1ccc(=O)[nH]c1 236183384 CZWAXLOMNRUKNE-UHFFFAOYSA-N 196.166 -1.312 50 10 AAGE CCOC(=O)N/N=C(/N)C(=O)NC 238265621 HAZGUCHTIFYXAV-UHFFFAOYSA-N 188.187 -1.249 50 10 AAGE CNC(=O)NNC(=O)C1COC1 306842342 BWRQRGCEHWEHHT-UHFFFAOYSA-N 173.172 -1.407 50 10 AAGE OB(O)c1ccn(C[C@H]2CCCO2)n1 694277914 VSECCQAHXVGZLM-SSDOTTSWSA-N 196.015 -1.258 50 10 AAGE C/C=C/[C@@H](O)C(=O)NN(C)C(N)=O 901276822 BMXBXNCFGRNFBW-QLSVQJPWSA-N 187.199 -1.035 50 10 AAGE CN(CC(=O)NN)C1(C)COC1 1881653047 NKLJWSMQKIOYGX-UHFFFAOYSA-N 173.216 -1.303 50 10 AAGE COC(=O)c1cc(B(O)O)cn1C 1882336239 MFLDQNAAMJYXTJ-UHFFFAOYSA-N 182.972 -1.509 50 10 AAGE COC[C@@H]1C[C@H]1C(=O)NNC(N)=O 1882998558 WLYUQEWTKGRJLI-CRCLSJGQSA-N 187.199 -1.032 50 10 AAGE NNC(=O)C(=O)N1CCC[C@@H]2C[C@H]21 1916275676 GYGVQRCKMJPVKY-PHDIDXHHSA-N 183.211 -1.013 50 10 AAGE OB(O)CN=c1[nH]cncc1Cl 1923811953 MGSQCAUPVPMWGI-UHFFFAOYSA-N 187.395 -1.024 50 10 AAGE COCCOC(=O)NNCCO 1929841645 IYBWOBCEDDAJLB-UHFFFAOYSA-N 178.188 -1.144 50 10 AAGE N#C[C@H](O)[C@@H](N)c1nc(O)nc(O)n1 1953071262 LYYDVTSVZWBDKN-STHAYSLISA-N 197.154 -1.833 50 10 AAGE NNC(=O)[C@]1(N)CCCOC1 1953309613 IQWIRCYKOADIBX-LURJTMIESA-N 159.189 -1.516 50 10 AAGE CN(C)C[C@H]1CCN1CC(=O)NN 1954509390 MUFYQHHFLBMAQH-SSDOTTSWSA-N 186.259 -1.388 50 10 AAGE N#CCNC(=O)c1occc1B(O)O 2241480256 GUYYDPQLCMDIBJ-UHFFFAOYSA-N 193.955 -1.787 50 10 AAGE O=C(NCC#CCO)C1(B(O)O)CC1 2241481199 PUQPXMFEZRTMLF-UHFFFAOYSA-N 196.999 -1.895 50 10 AAGE C[C@H]1CC(=O)N(CC(=O)NN)C1=O 110505375 FHOAZDBGAFFTBJ-BYPYZUCNSA-N 185.183 -1.629 50 10 AAGE OCc1cccc2oc(B(O)O)nc12 307496084 NCXYCXZRSSMFFQ-UHFFFAOYSA-N 192.967 -1.000 50 10 AAGE NC(=O)NN=C/C=C/NCC(=O)O 379333662 KECSEDOVKINKPT-SYXWNFKLSA-N 186.171 -1.172 50 10 AAGE CSCC[C@H](O)C(=O)NNC=O 388420608 HKIPIMLDWNFQIU-YFKPBYRVSA-N 192.240 -1.122 50 10 AAGE N[C@@H]1N[C@H](Cl)[C@H]2CCN[C@@H]2N1 585665126 ODARHCRZUCREHU-JGWLITMVSA-N 176.651 -1.078 50 10 AAGE Cn1cc(B(O)O)c(OC(F)F)n1 1887712368 KNIUMZDMQNSGDR-UHFFFAOYSA-N 191.930 -1.299 50 10 AAGE COC(=O)[C@H](N)CC(=O)NN 1913584795 QNJQTXWTJCGUQH-GSVOUGTGSA-N 161.161 -2.133 50 10 AAGE O=C(NCB(O)O)[C@@H]1CC=CCO1 1931602932 BSUJRYSQKWDDLY-LURJTMIESA-N 184.988 -1.540 50 10 AAGE NNC(=O)C1CC2(CNC2)C1 1931919226 KGKBNJGVODBRLP-UHFFFAOYSA-N 155.201 -1.024 50 10 AAGE NNC(=O)CN1CC[C@]2(CCO2)C1 1932811779 HDAUUESQKYZENL-QMMMGPOBSA-N 185.227 -1.159 50 10 AAGE C[C@H]([C@@H](N)[C@@H](O)C#N)S(C)(=O)=O 1952838311 IWXMYGXXLJYVHT-NGJCXOISSA-N 192.240 -1.369 50 10 AAGE NNC(=O)[C@@H]1C[C@@H](N)[C@@H]2C[C@H]12 1953201696 AYUGSVNUXYTPAE-SLPGGIOYSA-N 155.201 -1.040 50 10 AAGE NNC(=O)N1CC(=O)N2CCC[C@H]2C1 1955212405 ZLHNMSRAXUSEJO-LURJTMIESA-N 198.226 -1.124 50 10 AAGE NC(=O)C1(NC(=O)C#CB(O)O)CC1 2241468000 FSGIAEIXXWCZTD-UHFFFAOYSA-N 195.971 -2.864 50 10 AAGE NNC(=O)c1cc(B(O)O)ccc1O 2241489369 CGTVUWSREXCXOK-UHFFFAOYSA-N 195.971 -2.325 50 10 AAGE CC1(OCC(=O)NN)COC1 2242122064 LTKJTFDKIRTFIC-UHFFFAOYSA-N 160.173 -1.218 50 10 AAGE N#C[C@H](O)c1cn(CCO)nn1 117139290 XCRSOSYEPKZSAG-LURJTMIESA-N 168.156 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AAGE NNC(=O)N1CC[C@@H]1C(N)=O 757151932 XUUWFRITLPKMAP-GSVOUGTGSA-N 158.161 -1.871 50 10 AAGE NNC(=O)N1C[C@H]2C(C(N)=O)[C@@H]2C1 1883971750 WZUZBQWRYYZYJC-QWWZWVQMSA-N 184.199 -1.767 50 10 AAGE CN(C)NC(=O)C1(CO)CNC1 1953688380 JPTCKTZQHPCFAY-UHFFFAOYSA-N 173.216 -1.839 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2C[C@H](C1)C2O 1957010208 PHRMLJVRVJLURZ-QBARFFCXSA-N 199.254 -1.323 50 10 AAGE O=C(C#CB(O)O)NC1CC(CO)C1 2241468555 QIIVXBVDWRDWSF-UHFFFAOYSA-N 196.999 -2.111 50 10 AAGE NCCNC(=O)c1n[nH]cc1B(O)O 2241474963 NZUNTWNFFPDRCE-UHFFFAOYSA-N 197.991 -3.222 50 10 AAGE C[C@H](CN)CNC(=O)C#CB(O)O 2241475620 BFIBJSHXSSCFRW-ZCFIWIBFSA-N 184.004 -2.287 50 10 AAGE CON(C)C(=O)C#CB(O)O 2241479256 UVNVPDQMGGXNFW-UHFFFAOYSA-N 156.934 -1.978 50 10 AAGE CC(=O)NNC(=O)[C@H]1C[C@H]1B(O)O 2241479586 BDNZVQPFDHBAQI-CRCLSJGQSA-N 185.976 -1.983 50 10 AAGE NNC(=O)c1nnc(=S)[nH]c1O 17380711 VZGGVZUQGNXOPX-UHFFFAOYSA-N 187.184 -1.157 50 10 AAGE N#C[C@@H](O)CC(N)=O 117650007 GIKFLCHIFSBFSL-VKHMYHEASA-N 114.104 -1.254 50 10 AAGE COC(=O)/C(C#N)=C1/NCCNC1=O 210624043 WXUHHLQJTXCKLI-AATRIKPKSA-N 195.178 -1.344 50 10 AAGE O[C@H](CCl)CN1C[C@H](O)[C@H](O)C1 236551886 OBNCKRPKADTZHT-QYNIQEEDSA-N 195.646 -1.377 50 10 AAGE C/C(=N\NC(=O)C(N)=O)C(=O)O 238029388 VEMPJCLHPKIGOQ-FARCUNLSSA-N 173.128 -1.952 50 10 AAGE NNC(=O)C1CCN(CCO)CC1 238654947 IHFUINRKZSLGDC-UHFFFAOYSA-N 187.243 -1.319 50 10 AAGE CN1C[C@H](NC(=O)NN)CC1=O 307538089 WCJNVHLGECUFFK-SCSAIBSYSA-N 172.188 -1.610 50 10 AAGE NC(=O)NN=C[C@@H](N)CO 307848049 WWSPMOAJFMYVOQ-GSVOUGTGSA-N 146.150 -2.040 50 10 AAGE O=C1N=C=C(B(O)O)C(=O)N1 616579567 LQCFZWZTQHPKHN-UHFFFAOYSA-N 153.890 -2.156 50 10 AAGE N=c1cc(B(O)O)nc[nH]1 1880031648 UGBRPTADIZXIKS-UHFFFAOYSA-N 138.923 -2.431 50 10 AAGE OB(O)c1ccn2nncc2c1 1881008389 GFYOUHOAXGHDKU-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE CN(C)NC(=O)[C@@H]1[C@@H]2NCCO[C@@H]21 1929944536 DRBDIBUOMXAUED-DSYKOEDSSA-N 185.227 -1.434 50 10 AAGE C[C@]1(O)CON(CCC(=O)NN)C1 1930292159 VVCPVMKTRHONON-SSDOTTSWSA-N 189.215 -1.635 50 10 AAGE NNC(=O)C1(CN2CCC2=O)CC1 1931266612 IDEKCBCKTGMHTM-UHFFFAOYSA-N 183.211 -1.011 50 10 AAGE N#CC1CN(C(=O)NNCCO)C1 1954818593 BRLQAYNURMUANB-UHFFFAOYSA-N 184.199 -1.352 50 10 AAGE OB(O)c1ccnc(N2CC(O)C2)c1 2210068647 XABMYUKWTRAOFY-UHFFFAOYSA-N 193.999 -2.058 50 10 AAGE C[C@H](F)CCNC(=O)C#CB(O)O 2241469034 YZPMYPRVYPGSKQ-LURJTMIESA-N 186.979 -1.134 50 10 AAGE O=C(NCC1(O)CC1)[C@@H]1C[C@@H]1B(O)O 2241494773 CSWJHCGNTGSZSS-RITPCOANSA-N 199.015 -1.510 50 10 AAGE NNC(=O)[C@@H]1CCCC[C@]1(O)NN 104553109 YNLURNLSZXYBHR-CAHLUQPWSA-N 188.231 -1.682 50 10 AAGE N#CCC(=O)N(N)C(=O)CCC(=O)O 140574009 MFKLTPYULGVQJZ-UHFFFAOYSA-N 199.166 -1.006 50 10 AAGE CC[C@@H](C(=O)NN)N1CC[C@@H](O)C1 216476356 SFAVXXWFBHKFMX-RQJHMYQMSA-N 187.243 -1.179 50 10 AAGE COC(=O)/C(C#N)=C(\N)CC(N)=O 217428662 QMCAKTQROCYYDG-PLNGDYQASA-N 183.167 -1.229 50 10 AAGE NNC(=O)[C@H](O)[C@@H](O)C(N)=O 238556209 BYRHQFFLRWQHOK-JCYAYHJZSA-N 163.133 -3.817 50 10 AAGE COc1cc(NN)cc(B(O)O)c1 306980879 PUPGVTJZFCHXPD-UHFFFAOYSA-N 181.988 -1.339 50 10 AAGE NNc1c(F)cccc1B(O)O 307042939 SKOUSYMSMXVKQP-UHFFFAOYSA-N 169.952 -1.209 50 10 AAGE O=C(NCB(O)O)c1cc[nH]n1 702008877 XLTHADQUHZVWPU-UHFFFAOYSA-N 168.949 -1.849 50 10 AAGE CC#CC(=O)NNC(N)=S 705987874 CSONQFBEOGUHMX-UHFFFAOYSA-N 157.198 -1.126 50 10 AAGE N#CCC(=O)NNC(=O)c1ncon1 1157783570 ORDHWSFWAGKJLD-UHFFFAOYSA-N 195.138 -1.256 50 10 AAGE C=Cn1cc(B(O)O)cn1 1880031521 SEZDRZARHWXTCD-UHFFFAOYSA-N 137.935 -1.337 50 10 AAGE CON(C(=O)C#CB(O)O)C(C)C 2241468235 JTXUBKMGEFAKHW-UHFFFAOYSA-N 184.988 -1.200 50 10 AAGE N[C@@H]1CCCN(C(=O)C#CB(O)O)C1 2241468886 WKMDSECZRBRHAS-SSDOTTSWSA-N 196.015 -2.049 50 10 AAGE Cn1ncc(C(N)=O)c1B(O)O 2241481399 RZGDYGWHSMGOKI-UHFFFAOYSA-N 168.949 -2.801 50 10 AAGE O=C(c1cc(B(O)O)co1)N1CCC1 2241747794 GCNKRMDETQWUOS-UHFFFAOYSA-N 194.983 -1.195 50 10 AAGE OC[C@H]1O[C@H](O)[C@H](Cl)[C@@H](O)[C@H]1O 44608300 SNGNCYILSHZBLM-DVKNGEFBSA-N 198.602 -1.975 50 10 AAGE Cc1cc(=O)n(CCC(=O)NN)cn1 82468562 XSIOBFNYORPSFB-UHFFFAOYSA-N 196.210 -1.068 50 10 AAGE O[C@@H]1[C@@H](CCl)O[C@@H](O)[C@H]1O 212044803 BFLITKCZBOUHRA-SQOUGZDYSA-N 168.576 -1.336 50 10 AAGE O=C(CCB(O)O)N1CCOCC1 231386851 PGMLCDJEUNKDAH-UHFFFAOYSA-N 187.004 -1.292 50 10 AAGE Cc1cc(NC(=O)C(=O)NN)nn1C 300916758 GDBAEXQBTPITKI-UHFFFAOYSA-N 197.198 -1.343 50 10 AAGE CC(=O)N1C[C@@H](F)C[C@H]1C(=O)NN 306745112 ZNPWPEFPRLOPFS-WDSKDSINSA-N 189.190 -1.065 50 10 AAGE CO[C@H](C)CN(C)C(=O)C(=O)NN 379347493 HGRMIIZMDHRXRL-RXMQYKEDSA-N 189.215 -1.530 50 10 AAGE CC1(O)CN(CCCC(=O)NN)C1 394903520 DKYCGYYFNAWIGA-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE O=C1CN=C2N[C@@H](Cl)NC[C@@H]2N1 605700473 ZHDXVJCBZUMXAE-DZSWIPIPSA-N 188.618 -1.402 50 10 AAGE OB(O)c1ccn(CCOC2CC2)n1 711747127 YUYGDALLMFXEQG-UHFFFAOYSA-N 196.015 -1.258 50 10 AAGE O=C(NCC#CB(O)O)[C@@]12CC[C@@H]1C2 1877555586 DNLOGRJDMRIYCN-VXNVDRBHSA-N 193.011 -1.082 50 10 AAGE OB(O)c1cncnc1OCCF 1882526321 PDCBLLUFBPGNCV-UHFFFAOYSA-N 185.951 -1.495 50 10 AAGE O=C(CCn1ccnn1)NNCCO 1929835305 QLCYBDISPOPDMF-UHFFFAOYSA-N 199.214 -1.719 50 10 AAGE CN(C)NC(=O)[C@@H]1CNC[C@@H](O)C1 1934304547 FJMDCOSEPWSBHI-BQBZGAKWSA-N 187.243 -1.450 50 10 AAGE CO[C@@H]1C[C@@]2(C(=O)NCB(O)O)C[C@H]12 1935498576 BOVXCJCKIVVYCD-JKMUOGBPSA-N 199.015 -1.460 50 10 AAGE CN1CCC(N)(B(O)O)CC1 1953251938 RHGXDUJNEINFTF-UHFFFAOYSA-N 158.010 -1.579 50 10 AAGE CC1(C)CNC[C@@H](C(=O)NN)O1 1953516966 LZUUYEWEXPOIAE-YFKPBYRVSA-N 173.216 -1.257 50 10 AAGE NCCCNc1ncccc1B(O)O 2210068225 OHANXXFYUODSES-UHFFFAOYSA-N 195.031 -1.478 50 10 AAGE CNC(=O)[C@H]1C[C@H]1B(O)O 2241495222 HPBNRSFGDORTPK-IUYQGCFVSA-N 142.951 -1.405 50 10 AAGE NNC(=O)Cn1nncc1O 100468221 VOMQLSBJPIPVFY-UHFFFAOYSA-N 157.133 -2.026 50 10 AAGE C/C(=N\NC(N)=O)C(=O)NO 307162197 HATGKHONDQPODD-QHHAFSJGSA-N 160.133 -1.464 50 10 AAGE NNC(=O)/C=C\CC(=O)NN 388149005 KDWJPLHYVIJNPE-UPHRSURJSA-N 158.161 -2.088 50 10 AAGE CCC1CN(C(=O)C(=O)NN)C1 698604111 YLWLSYLJQHSPPE-UHFFFAOYSA-N 171.200 -1.155 50 10 AAGE CC(C)[C@@H](N)C(=O)NCC(=O)NN 713730007 GJSKKADQZCSHRQ-ZCFIWIBFSA-N 188.231 -1.924 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@H]1CO2 718286639 MPASBDODXSZKGZ-WDSKDSINSA-N 171.200 -1.551 50 10 AAGE CC(C)(F)CNC(=O)C(=O)NN 1953352730 SRMSBGCHFNVOQK-UHFFFAOYSA-N 177.179 -1.159 50 10 AAGE N#CNC(=O)c1ccc(B(O)O)s1 2241468839 VQXMPAPDWJJCNN-UHFFFAOYSA-N 195.996 -1.361 50 10 AAGE CCCNCCNC(=O)C#CB(O)O 2241479212 UBJOYCVBMRVXGJ-UHFFFAOYSA-N 198.031 -1.882 50 10 AAGE NNC(=O)[C@H]1C[C@@H]1C(N)=O 2241522865 NIEZPWIROXXJBA-HRFVKAFMSA-N 143.146 -1.902 50 10 AAGE C#CC(=O)N[C@H]1CCC=C1B(O)O 2241558113 DWUXWOFKYZYRHB-ZETCQYMHSA-N 178.984 -1.163 50 10 AAGE CN(CC1COC1)C(=O)C(=O)NN 2241654701 BLYNDXVIFPUSER-UHFFFAOYSA-N 187.199 -1.919 50 10 AAGE CN(C)CCN(C)CCC(=O)NN 58838390 BCCZDBBLGRCRJE-UHFFFAOYSA-N 188.275 -1.140 50 10 AAGE NNC(=O)C1COC1 211606070 MKYUXZZXOHOWCT-UHFFFAOYSA-N 116.120 -1.377 50 10 AAGE O=C[C@H](O)[C@H](Cl)[C@@H](O)[C@H](O)CO 307915808 JWYWFHQMFHJVRH-FSIIMWSLSA-N 198.602 -2.132 50 10 AAGE CC(=O)NNC(=O)c1n[nH]cc1N 1883133032 MZRGMWTVBZEWSS-UHFFFAOYSA-N 183.171 -1.227 50 10 AAGE OB(O)[C@H]1CCN(C[C@@H](O)CF)C1 1891517595 QIFUMPQQCPBLTO-BQBZGAKWSA-N 191.011 -1.135 50 10 AAGE CC1(Cn2ccc(B(O)O)n2)COC1 1895522607 IMLFFWRCLRVILM-UHFFFAOYSA-N 196.015 -1.401 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@@H]1CO 1929742131 VHGGTAMFIRGJGV-NTSWFWBYSA-N 173.216 -1.569 50 10 AAGE ONc1ncccc1B(O)O 2208978439 NWRDKEYYQAURHS-UHFFFAOYSA-N 153.934 -1.438 50 10 AAGE CCOC[C@@H](C)NC(=O)C#CB(O)O 2241478414 DUUWLOXFTWDTGW-SSDOTTSWSA-N 199.015 -1.457 50 10 AAGE C[C@H](NC(=O)NN)C(=O)N(C)C 42576281 NKJXZGANQIEYCF-BYPYZUCNSA-N 174.204 -1.364 50 10 AAGE C[C@H](C(=O)NN)n1[nH]c(=O)ccc1=O 82468554 XAHHEWMLZMTUOK-SCSAIBSYSA-N 198.182 -1.913 50 10 AAGE C[C@](O)(C#N)CC(=O)NN 140203451 MTZZVNDROXPBIM-RXMQYKEDSA-N 143.146 -1.359 50 10 AAGE C[C@H](C[S@@](C)=O)NC(=O)NN 229034908 AGVYQVGURXBSAC-IOHHNLJHSA-N 179.245 -1.074 50 10 AAGE CO[C@@H]1CCN(CC(=O)NN)C1 234822427 RBEWMSPCTLUNEZ-ZCFIWIBFSA-N 173.216 -1.303 50 10 AAGE Cc1nn(C)c(B(O)O)c1F 306390876 XUWSDHPRKOQOKB-UHFFFAOYSA-N 157.941 -1.453 50 10 AAGE NNC(=O)C(=O)NCCc1ccoc1 692776920 GQFHEEVYWFSKNT-UHFFFAOYSA-N 197.194 -1.072 50 10 AAGE OB(O)COCB(O)O 707913171 RUZXWHUPPHZYQV-UHFFFAOYSA-N 133.705 -2.973 50 10 AAGE Cc1conc1C(=O)NCB(O)O 720525242 LKOGQZKHUAMMIL-UHFFFAOYSA-N 183.960 -1.275 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@H]1C(N)=O 757145172 KSYKAKQSHWLLJO-WHFBIAKZSA-N 186.215 -2.076 50 10 AAGE N#CC1=C(O[C@H]2CNOC2)NNC#C1 885589564 MPWKOMKCYAMANE-ZETCQYMHSA-N 192.178 -1.290 50 10 AAGE O=C(NCC#CB(O)O)NCC1CC1 1895049345 LDTBINQNUYIZLA-UHFFFAOYSA-N 196.015 -1.289 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@@H]1CO 1929742133 VHGGTAMFIRGJGV-PHDIDXHHSA-N 173.216 -1.569 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@H]2OCC[C@@H]12 1931663976 ZCQNEBNDSKFBDE-KVQBGUIXSA-N 199.210 -1.730 50 10 AAGE C[C@H](C(=O)NN)N1CCC12COC2 1954052764 PFRZWVXHLYNPET-ZCFIWIBFSA-N 185.227 -1.161 50 10 AAGE CCCOc1ncncc1B(O)O 1954085612 GRAOQWHQORHPQA-UHFFFAOYSA-N 181.988 -1.055 50 10 AAGE NNC(=O)[C@@H]1CN[C@@H]2CCOC[C@H]2C1 1968304876 QBHSVVFNKGGUOQ-XLPZGREQSA-N 199.254 -1.009 50 10 AAGE C[C@@H](CN)Nc1cc(B(O)O)ccn1 2210068455 SKGUDJGPYHETIM-LURJTMIESA-N 195.031 -1.480 50 10 AAGE C[C@H](N)[C@@H](C)NC(=O)C#CB(O)O 2241468700 SPKIUSAKJPLKLF-NTSWFWBYSA-N 184.004 -2.146 50 10 AAGE CN[C@@H](C)CCNC(=O)C#CB(O)O 2241479285 VQGIHRLAHUAYFO-ZETCQYMHSA-N 198.031 -1.884 50 10 AAGE NNC(=O)CN1CCC[C@@H](N)C1 82470164 AHFIJERXZFPEGN-ZCFIWIBFSA-N 172.232 -1.601 50 10 AAGE OB(O)c1cocc1B(O)O 306965328 NKZABPLTDFDWLW-UHFFFAOYSA-N 155.711 -3.361 50 10 AAGE O[C@H](CCl)[C@@H](O)[C@H](O)[C@@H]1CO1 307737144 DQODCZOZAFGOJJ-JGWLITMVSA-N 182.603 -1.293 50 10 AAGE CCONCC(=O)NNC(C)=O 308145730 KBKCUWYPIIUXCW-UHFFFAOYSA-N 175.188 -1.305 50 10 AAGE NNC(=O)CN1CC2(COC2)C1 697131541 CGJMVNZIABQPIP-UHFFFAOYSA-N 171.200 -1.692 50 10 AAGE O=C(Cc1ccccn1)NCB(O)O 702029966 LISNYIDFESCQBS-UHFFFAOYSA-N 193.999 -1.248 50 10 AAGE NNC(=O)CN1C[C@H](F)[C@@H](F)C1 714557924 JJPGVSCBEFYDEH-WHFBIAKZSA-N 179.170 -1.032 50 10 AAGE NNC(=O)N1CC[C@H]1C(N)=O 757151940 XUUWFRITLPKMAP-VKHMYHEASA-N 158.161 -1.871 50 10 AAGE Cc1nocc1C(=O)NNC(=O)CO 1654451141 SKGSHMVWILGMDF-UHFFFAOYSA-N 199.166 -1.264 50 10 AAGE NNC(=O)N[C@H](C(N)=O)C1CC1 1932381055 KIQDXYPTDTWRRC-BYPYZUCNSA-N 172.188 -1.577 50 10 AAGE NNC(=O)[C@]1(N)CCS(=O)(=O)C1 1953710207 SJJKEKUQIUKVMH-YFKPBYRVSA-N 193.228 -2.508 50 10 AAGE NNC(=O)CN1CC[C@H]1c1ncon1 1955512366 FZMPSTLCMYYYAA-YFKPBYRVSA-N 197.198 -1.194 50 10 AAGE C#CCN(C)c1ccc(B(O)O)cn1 2210061806 YMZGHEIDIVVWBE-UHFFFAOYSA-N 190.011 -1.169 50 10 AAGE NNC(=O)[C@@H]1CO[C@@H]2CNC[C@H]2O1 2241299619 FEOSMCVMTZNMHQ-PBXRRBTRSA-N 187.199 -2.268 50 10 AAGE CSC1CN(C(=O)C#CB(O)O)C1 2241479001 PMVREMCDHSCAAM-UHFFFAOYSA-N 199.040 -1.424 50 10 AAGE CCO[C@@H](C)CNC(=O)C(=O)NN 164040613 NRHSAYKGVFGTSD-YFKPBYRVSA-N 189.215 -1.483 50 10 AAGE COC(=O)C(C#N)=C(N)N 215201340 RCWFGWQXJDYRNE-UHFFFAOYSA-N 141.130 -1.188 50 10 AAGE NNC(=O)OC[C@H](O)CO 238662725 VIVATWVIWOMZLZ-GSVOUGTGSA-N 150.134 -2.061 50 10 AAGE O=C1O[C@H](CO)[C@@H](O)[C@H]1Cl 306229550 HCPFLJPXBRSDPJ-BXXZVTAOSA-N 166.560 -1.128 50 10 AAGE CNNC(=O)c1nn[nH]n1 575458334 IWWNOVAEOHFPSO-UHFFFAOYSA-N 142.122 -1.936 50 10 AAGE N#C[C@H](O)[C@H]1CNCCO1 1880121161 OSPAPYZOHAITAV-NTSWFWBYSA-N 142.158 -1.141 50 10 AAGE O=C(F)NCC(CO)(CO)CO 1881054382 BEWLTPRQSBIPNU-UHFFFAOYSA-N 181.163 -1.371 50 10 AAGE NNC(=O)[C@@]12CO[C@@H](CN1)C2 1923842983 WSICMPYWSVIXJS-INEUFUBQSA-N 157.173 -1.893 50 10 AAGE Cc1nc(C(=O)NNCCO)n[nH]1 1929831342 AIPUEXJGTAZBQP-UHFFFAOYSA-N 185.187 -1.660 50 10 AAGE COC1([C@H](N)B(O)O)CCOCC1 1931460986 JBMLHURKWZJGHN-LURJTMIESA-N 189.020 -1.479 50 10 AAGE CCON(C)c1ncc(B(O)O)cn1 1956960005 AATPBKZGRYUVNJ-UHFFFAOYSA-N 197.003 -1.456 50 10 AAGE CNCCOc1ccc(B(O)O)cn1 2210066709 WYLHDLOOZPGUNW-UHFFFAOYSA-N 196.015 -1.640 50 10 AAGE CCCOCCNC(=O)C#CB(O)O 2241468212 JEKGYTOGTRLQIH-UHFFFAOYSA-N 199.015 -1.455 50 10 AAGE CO[C@@H]1C[C@@H]1NC(=O)C#CB(O)O 2241471391 JBQZVJKXROOFAI-NTSWFWBYSA-N 182.972 -2.095 50 10 AAGE CNCCNC(=O)[C@H]1C[C@@H]1B(O)O 2241481951 XRFCVXAYVSTHOH-WDSKDSINSA-N 186.020 -1.815 50 10 AAGE O=C([C@H]1C[C@@H]1B(O)O)N1CCNCC1 2241495026 GCAAWPSGLTXPAZ-BQBZGAKWSA-N 198.031 -1.719 50 10 AAGE COCCN(C)[C@H](C)C(=O)NN 82470593 LCQXVCWYADDHOD-ZCFIWIBFSA-N 175.232 -1.057 50 10 AAGE Cc1n[nH]c(C(=O)NN)n1 87445603 SFVLQYWMUCPORB-UHFFFAOYSA-N 141.134 -1.283 50 10 AAGE CN(C)NC(=O)[C@]1(C)COC[C@H]1N 147287493 MDEAWKRUTKNDFB-HTRCEHHLSA-N 187.243 -1.057 50 10 AAGE O=C/C(O)=C(/O)[C@@H](O)CO 393563484 XWBKCRSHNITEJC-BNWFAOCJSA-N 148.114 -1.134 50 10 AAGE N[C@@H]1N[C@H](Cl)N[C@@H]2NCN[C@H]21 585663898 IDFMJJJXQBRRKV-QTBDOELSSA-N 177.639 -2.169 50 10 AAGE CN1CC[C@H](C[N+]2=C=C(C=O)NN2)C1 885687850 GXMRLQKAMSFECT-QMMMGPOBSA-N 195.246 -1.274 50 10 AAGE NNC(=O)CN1CC[C@@H](O)[C@H](O)C1 1882908079 VDOMZIHVOVGCEP-PHDIDXHHSA-N 189.215 -2.596 50 10 AAGE CONCC(=O)NN 1953129102 ZHTICHCFRGRICI-UHFFFAOYSA-N 119.124 -1.873 50 10 AAGE C=C(C)CONC(=O)C#CB(O)O 2241479410 XMKGSJSTSLHGKA-UHFFFAOYSA-N 182.972 -1.374 50 10 AAGE NNC(=O)c1occc1B(O)O 2241480154 DYZLPXMYCVRAMV-UHFFFAOYSA-N 169.933 -2.437 50 10 AAGE NNC(=O)CN1C[C@H]2COC[C@H]1C2 2241890268 GGOBBOBMDMBZMA-NKWVEPMBSA-N 185.227 -1.303 50 10 AAGE NNC(=O)CNC=O 1653018 CIRVNJGVWPTMFQ-UHFFFAOYSA-N 117.108 -2.278 50 10 AAGE C[C@@H](O)CNCCC(=O)NN 58848564 DLAXXIFGWKBNSX-RXMQYKEDSA-N 161.205 -1.663 50 10 AAGE COCCNC[C@H](C)C(=O)NN 58853536 DCXNYUNNLVZBMH-LURJTMIESA-N 175.232 -1.152 50 10 AAGE O=C[C@@H](Cl)[C@H](O)S(=O)(=O)O 141304462 FLHGOUWURQMLKC-PWNYCUMCSA-N 188.588 -1.001 50 10 AAGE O=CC1=N[C@@H](B(O)O)C=C1 210406554 KLLAUTNSURDYST-RXMQYKEDSA-N 138.919 -1.423 50 10 AAGE COc1nccc(CN)c1B(O)O 238425159 YRCDNBRWMJUEKF-UHFFFAOYSA-N 181.988 -1.771 50 10 AAGE OB(O)c1ccnc(F)c1O 238630114 JCPQHYIXRUDBBU-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE C[C@@H](NC(N)=O)C(=O)NNC=O 307674038 CEIOGEGHVFYSDG-GSVOUGTGSA-N 174.160 -2.180 50 10 AAGE NNC(=O)CCN1C[C@H]2C[C@@H]2C1=O 715706372 ZNXJSZZWMLZAOX-RITPCOANSA-N 183.211 -1.155 50 10 AAGE N#CC1=C(N2CC[C@H](N)C2)NC#CN1 885540571 DTSHGGIIOPABTN-ZETCQYMHSA-N 189.222 -1.177 50 10 AAGE C=CC[C@H](NC(=O)CO)B(O)O 1923809305 KUASGIVZWLGGCD-YFKPBYRVSA-N 172.977 -1.948 50 10 AAGE Cn1nccc1CNCB(O)O 1923937422 DVPUSXHJKWTFGR-UHFFFAOYSA-N 168.993 -1.478 50 10 AAGE NNC(=O)[C@@H]1C[C@H]2CNC[C@@H]21 1951339448 JYTSGFDUXSBHTC-JKUQZMGJSA-N 155.201 -1.168 50 10 AAGE C[C@@H]([C@@](C)(N)B(O)O)S(C)(=O)=O 1953677421 DMCXRBWAHFSECF-CRCLSJGQSA-N 195.049 -1.851 50 10 AAGE OB(O)c1cnccc1-n1cncn1 1956966384 ULTJRLPDKVNDEU-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE NNC(=O)CN1CC[C@H](F)C1=O 2297006791 AVSVVOUZBLWDAD-BYPYZUCNSA-N 175.163 -1.453 50 10 AAGE COCC[C@@H](C)NC(=O)C(=O)NN 81721034 HACILNFPGGCRHM-RXMQYKEDSA-N 189.215 -1.483 50 10 AAGE Nc1cc(Cl)cnc1B(O)O 204466614 QMQBKEZDGSJLIR-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE NNC(=O)[C@@H]1CNC(=O)NC1=O 211336409 WMAIISJDUCHWRJ-UWTATZPHSA-N 172.144 -2.568 50 10 AAGE C[C@]1(C(N)=O)CCN(C(=O)NN)C1 235745024 XZIAZBNKJBPRSK-ZETCQYMHSA-N 186.215 -1.233 50 10 AAGE NNC(=O)CN1CC(O)C1 307356978 VVIMWQXTRAONMM-UHFFFAOYSA-N 145.162 -2.347 50 10 AAGE NNC(=O)[C@]12CCOC[C@H]1CNC2 715428108 YLYJOGAXWSWYLQ-SVRRBLITSA-N 185.227 -1.398 50 10 AAGE CC1=C=NO[C-]1C(=O)NCB(O)O 885449130 CAHSPRPVEMMVOV-UHFFFAOYSA-N 182.952 -1.792 50 10 AAGE NNC(=O)N1C[C@@H]2NC(=O)O[C@H]2C1 1881801856 UKPGYSHHCHNXIU-IMJSIDKUSA-N 186.171 -1.638 50 10 AAGE NNC(=O)N1CCO[C@H]2COC[C@H]21 1883207373 DXXJEXLUBIKZTP-RITPCOANSA-N 187.199 -1.331 50 10 AAGE CO[C@@H]1CNC[C@H](C(=O)NN)C1 1934671854 QLWPRYKVXHNCKV-RITPCOANSA-N 173.216 -1.399 50 10 AAGE C[C@H]1C[C@@H](NC(=O)C#CB(O)O)CN1 2241467855 BZDKICVKWMEDET-NKWVEPMBSA-N 196.015 -2.132 50 10 AAGE NC1(CNC(=O)C#CB(O)O)COC1 2241468294 KXTLTBCPKAMFFV-UHFFFAOYSA-N 197.987 -3.154 50 10 AAGE C[C@H]1CN(C(=O)C#CB(O)O)[C@@H]1C 2241468896 WPKBJWHQWIHSSR-NKWVEPMBSA-N 181.000 -1.131 50 10 AAGE NC(=O)[C@H]1C[C@@H](B(O)O)C1 2241475487 YQOGFRRNHNKBMS-ZXZARUISSA-N 142.951 -1.275 50 10 AAGE C=CCNC(=O)c1cc(B(O)O)c[nH]1 2241478220 ALHCCVJQQIXGTI-UHFFFAOYSA-N 193.999 -1.390 50 10 AAGE NC(=S)NNC(=O)/C=C/C(=O)O 59514077 YILAPZAVSVNSEB-OWOJBTEDSA-N 189.196 -1.508 50 10 AAGE 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-2.459 50 10 AAGE NNc1cccc(B(O)O)c1S 307110134 BQDJFVRFVMUWJL-UHFFFAOYSA-N 184.029 -1.059 50 10 AAGE N#C[C@]1(O)C[C@H](O)[C@@H]2O[C@@H]21 307131360 ZZFYRSMSXDWPRD-OMMKOOBNSA-N 141.126 -1.227 50 10 AAGE OB(O)c1cccnc1N1CC(F)C1 1956954391 KYAWJGKCNPNOSO-UHFFFAOYSA-N 195.990 -1.081 50 10 AAGE NCCCN=c1cc(B(O)O)cc[nH]1 2210061688 XPHMVPGBQBYSKJ-UHFFFAOYSA-N 195.031 -2.056 50 10 AAGE Cn1c(O)cn(CC(=O)NN)c1=O 2241373368 OZWQRYUVGYJYNO-UHFFFAOYSA-N 186.171 -2.118 50 10 AAGE NCC=CCNC(=O)C#CB(O)O 2241468136 IBNBWRHPQQUGEW-UHFFFAOYSA-N 181.988 -2.367 50 10 AAGE O=C(C#CB(O)O)NC[C@@H]1CCO1 2241468363 MOZXGOOUFUQRBA-LURJTMIESA-N 182.972 -2.093 50 10 AAGE CCNC(=O)c1cn(C)c(B(O)O)n1 2241480928 MTOGZRPWLIMQOD-UHFFFAOYSA-N 197.003 -2.150 50 10 AAGE CO[C@H]1C[C@@H]1NC(=O)C1(B(O)O)CC1 2241481602 UHYYAWXFENASLZ-WDSKDSINSA-N 199.015 -1.103 50 10 AAGE O=C(CCl)NC(CO)(CO)CO 41674635 CISLJKKJJJAUMY-UHFFFAOYSA-N 197.618 -1.943 50 10 AAGE OC[C@@H](O)[C@@H](O)[C@H](O)CCl 141173012 ITZUYINNFCACKN-WDCZJNDASA-N 170.592 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-1.874 50 10 AAGE NNC(=O)C(=O)NC1[C@@H]2CCC[C@@H]12 1930493050 AAKIAUCOWZRODT-RFZPGFLSSA-N 183.211 -1.109 50 10 AAGE CN1CC[C@H](NC(=O)C#CB(O)O)C1 2241468506 POVAHWWUGZTGBB-ZETCQYMHSA-N 196.015 -2.178 50 10 AAGE O=C(N1CCOC1)C1(B(O)O)CC1 2241474279 ZWIBYNXJBCLDKH-UHFFFAOYSA-N 184.988 -1.190 50 10 AAGE C#CCOC(=O)NCCC#CB(O)O 2241899688 OHQUXUDHZFGTHK-UHFFFAOYSA-N 194.983 -1.249 50 10 AAGE C[C@H](CO)N(C)CCC(=O)NN 123715356 SPCZDIKKVXWDDY-ZCFIWIBFSA-N 175.232 -1.321 50 10 AAGE OB(O)/C=C/[C@@H]1O[C@H](O)[C@@H](O)[C@@H]1O 306393357 DQCSKJVOIMGUKO-JSSOJSOGSA-N 189.960 -3.006 50 10 AAGE Cc1nocc1CNC(=O)C(=O)NN 306584533 QDZZWAJLCLVPHN-UHFFFAOYSA-N 198.182 -1.411 50 10 AAGE COC[C@@H](C(=O)NN)n1ccnn1 710720071 MHMFSFOIUDHVQM-YFKPBYRVSA-N 185.187 -1.545 50 10 AAGE O=C1OC(=O)[C@@H]2OCCO[C@H]12 1857779015 BTCNZQQDMJKBPH-ZXZARUISSA-N 158.109 -1.146 50 10 AAGE C=C[C@]1(O)CCN(CC(=O)NN)C1 1883357365 RCONOSIVIXOPNR-QMMMGPOBSA-N 185.227 -1.401 50 10 AAGE O=C(NCB(O)O)[C@]12C[C@H](CCO1)C2 1892829061 SIGKQGZYBDHXKR-WRXNHJIOSA-N 199.015 -1.316 50 10 AAGE CN(O)C(=O)c1cccc(B(O)O)c1 1897480743 FDDPEHGQYANKNJ-UHFFFAOYSA-N 194.983 -1.172 50 10 AAGE O=C(O)[C@H]1C[C@H]1C(=O)NNCCO 1929832777 YKZKYAWJRWDXLT-UHNVWZDZSA-N 188.183 -1.680 50 10 AAGE CN1CCN(C[C@H](N)[C@H](O)C#N)CC1 1952796988 XLYLINZBBMUADX-DTWKUNHWSA-N 198.270 -1.554 50 10 AAGE CNNC(=O)[C@@H]1CO[C@H]2COC[C@H]12 1954357619 OZPIEGGWXRNQIA-QYNIQEEDSA-N 186.211 -1.102 50 10 AAGE CN1CC2(CCN2CC(=O)NN)C1 2209368211 WLLFNMMPCMEWAO-UHFFFAOYSA-N 184.243 -1.634 50 10 AAGE CC[C@@H](C)NC(=O)C#CB(O)O 2241475850 GTCUYLRKVTZTHP-ZCFIWIBFSA-N 168.989 -1.084 50 10 AAGE NNC(=O)C(=O)NCc1ccon1 88054481 GDSBZJFWBSDXIJ-UHFFFAOYSA-N 184.155 -1.719 50 10 AAGE CCO[C@H](C)CNC(=O)C(=O)NN 164040727 NRHSAYKGVFGTSD-RXMQYKEDSA-N 189.215 -1.483 50 10 AAGE COc1ccn2ncc(B(O)O)c2n1 238369272 AQGBMLXHBUUWMA-UHFFFAOYSA-N 192.971 -1.582 50 10 AAGE C[N+]1=Cc2ccccc2[B-](O)(O)O1 306199892 LAJUJTJQMOBJID-UHFFFAOYSA-N 178.984 -1.177 50 10 AAGE CC1(C)[C@@H](O)CCN1CC(=O)NN 307704203 WRPMBPJTCGAPDE-LURJTMIESA-N 187.243 -1.179 50 10 AAGE C=CCC(=O)NCB(O)O 702021689 BWRKVEWYKSFTAO-UHFFFAOYSA-N 142.951 -1.309 50 10 AAGE CO[C@@H]1CC[C@@]1(N)B(O)O 724162081 QSGZLHMMVFYVPU-UHNVWZDZSA-N 144.967 -1.495 50 10 AAGE NNC(=O)N[C@@H]1COC[C@@H]1F 1880383069 BHNCHJYKRLIYNB-IUYQGCFVSA-N 163.152 -1.104 50 10 AAGE C#CCOC(=O)NCC#CB(O)O 1883738852 NDJNPPSADKFRJG-UHFFFAOYSA-N 180.956 -1.639 50 10 AAGE C[C@H](CN)Oc1ccc(B(O)O)cn1 2210060773 NIMRFQTWWDLCIO-ZCFIWIBFSA-N 196.015 -1.513 50 10 AAGE OB(O)c1cnc(N[C@H]2C[C@@H]2F)nc1 2210061200 RHYRHGMTIPTRGS-WDSKDSINSA-N 196.978 -1.321 50 10 AAGE NC(=O)CNc1ncccc1B(O)O 2210068270 PBWJNFIINLUPIS-UHFFFAOYSA-N 194.987 -2.341 50 10 AAGE C=C(CS(=O)(=O)NN)B(O)O 2241481131 PAJKLVMOWGMFBO-UHFFFAOYSA-N 179.994 -2.652 50 10 AAGE CN(N)C(=O)[C@H]1C[C@H]1C(N)=O 2241522369 GLWCCHXVLIVFAX-DMTCNVIQSA-N 157.173 -1.560 50 10 AAGE Cc1nc(NC#N)ncc1B(O)O 2241555182 KFJYALZSSICZPR-UHFFFAOYSA-N 177.960 -1.642 50 10 AAGE C[S@](=O)NCCC#CB(O)O 2241901648 AOOWOESBHZIIHM-NSHDSACASA-N 175.018 -1.725 50 10 AAGE O=C1C[C@]2(CN1)CC(=O)OC2=O 100462052 FVYAKGFRJJGRPR-SSDOTTSWSA-N 169.136 -1.034 50 10 AAGE OC[C@@H](O)COC[C@H](O)CCl 147199641 YLPXUJPMQZRZLW-PHDIDXHHSA-N 184.619 -1.044 50 10 AAGE C=C(C#N)C(=O)OC[C@@H](O)CO 197001310 XTUOQYXRGNGOAA-LURJTMIESA-N 171.152 -1.037 50 10 AAGE NNC(=O)C[C@@H](NCCO)C(=O)O 238658410 KNATUMAAOOHKHL-SCSAIBSYSA-N 191.187 -2.599 50 10 AAGE NNc1ccc(B(O)O)cc1C=O 306609944 ZLZWYGQETLXOCX-UHFFFAOYSA-N 179.972 -1.536 50 10 AAGE C=CCNNC(=O)[C@@H]1COCCN1 308753204 VJVKUTUUTFGAFP-ZETCQYMHSA-N 185.227 -1.218 50 10 AAGE CC(=O)NNC(=O)CNCCC#N 379379368 AZWIIDCMNYJJBI-UHFFFAOYSA-N 184.199 -1.343 50 10 AAGE CC(=O)Nc1ncc(B(O)O)cn1 716784307 LYAVENJQHJWLGS-UHFFFAOYSA-N 180.960 -1.885 50 10 AAGE CC[C@H](OC)C(=O)NCC#CB(O)O 1895050043 UOAONBKUCMRTFI-ZETCQYMHSA-N 199.015 -1.457 50 10 AAGE CNC(=O)NCC(=O)NNC=O 1923855488 RZCLAXIOQUZQNX-UHFFFAOYSA-N 174.160 -2.307 50 10 AAGE O=C(C#CB(O)O)N[C@H]1CCNC1=O 2241468447 OLBGBDREMJWSDT-YFKPBYRVSA-N 195.971 -2.994 50 10 AAGE C=CC[C@H](CO)NC(=O)C#CB(O)O 2241468780 UULBPCPJMGGHOP-SSDOTTSWSA-N 196.999 -1.945 50 10 AAGE CCNC(=O)C#CB(O)O 2241478206 ADTZLYBRSIWGDD-UHFFFAOYSA-N 140.935 -1.862 50 10 AAGE O=C(C#CB(O)O)NC[C@@H]1CCNC1 2241479524 ZQQJPLLEYZHNDL-SSDOTTSWSA-N 196.015 -2.273 50 10 AAGE CNC(=O)CNC(=O)C(=O)NN 37225136 GDCWBJCUDZBIME-UHFFFAOYSA-N 174.160 -3.162 50 10 AAGE C[C@@H](CC(=O)NN)N(C)CCO 58839118 MQZCYQHIHWFIRG-LURJTMIESA-N 175.232 -1.321 50 10 AAGE NNC(=O)CSC[C@@H](O)CO 86661859 IJESHGMOSVAUKA-BYPYZUCNSA-N 180.229 -1.937 50 10 AAGE OB(O)/C=C\[C@H]1O[C@@H](O)[C@@H](O)[C@H]1O 208184026 DQCSKJVOIMGUKO-UMVMMHMCSA-N 189.960 -3.006 50 10 AAGE OB(O)CC(B(O)O)B(O)O 219983357 OJXGTIARQLPJOK-UHFFFAOYSA-N 161.524 -3.686 50 10 AAGE C/C=N/NC(=O)c1cc(=O)[nH]c(=O)[nH]1 238081358 NBRBVWZFGWUKLM-KRXBUXKQSA-N 196.166 -1.201 50 10 AAGE CC(=O)NNC(=O)CC(N)=O 238103588 OZXBSKLIDNESCE-UHFFFAOYSA-N 159.145 -1.971 50 10 AAGE OB(O)c1ccc(C2COC2)nc1 238644366 BFBASVFZRQMFKF-UHFFFAOYSA-N 178.984 -1.125 50 10 AAGE O=C(O)[C@H](O)[C@@H](O)C(=O)Cl 238715262 LKCPSSDNCUYXGJ-JCYAYHJZSA-N 168.532 -1.442 50 10 AAGE NNC(=O)[C@@H]1CSC(=O)N1 307530712 VYXDIUWUZXCVRA-REOHCLBHSA-N 161.186 -1.199 50 10 AAGE C[C@H](CF)NC(=O)C(=O)NN 702583974 SVFSRMMPRRBEJT-GSVOUGTGSA-N 163.152 -1.550 50 10 AAGE CO[C@]1(C(=O)NN(C)C)CCNC1 704168585 PGUKDDVYNXKNKV-MRVPVSSYSA-N 187.243 -1.042 50 10 AAGE CN1C#C[C-](C(=O)N(C)N)N1 885247602 DSGPSXNIKRXQGR-UHFFFAOYSA-N 153.165 -1.739 50 10 AAGE CC(=O)NNC(=O)c1cn(C)c(O)n1 1327745373 NOYLQKDTKWAEDD-UHFFFAOYSA-N 198.182 -1.093 50 10 AAGE C[C@]1(C(=O)NN)COCCN1 1880495586 MIZLXXMRUFNNET-ZCFIWIBFSA-N 159.189 -1.645 50 10 AAGE C[C@]1(B(O)O)CCN(C(=O)CO)C1 1891517268 MSHQEUYPLHMERA-ZETCQYMHSA-N 187.004 -1.556 50 10 AAGE CS(=O)(=O)CC[C@H](O)[C@@H](O)C#N 1951367737 ORKSJRLFXYGVHE-WDSKDSINSA-N 193.224 -1.334 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H]1C(F)F 1954051618 VJZISANGNAIQIR-GSVOUGTGSA-N 193.153 -1.158 50 10 AAGE CN(O)C(=O)c1cc(B(O)O)co1 2241752385 QKJYKDDYAUAVPE-UHFFFAOYSA-N 184.944 -1.579 50 10 AAGE CN(C)NC(=O)[C@H]1CN=CNC1 4631950 RPDVIAMBQBUQDG-UHFFFAOYSA-N 170.216 -1.173 50 10 AAGE NNC(=O)CN1CCC(=O)CC1 74373865 LNVVIWJPYGBFLI-UHFFFAOYSA-N 171.200 -1.359 50 10 AAGE C[C@@H](NC=O)C(=O)NN 104697429 MLLSMVRWAJMIHJ-GSVOUGTGSA-N 131.135 -1.889 50 10 AAGE O=c1cc(B(O)O)[nH]c(=O)[nH]1 197359970 AHPVQUJXXSFJHB-UHFFFAOYSA-N 155.906 -3.257 50 10 AAGE N#C/C(=C/NCCO)C(=O)NC(N)=O 238580145 OJOGYRSTEGXXQQ-PLNGDYQASA-N 198.182 -1.829 50 10 AAGE O=C(O)c1cc(F)ncc1B(O)O 238634506 QWTDYUMHAFCKCX-UHFFFAOYSA-N 184.919 -1.401 50 10 AAGE C[C@H](O)[C@]1(O)[C@H](O)C=C(C#N)[C@H]1O 238736465 XTQRPPSVJOYBFK-IHBLQFBFSA-N 185.179 -1.716 50 10 AAGE OB(O)c1nccc(F)c1O 307178507 YWXPQPSWAALMAT-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE O=C1NCN[C@@H]2CN[C@@H](Cl)N[C@@H]12 307523695 QKTVILKANVMHGO-ZMIZWQJLSA-N 190.634 -1.884 50 10 AAGE CCC(=O)NNC(=O)CCO 307620002 HZMXHYIAKIFXCR-UHFFFAOYSA-N 160.173 -1.074 50 10 AAGE CN(N)C(=O)[C@@H]1CCC(=O)N1 575558826 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NNC(=O)N1CC[C@@H]1[C@@H](O)CO 2241829262 BBCVUKGTWWNXRA-UHNVWZDZSA-N 175.188 -2.003 50 10 AAGE NNC(=O)CNCCCO 58863512 BRJGUXQWQNOHRQ-UHFFFAOYSA-N 147.178 -2.052 50 10 AAGE N#C[C@H]1CN(CCC(=O)NN)CCO1 86656724 ZDJUJLNCGOQFBP-ZETCQYMHSA-N 198.226 -1.409 50 10 AAGE N[C@@]1(C(=O)O)CC[C@H](B(O)O)C1 195893026 VOHZFKLCWSOFRW-NJGYIYPDSA-N 172.977 -1.205 50 10 AAGE C[C@@H]1COC[C@H]1NC(=O)C(=O)NN 575485369 NQVDNPVUFBXBAU-RFZPGFLSSA-N 187.199 -1.873 50 10 AAGE C[C@]1(CO)C[C@@H](O)CN1C(=O)NN 606260986 JCMSJBAEAVLGDJ-IYSWYEEDSA-N 189.215 -1.613 50 10 AAGE O=C(CC1CC1)NCB(O)O 706439851 UDXMGIOBGAOPFQ-UHFFFAOYSA-N 156.978 -1.085 50 10 AAGE NC(=O)[C@H](O)CNC(=O)F 1880055482 JNJXYUMFRNVMJQ-UWTATZPHSA-N 150.109 -1.488 50 10 AAGE C=C[C@@]1(O)CCN(CC(=O)NN)C1 1883357364 RCONOSIVIXOPNR-MRVPVSSYSA-N 185.227 -1.401 50 10 AAGE O=C1C[C@H](CN2CC[C@H](B(O)O)C2)N1 1891516056 DEWCAPZREBXKSE-NKWVEPMBSA-N 198.031 -1.576 50 10 AAGE COC[C@@H](NC(=O)CCl)C(N)=O 1932164794 JSULBMQTCIDSMI-SCSAIBSYSA-N 194.618 -1.158 50 10 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C[C@@H](CNC(=O)NN)[S@](C)=O 229763375 DWMIYDJIPGNHIT-AUIPBDMJSA-N 179.245 -1.074 50 10 AAGE OB(O)c1cnc2cnoc2c1 238656487 RYLOCOABZYVYGB-UHFFFAOYSA-N 163.929 -1.097 50 10 AAGE O=CC1=CC(=O)[C@@H]2O[C@H]2[C@@H]1O 238684010 QOYPXUBTGNKJBY-VQVTYTSYSA-N 154.121 -1.177 50 10 AAGE COc1cc(F)cnc1B(O)O 306944519 YFBJRPLJEGQDSB-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE OB(O)c1ncc(F)cc1O 307666437 DEBLINHPYLXOIT-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE NS(=O)(=O)N1CCN[C@@H](Cl)C1 616654106 LQLWKHXZGDPDGD-SCSAIBSYSA-N 199.663 -1.340 50 10 AAGE N#Cc1cnc(B(O)O)nc1 642880830 YRBOIQQVXHWCJH-UHFFFAOYSA-N 148.918 -1.972 50 10 AAGE C[C@@H](C(=O)O)C(=O)NCB(O)O 1923715316 HBIMTEKGOHQPSK-GSVOUGTGSA-N 174.949 -2.165 50 10 AAGE N#C[C@H](O)Cc1nn[nH]n1 1951360502 DYYRRSIVGBFEPG-GSVOUGTGSA-N 139.118 -1.373 50 10 AAGE CN(C)NC(=O)[C@H]1NCCNC1=O 1953981473 QADWCWQLUHYSSC-YFKPBYRVSA-N 186.215 -2.333 50 10 AAGE CO[C@@H]1C[C@H](O)CN(C(=O)NN)C1 1954843090 DAPSYYYJUBQLRY-NTSWFWBYSA-N 189.215 -1.349 50 10 AAGE 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159.189 -1.516 50 10 AAGE OB(O)[C@@H]1CCC[C@H]1B(O)O 225016996 XTUNCRCDQALZKE-RFZPGFLSSA-N 157.771 -1.144 50 10 AAGE CN(C)C(=O)[C@@](C)(O)NNC(N)=O 238311543 UWLOHBOZBNQZDM-ZCFIWIBFSA-N 190.203 -2.044 50 10 AAGE COc1ccnc(C=O)c1B(O)O 238383578 MZHNRVQXLAJKDR-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE NNC(=O)C(=O)N1CCC(F)(F)C1 306249370 VZPUZIDVBRCORY-UHFFFAOYSA-N 193.153 -1.156 50 10 AAGE CO[C@]1(C)C[C@H]1NC(=O)C(=O)NN 694462366 MLLZHUDKEYCZNI-CLZZGJSISA-N 187.199 -1.730 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]2NCCO[C@@H]2C1 1878462017 SGZDLMMRUOVMHH-DSYKOEDSSA-N 185.227 -1.257 50 10 AAGE Cc1coc(B(O)O)n1 1879952427 NLTDMGLVEVZAMQ-UHFFFAOYSA-N 126.908 -1.337 50 10 AAGE NNC(=O)N1C[C@@H]2[C@H](CO)[C@@H]2C1 1880857882 CQVLJLXWAAMWTM-FPFOFBBKSA-N 171.200 -1.260 50 10 AAGE NNC(=O)N1CC[C@@]2(CNC(=O)N2)C1 1884977094 OIUBDTYFLFVGDJ-SSDOTTSWSA-N 199.214 -1.673 50 10 AAGE N#CNCCc1ccc(B(O)O)cc1 1904782014 ORUBBVIHLKXGEJ-UHFFFAOYSA-N 190.011 -1.020 50 10 AAGE CCN(C)c1ncnc(C)c1B(O)O 1956956195 SYVLDLJVZBDMBZ-UHFFFAOYSA-N 195.031 -1.079 50 10 AAGE OB(O)c1cnccc1-n1cccn1 1956964216 FOUGTAPGLXOETP-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE OCc1ncc(B(O)O)o1 2049399337 WZLFCNDKUYKEHC-UHFFFAOYSA-N 142.907 -2.153 50 10 AAGE N[C@H]1CCN(C(=O)C2(B(O)O)CC2)C1 2241479981 CMIQCNJCLRRNLE-LURJTMIESA-N 198.031 -1.447 50 10 AAGE CNNC(=O)C1(O)CC1 2297008022 ZPHUKMIEBYQFHF-UHFFFAOYSA-N 130.147 -1.238 50 10 AAGE O=C1O[C@H](CCl)[C@H](O)[C@@H]1O 27756748 CBQUKTYYJALFIT-UZBSEBFBSA-N 166.560 -1.128 50 10 AAGE C/C(=N\NC(N)=O)C1=NCCNC1=O 36477206 ALNZDTXHHCVMFS-NYYWCZLTSA-N 197.198 -1.399 50 10 AAGE Cc1cnn(CC(=O)NN)c(=O)c1 235800329 AWIUZJBWHCDSKW-UHFFFAOYSA-N 182.183 -1.458 50 10 AAGE COc1c(B(O)O)ccnc1C#N 238345890 RQMUYXSBBNUNEJ-UHFFFAOYSA-N 177.956 -1.358 50 10 AAGE Cc1ccnc(O)c1B(O)O 238471908 SGNVEMNEHCGJTP-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE Cc1nccc(O)c1B(O)O 238491027 VHSQAAAJIQGBED-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE N#CC1=C[C@H](O)[C@H](O)[C@H](CO)O1 306222740 XEFNLUVAZWYCPL-ACZMJKKPSA-N 171.152 -1.493 50 10 AAGE C[C@@H]1CCN(CC(=O)NN)C1=O 306875853 BJNAWORPAZFXKF-RXMQYKEDSA-N 171.200 -1.155 50 10 AAGE CNC(=O)NNC(=O)CCN(C)C 308275549 VHBAXUDEMKWSFG-UHFFFAOYSA-N 188.231 -1.102 50 10 AAGE O=C(NCB(O)O)NC1CC1 575563832 WSQNFDRUGORVMH-UHFFFAOYSA-N 157.966 -1.540 50 10 AAGE CC(F)(F)CNC(=O)C(=O)NN 697988582 VFOGZTSAPHMNOB-UHFFFAOYSA-N 181.142 -1.252 50 10 AAGE NNC(=O)[C@@H]1CC[C@H](C(N)=O)C1 1333178964 YBVJCGYAMHTQNR-CRCLSJGQSA-N 171.200 -1.122 50 10 AAGE Cc1nc(C)c(B(O)O)[nH]1 1880056977 HZXXAQMYZIZOQW-UHFFFAOYSA-N 139.951 -1.294 50 10 AAGE O=S1(=O)CC[C@H](CB(O)O)C1 1929558949 RQWNKUREBJKYFG-RXMQYKEDSA-N 178.018 -1.106 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H](F)[C@H](O)C1 1929910416 MTVYMMZHYJKXGL-NGJCXOISSA-N 191.206 -1.621 50 10 AAGE O=C(C#CB(O)O)N1C[C@H]2C[C@H]1CN2 2241468042 GJUXBEWWBXSYGZ-RQJHMYQMSA-N 193.999 -2.426 50 10 AAGE O=C1NCCN1C(=O)[C@H]1C[C@@H]1B(O)O 2241494945 FTXBBRHMCKRMRM-WHFBIAKZSA-N 197.987 -1.599 50 10 AAGE NC(=O)NC(=O)c1coc(B(O)O)c1 2241585165 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710824445 DZEWDIZURLNEKZ-ZETCQYMHSA-N 189.215 -2.019 50 10 AAGE NNC(=O)N1CC[C@@H](O)[C@@H](O)C1 1881080004 DSJSNVJBFBVISR-UHNVWZDZSA-N 175.188 -2.003 50 10 AAGE C[S@](=O)N1CC[C@@H](B(O)O)C1 1891606629 GTLDCXADGUKTAV-GCXOYZPQSA-N 177.034 -1.171 50 10 AAGE CC1(C)CN(CC(=O)NN)[C@@H]1CO 1929740745 LZWZNJGJMMWZLK-ZCFIWIBFSA-N 187.243 -1.321 50 10 AAGE NC[C@@H]1CC[C@@H]1C(=O)NN 1935412430 SHZYSXCYLQHAJS-WHFBIAKZSA-N 143.190 -1.039 50 10 AAGE CCn1nnnc1CNC(=O)NN 1953971898 IMUUIIQNOMGBTD-UHFFFAOYSA-N 185.191 -1.634 50 10 AAGE CNNC(=O)[C@@H]1CO[C@H]2COC[C@@H]12 1954357621 OZPIEGGWXRNQIA-XVMARJQXSA-N 186.211 -1.102 50 10 AAGE NOCCOc1cc(B(O)O)ccn1 2210061417 UDECCAJARKFBFO-UHFFFAOYSA-N 197.987 -1.970 50 10 AAGE CCNC(=O)c1nccnc1B(O)O 2241501914 BXEJPASLGVYTBP-UHFFFAOYSA-N 194.987 -2.094 50 10 AAGE O=C(NCB(O)O)[C@H]1[C@@H]2CCO[C@@H]21 2297039996 IGMZKBJQHGKPPH-ZLUOBGJFSA-N 184.988 -1.851 50 10 AAGE NNC(=O)[C@@H]1O[C@H]1C(=O)NN 39136634 FANRUYLVDUQZQS-JCYAYHJZSA-N 160.133 -3.266 50 10 AAGE CC(=O)N1CCN(C(=O)NN)CC1 71499788 WCUVHDPCWUJYJQ-UHFFFAOYSA-N 186.215 -1.266 50 10 AAGE NNC(=O)CCN1CCC[C@H](N)C1 82470159 UZUUNVVSDIPPPQ-ZETCQYMHSA-N 186.259 -1.211 50 10 AAGE NC(=O)NC(/C=C/C=O)NC(N)=O 139458515 OPXAXQWORTUTAZ-OWOJBTEDSA-N 186.171 -1.596 50 10 AAGE OB(O)CCCCc1nnn[nH]1 238607816 WHDDHPOQPXNJMK-UHFFFAOYSA-N 169.981 -1.005 50 10 AAGE CC(=O)NN/C(C)=C(/C#N)C(N)=O 306544411 YBLYWODBFAUYFZ-XQRVVYSFSA-N 182.183 -1.090 50 10 AAGE C[C@H]1CN(CC(=O)NN)C[C@@H]1O 307323741 HDRDSKKVTLFGJE-WDSKDSINSA-N 173.216 -1.711 50 10 AAGE C[C@H](CNC(=O)NN)S(N)(=O)=O 307463680 INGFZEUWFHXKDT-GSVOUGTGSA-N 196.232 -2.164 50 10 AAGE Cc1nc(CB(O)O)n(C)n1 575471528 KMSUWURUCUOJAB-UHFFFAOYSA-N 154.966 -1.322 50 10 AAGE NC(=O)NNC(=O)c1nc[nH]n1 575587326 REDAVNAPAYNHCG-UHFFFAOYSA-N 170.132 -1.882 50 10 AAGE N[C@H]1N[C@@H]2NCN[C@H]2[C@@H](Cl)N1 585662372 WQAUMAKLAOPFGY-NEEWWZBLSA-N 177.639 -2.169 50 10 AAGE NNC(=O)[C@H]1C[C@@H]1CN1CCNC1=O 885894785 QSCNOBONHFTQPE-RITPCOANSA-N 198.226 -1.362 50 10 AAGE 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191.256 -1.025 50 10 AAGE NNC(=O)C(=O)NCc1ncccn1 702324196 QIVIUSIGSJJQCH-UHFFFAOYSA-N 195.182 -1.917 50 10 AAGE NNC(=O)N[C@@H]1CCNC(=O)C1 1881022630 RBCADXNAXGABPX-SCSAIBSYSA-N 172.188 -1.562 50 10 AAGE C[S@@](=O)N[C@H]1CCC=C1B(O)O 1881335128 GHNFAPZXMHMKLZ-PWCHPLFNSA-N 189.045 -1.030 50 10 AAGE CN(C[C@H]1C[C@H]1F)C(=O)C(=O)NN 1882863368 HFZMSRLBNNJEOB-RFZPGFLSSA-N 189.190 -1.207 50 10 AAGE NC(=O)NN=C1CCC(=O)NC1 1923835489 WFNZYPRMYXXDLO-UHFFFAOYSA-N 170.172 -1.079 50 10 AAGE CN(CC(=O)NNC=O)C1CC1 1923943808 IJFXRAIAZCSAHT-UHFFFAOYSA-N 171.200 -1.142 50 10 AAGE CN(CCO)c1ncccc1B(O)O 2210068227 OHRDHDNIWKAYLB-UHFFFAOYSA-N 196.015 -1.810 50 10 AAGE O=C(C#CB(O)O)N1CCC[C@@H](O)C1 2241468318 LLBWNXJZAUBKNA-SSDOTTSWSA-N 196.999 -2.015 50 10 AAGE NC(=O)C1(B(O)O)CCC1 2241470669 BBLUAJKIMOMYSF-UHFFFAOYSA-N 142.951 -1.131 50 10 AAGE CCCN(CCO)C(=O)C(=O)NN 42453612 JGOBDHPXZSYIFM-UHFFFAOYSA-N 189.215 -1.793 50 10 AAGE C[C@@H](Cn1cnc(C#N)n1)C(=O)NN 82471715 IPXRPBWTWUEDQA-YFKPBYRVSA-N 194.198 -1.224 50 10 AAGE Cn1cc(CC(=O)NN)ccc1=O 167164954 AMDGZUQKCULHPN-UHFFFAOYSA-N 181.195 -1.082 50 10 AAGE Nc1nccc(Cl)c1B(O)O 238699019 JDVMUYWJEQHHLY-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE N[C@H]1[C@H](O)[C@@H](N)[C@H](O)[C@H](Cl)[C@@H]1O 307039155 IQRWSOIXUCSHGB-QWBQGLJISA-N 196.634 -2.655 50 10 AAGE NNC(=O)CN(CCO)CCCO 385744360 MKPQILJHLICRMW-UHFFFAOYSA-N 191.231 -2.347 50 10 AAGE NNC(=O)CN1C[C@H]2COC[C@@H]2C1 718240974 IINQGJGSMHVWDK-BQBZGAKWSA-N 185.227 -1.446 50 10 AAGE NNC(=O)CCN1C[C@@H]2[C@@H](CO)[C@@H]2C1 1885722706 SZBUEYRJJZPIAC-JIGDXULJSA-N 199.254 -1.464 50 10 AAGE NNC(=O)CN1CC[C@H](O)[C@H]2CC[C@H]21 1888265784 OKTFLELCYJNJOO-RNJXMRFFSA-N 199.254 -1.179 50 10 AAGE O=C(NNCCO)c1ccc(=O)oc1 1929833675 NTSSEMNQGYDHOW-UHFFFAOYSA-N 198.178 -1.134 50 10 AAGE C=CC(=O)N[C@H](CB(O)O)C(=O)O 1954526651 XGOWHWHYGMDTLH-SCSAIBSYSA-N 186.960 -1.785 50 10 AAGE CCN(O)C(=O)c1cc(B(O)O)n[nH]1 2241475259 UNHCTBWIWUNVQJ-UHFFFAOYSA-N 198.975 -2.059 50 10 AAGE Nc1c(B(O)O)cncc1C(=O)O 206090947 WPNVDTFBQAYEAK-UHFFFAOYSA-N 181.944 -1.958 50 10 AAGE CN(C)NC(=O)CCN 214996037 QLBHETBBMDLJCZ-UHFFFAOYSA-N 131.179 -1.072 50 10 AAGE CC(=O)NNC(=O)Cn1cncn1 307123984 YCDVEEUUQUTBKM-UHFFFAOYSA-N 183.171 -1.555 50 10 AAGE COC(=O)NNC(=O)N(C)CCO 308435544 WDFSSGKMHMFHDW-UHFFFAOYSA-N 191.187 -1.109 50 10 AAGE COCC1=C=C(C(=O)NN)NO1 885325436 CUAJMMYCIDVLDH-UHFFFAOYSA-N 171.156 -1.476 50 10 AAGE NNC(=O)C1=C=NN2CCNC[C-]12 885390068 HYESOBWLYTXJMW-UHFFFAOYSA-N 180.191 -2.062 50 10 AAGE NNC(=O)NC[C@@H]1CCO1 1880067320 UMQLSSOKCGRNPU-BYPYZUCNSA-N 145.162 -1.052 50 10 AAGE CN(C)NC(=O)CO[C@H]1CCNC1 1932652060 CQMYWHKLULVCFL-ZETCQYMHSA-N 187.243 -1.042 50 10 AAGE NNC(=O)CCCN1CC=C[C@@H](O)C1 1956307396 QALRPMIKVSBCRK-MRVPVSSYSA-N 199.254 -1.011 50 10 AAGE O=C(C#CB(O)O)N[C@@]12CNC[C@H]1C2 2241467786 AXDVXIDUHANZSJ-SVRRBLITSA-N 193.999 -2.520 50 10 AAGE O=C(NC1CC1)c1cc(B(O)O)n[nH]1 2241474707 JIJDNVNYECJSHK-UHFFFAOYSA-N 194.987 -2.018 50 10 AAGE O=C([C@H]1C[C@@H]1B(O)O)N1CCOC1 2241481508 VZZDYNKGXCKNKK-WDSKDSINSA-N 184.988 -1.334 50 10 AAGE CC(C)NNC(=O)C(=O)NN 2009132 JWIHWSUHUHGYGL-UHFFFAOYSA-N 160.177 -1.995 50 10 AAGE NNC(=O)Cc1ncnc2nc[nH]c12 17354432 YAXUERPUBHSCKX-UHFFFAOYSA-N 192.182 -1.115 50 10 AAGE CN(C)NC(=O)COCCN 147243676 CMYJAMOTYOTVDI-UHFFFAOYSA-N 161.205 -1.446 50 10 AAGE COC(=O)c1ncc(B(O)O)cc1N 206064820 CITBHQNLNDOHHT-UHFFFAOYSA-N 195.971 -1.870 50 10 AAGE C[C@H]1CN(C)CCN1CC(=O)NN 235574217 IKRCPDAASSDLRX-ZETCQYMHSA-N 186.259 -1.388 50 10 AAGE COc1nc(B(O)O)ncc1F 238352160 OCJYSLYTBQZCQZ-UHFFFAOYSA-N 171.924 -1.696 50 10 AAGE NNC(=O)[C@H]1[C@H]2CN3CC[C@@H](O2)[C@@H]13 306589009 TZTAPDGMEFSGAS-JWXFUTCRSA-N 183.211 -1.552 50 10 AAGE C/C(=N/NC(N)=O)[C@](C)(N)CO 306958961 WQVAKYYVYQOMPV-JSGQGRBMSA-N 174.204 -1.260 50 10 AAGE C[C@H]1CN(CC(=O)NN)CC(=O)N1 307360394 FUDNOPXRSZRFOJ-YFKPBYRVSA-N 186.215 -2.203 50 10 AAGE O[C@@H]1CO[C@@H](O)[C@H](Cl)[C@@H]1O 307371450 QBZSYPGANFVRKW-TXICZTDVSA-N 168.576 -1.336 50 10 AAGE Cc1cnc(B(O)O)c(N)c1 307557793 CCYANWBZOHTEEC-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE C#CCNC(=O)[C@@H](C)NNC(C)=O 379413721 MIAAXUZSTWVYTA-ZCFIWIBFSA-N 183.211 -1.235 50 10 AAGE CNC(=O)NC(=O)N[N+](=O)[O-] 687806926 JULNNPWTUSUFBN-UHFFFAOYSA-N 162.105 -1.183 50 10 AAGE CN1C[C@@H]2C[C@H](C1)N2C(=O)C(=O)NN 1887176907 ZUMBHYJDXBNCAT-OLQVQODUSA-N 198.226 -2.109 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]2COC[C@H]21 1895631429 CDEKUSUMTSYPDA-NTSWFWBYSA-N 199.210 -1.776 50 10 AAGE Cc1c(NC(=O)C(=O)NN)cnn1C 1932445507 CADRHGCRLPMXAC-UHFFFAOYSA-N 197.198 -1.343 50 10 AAGE C[C@@H](O)[C@H]1CN(C(=O)NN)CCO1 1954189023 ILMPGQFRAAVLMC-PHDIDXHHSA-N 189.215 -1.349 50 10 AAGE CO[C@@H]1CC[C@@H]1C(=O)NCB(O)O 2209288732 NFMFHFBUKBPFKB-NTSWFWBYSA-N 187.004 -1.460 50 10 AAGE CC#CCN=c1ccc(B(O)O)c[nH]1 2210059725 CCBDCBNHGXXLCT-UHFFFAOYSA-N 190.011 -1.382 50 10 AAGE O=C(C#CB(O)O)N=c1cco[nH]1 2241468250 KFASLJWHSWDHMV-UHFFFAOYSA-N 179.928 -1.950 50 10 AAGE CN(O)C(=O)c1c(B(O)O)nnn1C 2241473320 IDVJSJPIAHKGAD-UHFFFAOYSA-N 199.963 -3.044 50 10 AAGE CC(C)NC(=O)c1cc(B(O)O)c[nH]1 2241479196 SZZRLLKCOLHGAY-UHFFFAOYSA-N 196.015 -1.167 50 10 AAGE N#CNC(=O)c1ccc(B(O)O)cn1 2241479307 VWGVLVTYDAAXMR-UHFFFAOYSA-N 190.955 -2.028 50 10 AAGE CC[C@](C)(CO)NC(=O)C#CB(O)O 2241479535 ZWKGHGOIZCKYKR-MRVPVSSYSA-N 199.015 -1.721 50 10 AAGE O=C(O)CNC(=O)[C@@H]1C[C@@H]1B(O)O 2241480532 MGPASALROXGGLA-DMTCNVIQSA-N 186.960 -1.950 50 10 AAGE CS(=O)(=O)CCCNC(=O)NN 44567980 OKHAMVPSIZBFEF-UHFFFAOYSA-N 195.244 -1.406 50 10 AAGE CN(C)NC(=O)[C@@H]1COCCN1 147296448 LBBFQSPQEKTQFZ-LURJTMIESA-N 173.216 -1.432 50 10 AAGE CC(=O)c1c(N)cncc1B(O)O 206091818 YRBABYPSNIWYNY-UHFFFAOYSA-N 179.972 -1.454 50 10 AAGE CN1CCCn2ncc(B(O)O)c21 238294580 DDRGGORGOBNJEM-UHFFFAOYSA-N 181.004 -1.597 50 10 AAGE CN1CC[C@@H]([C@H](N)C(=O)N(C)N)C1 259015401 ICHMJGPKRKKROG-RQJHMYQMSA-N 186.259 -1.403 50 10 AAGE CCCn1ncnc1B(O)O 307013266 LRDDUFBGIRDZJZ-UHFFFAOYSA-N 154.966 -1.632 50 10 AAGE COC(=O)C(=O)NN[C@H](C)C(N)=O 388234108 NRUAFYSGJQAUCL-GSVOUGTGSA-N 189.171 -2.346 50 10 AAGE NNC(=O)C(=O)NC1CC(F)(F)C1 575483366 PFUQSPREFFWAIY-UHFFFAOYSA-N 193.153 -1.110 50 10 AAGE C[N+]1=C=C([C@H](O)CCl)NN1 642842284 XCTLDCLHEICISY-RXMQYKEDSA-N 162.600 -1.195 50 10 AAGE CN(Cc1ncno1)C(=O)C(=O)NN 706395065 GIOZWZRJUOIDNM-UHFFFAOYSA-N 199.170 -1.982 50 10 AAGE O=CC1=C=[N+](C[C@@H]2COCCO2)NN1 885841412 XMGDYOOJFVUHEL-MRVPVSSYSA-N 198.202 -1.810 50 10 AAGE N#CC1=CCN(C(=O)[C@H](O)CN)CC1 1884516509 FPOIZSYOQUDLBV-MRVPVSSYSA-N 195.222 -1.012 50 10 AAGE NCCNCCSCC(=O)NN 1923473643 ATELLYNHMCPXRP-UHFFFAOYSA-N 192.288 -1.742 50 10 AAGE CCc1c(C(=O)NN)nnn1C 1923634281 WXCZZCWEJOXHKA-UHFFFAOYSA-N 169.188 -1.019 50 10 AAGE O=C(NNCCO)c1ccon1 1929830000 DOHFHVIMOCYSFO-UHFFFAOYSA-N 171.156 -1.099 50 10 AAGE NNC(=O)COC[C@@H]1COCCO1 1933320044 NPEOSIICVWMMHB-LURJTMIESA-N 190.199 -1.592 50 10 AAGE NC(=O)NNC(=O)[C@H]1[C@H]2COC[C@H]21 1954212349 OTRDWPGFQHVPOW-ZXFHETKHSA-N 185.183 -1.422 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C=CCC1 2241479526 ZQZRWSUQGTXTKR-ZETCQYMHSA-N 178.984 -1.163 50 10 AAGE CC#CCNC(=O)[C@H]1C[C@H]1B(O)O 2241496271 QSTMDAZERQLUFB-NKWVEPMBSA-N 181.000 -1.011 50 10 AAGE C[C@@H](O)C(=O)O[Si](C)(O)O 196471160 GJWAUYCSBMAJMS-GSVOUGTGSA-N 166.205 -1.536 50 10 AAGE CNc1c(N)cccc1B(O)O 204754108 MXQTWHOTQDULSI-UHFFFAOYSA-N 165.989 -1.010 50 10 AAGE N#C[C@@H](O)C[C@H](O)[C@H](O)CO 307738224 HBUAPQSBFUMCOW-HCWXCVPCSA-N 161.157 -2.025 50 10 AAGE COCC(=O)NN[C@H]1CCNC1=O 379394365 XCLRMZVXHAKDRK-YFKPBYRVSA-N 187.199 -1.858 50 10 AAGE CNNC(=O)C1COC1 1879950047 SYTILDPDAHLBOC-UHFFFAOYSA-N 130.147 -1.117 50 10 AAGE NNC(=O)CSCC(=O)O 1914754516 LFGCGAGNUOYZLQ-UHFFFAOYSA-N 164.186 -1.206 50 10 AAGE CCN(OC)[C@@H](COC)C(=O)NN 1928675190 LJJOSXOXAYDAJQ-LURJTMIESA-N 191.231 -1.125 50 10 AAGE N#C[C@@H](O)[C@@H](N)Cn1cnnn1 1952862242 MBIWZTSYGVCMEE-CRCLSJGQSA-N 168.160 -2.115 50 10 AAGE C[C@@H](C(=O)NN)N(C)Cc1ncon1 1955516905 WDAWXXIWGZIXDM-YFKPBYRVSA-N 199.214 -1.120 50 10 AAGE C[C@H](O)CNc1ncccc1B(O)O 2210068472 SNYBKSPOOOESLJ-LURJTMIESA-N 196.015 -1.446 50 10 AAGE CC[C@@H](NC(=O)C#CB(O)O)C(N)=O 2241468535 QBHWHAVLSRKUOW-RXMQYKEDSA-N 197.987 -2.618 50 10 AAGE O=C(NO)c1ncccc1B(O)O 2241583959 HECHEIORFUVNLL-UHFFFAOYSA-N 181.944 -2.120 50 10 AAGE NC(=O)NNC(=O)c1cnns1 83593140 HEENACAUTFHHMV-UHFFFAOYSA-N 187.184 -1.149 50 10 AAGE NNC(=O)C(=O)N1CC[C@H](CO)C1 159411283 ASEPVZMCNIHZAS-YFKPBYRVSA-N 187.199 -2.183 50 10 AAGE Nc1cncc(B(O)O)c1Cl 206092032 PXIRSUPQQLSIGO-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE C[C@@H](NC(=S)[C@H](C)N)B(O)O 210104757 BTELILDAVLHMTG-IUYQGCFVSA-N 176.050 -1.349 50 10 AAGE C[C@H]1C[C@@H](O)CN(CC(=O)NN)C1 307000808 ASTQBVFQWNTGHW-NKWVEPMBSA-N 187.243 -1.321 50 10 AAGE CO[C@@H]1C[C@@H]1Cn1ccc(B(O)O)n1 1887358905 BQJNARWIYNXWEG-RNFRBKRXSA-N 196.015 -1.402 50 10 AAGE O=S1(=O)CC[C@@H](CB(O)O)C1 1929558950 RQWNKUREBJKYFG-YFKPBYRVSA-N 178.018 -1.106 50 10 AAGE CN(C)NC(=O)CNO 1953141174 FLTTWPURABINSO-UHFFFAOYSA-N 133.151 -1.442 50 10 AAGE COC[C@@H]1C[C@@H]1NC(=O)C(=O)NN 1954201746 AYLKXYXIBWQWRV-WHFBIAKZSA-N 187.199 -1.873 50 10 AAGE CC#CC(=O)N[C@@H](CB(O)O)C(=O)O 1955592583 QVAYNWTYFWAJNK-YFKPBYRVSA-N 198.971 -1.948 50 10 AAGE CONC(=O)c1cncc(B(O)O)c1 2241475395 WYAZTJOTJXWJAD-UHFFFAOYSA-N 195.971 -1.947 50 10 AAGE C[C@@H](C(=O)NN)N1CCC[C@H](N)C1 82470161 QOYSCQRGAQMYNC-BQBZGAKWSA-N 186.259 -1.212 50 10 AAGE NNC(=O)CCONC(=O)NN 196536852 PVJUYDMPZGDBBH-UHFFFAOYSA-N 177.164 -2.529 50 10 AAGE COc1cnc(B(O)O)c(N)c1 204441763 MQIWKQCFVRMMCU-UHFFFAOYSA-N 167.961 -1.648 50 10 AAGE Nc1cnc(Cl)c(B(O)O)c1 206053811 UIWXQWPYHVLDAZ-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE NNC(=O)C(=O)N[C@H]1CNC(=O)C1 229354972 DLMPPNQAUCBGPM-GSVOUGTGSA-N 186.171 -3.019 50 10 AAGE NNc1cccc(B(O)O)c1[N+](=O)[O-] 307436669 RHEFAZROYROGJT-UHFFFAOYSA-N 196.959 -1.440 50 10 AAGE COC=NNC(=O)[C@@H]1CCC(=O)N1 383968908 MGZUKNHTMRSPGT-YFKPBYRVSA-N 185.183 -1.029 50 10 AAGE CNNC(=O)[C@@H]1CCC(=O)N1 575557078 DGONLTPEAFHEIS-BYPYZUCNSA-N 157.173 -1.484 50 10 AAGE Cc1cnn(C)c1C(=O)NNCCO 1930720883 HYGIWMGYDYKJOF-UHFFFAOYSA-N 198.226 -1.045 50 10 AAGE N#C[C@H](O)[C@@H](N)Cc1nn[nH]n1 1952795319 SAHGDVHOMDVEJE-IMJSIDKUSA-N 168.160 -2.046 50 10 AAGE N#C[C@H](O)[C@@H]1COCCN1 1953171697 OQQHMKPUEGIBTH-WDSKDSINSA-N 142.158 -1.141 50 10 AAGE C[C@H](C(=O)NN)N1CC(O)(CO)C1 1954057110 NKUSZHREEOKNQA-RXMQYKEDSA-N 189.215 -2.596 50 10 AAGE C[C@@H]1CN(C(=O)C#CB(O)O)C[C@@H]1N 2241468166 IKYHERZSWGMAPP-RQJHMYQMSA-N 196.015 -2.193 50 10 AAGE O=C(C#CB(O)O)N[C@H]1COC[C@@H]1O 2241471897 MVFKIVAFWSEKJA-WDSKDSINSA-N 198.971 -3.122 50 10 AAGE CNC(=O)c1cc(B(O)O)n[nH]1 2241474904 MWZRCRCEZASKDO-UHFFFAOYSA-N 168.949 -2.551 50 10 AAGE C[C@@H]1CN(C(=O)C(=O)NN)CCO1 36948179 XXRIGAUJYLQAAQ-RXMQYKEDSA-N 187.199 -1.776 50 10 AAGE NNC(=O)C(=O)N[C@@H]1CNC(=O)C1 229354963 DLMPPNQAUCBGPM-VKHMYHEASA-N 186.171 -3.019 50 10 AAGE CC1(C)NC(=O)C(=O)OC1=O 238255924 IFWJZSVAHNAQAN-UHFFFAOYSA-N 157.125 -1.035 50 10 AAGE OB(O)c1cc(F)c(B(O)O)s1 306342501 BICMYMAUMMDWRD-UHFFFAOYSA-N 189.769 -2.753 50 10 AAGE CN(N)C(=O)c1cnc(O)nc1O 575552267 YSIAOAKXSVTACV-UHFFFAOYSA-N 184.155 -1.167 50 10 AAGE O=C(O)COC(=O)N[N+](=O)[O-] 687727284 CNOYSXVNPFIEBJ-UHFFFAOYSA-N 164.073 -1.011 50 10 AAGE CCCOCCn1ccc(B(O)O)n1 694268686 FZHCYWHHKZOHPH-UHFFFAOYSA-N 198.031 -1.011 50 10 AAGE NNC(=O)[C@H]1C=C[C@@H]1C(=O)O 1880145100 CWYQDBYKJLIQED-IMJSIDKUSA-N 156.141 -1.137 50 10 AAGE OB(O)c1cnn(C[C@@H]2CO2)c1 1951329729 UBSQXTNEXQOPKX-ZCFIWIBFSA-N 167.961 -2.038 50 10 AAGE NNC(=O)CN1C[C@@H]2[C@H](CO)C[C@H]2C1 1957215932 GZXQXQHWRXGSRI-FXQIFTODSA-N 199.254 -1.464 50 10 AAGE NC(=O)CNc1ccc(B(O)O)cn1 2210061463 VDEUMOPQJUVEDP-UHFFFAOYSA-N 194.987 -2.341 50 10 AAGE N#CNC(=O)c1csc(B(O)O)c1 2241467886 COXICYPUPKXODC-UHFFFAOYSA-N 195.996 -1.361 50 10 AAGE NC(=O)c1sccc1B(O)O 2241478251 AYUUETBARBYEHO-UHFFFAOYSA-N 170.986 -1.473 50 10 AAGE CCOCCCNC(=O)C(=O)NN 36948210 HUWUSFYFWKAJLZ-UHFFFAOYSA-N 189.215 -1.481 50 10 AAGE NNC(=O)[C@@H]1CNCCN1 104604628 QVYRKKBRZGTCNX-BYPYZUCNSA-N 144.178 -2.462 50 10 AAGE CNc1cncc(B(O)O)c1 238346143 DUPVNTDAEOAVRM-UHFFFAOYSA-N 151.962 -1.197 50 10 AAGE NNC(=O)C1=NO[C@@]2(CCNC2)C1 687606253 IFPVBJKDELUKTK-ZETCQYMHSA-N 184.199 -1.515 50 10 AAGE NNC(=O)CN1CC2CC1(CO)C2 694573573 OPSYEUIQHHOYRQ-UHFFFAOYSA-N 185.227 -1.567 50 10 AAGE O=C(NCB(O)O)C1=C=NSN1 885503731 SSTZHUSCUFBLAZ-UHFFFAOYSA-N 186.989 -2.165 50 10 AAGE NC(=O)NCC=CB(O)O 1880095610 MXGDLKYCSWZMLT-UHFFFAOYSA-N 143.939 -1.777 50 10 AAGE C[C@H](N)C(=O)NNS(N)(=O)=O 1923701654 VQZIUKFFGNHJJY-REOHCLBHSA-N 182.205 -2.842 50 10 AAGE COCCOCC[C@@H](N)B(O)O 1953647771 NJQMRCNKKHOWCV-ZCFIWIBFSA-N 177.009 -1.621 50 10 AAGE NNC(=O)N1CC(=O)N[C@@H]2CC[C@H]21 1953947978 ZKEQGGVIRXVUOG-RFZPGFLSSA-N 184.199 -1.468 50 10 AAGE C=CCOc1ncc(B(O)O)cn1 1954085510 FRZMPJGPSYLAEL-UHFFFAOYSA-N 179.972 -1.279 50 10 AAGE C[C@]1(CO)C=CCN1CCC(=O)NN 2209890909 QVGQEAONYXRWSV-SECBINFHSA-N 199.254 -1.011 50 10 AAGE N[C@H](CO)CNC(=O)C#CB(O)O 2241467780 AUTWFAOTZYCUBR-YFKPBYRVSA-N 185.976 -3.562 50 10 AAGE Cn1nc(B(O)O)c(C(N)=O)n1 2241475491 YVCDMXKYDWZJRO-UHFFFAOYSA-N 169.937 -3.406 50 10 AAGE C[C@H](O)CC(=O)NCC=CB(O)O 2241570469 IALBNOFOWBTAQP-LURJTMIESA-N 187.004 -1.558 50 10 AAGE O=C(NO)c1c[nH]nc1B(O)O 2241584395 NBXWMUIMOIGEQD-UHFFFAOYSA-N 170.921 -2.792 50 10 AAGE CC(C)[C@@H](CO)NC(=O)C(=O)NN 221773597 TYKCMBZUDBNLHW-RXMQYKEDSA-N 189.215 -1.891 50 10 AAGE O=C(O)c1ncc(B(O)O)cc1O 238632960 GWYDIWMCTCRNMI-UHFFFAOYSA-N 182.928 -1.835 50 10 AAGE Nc1cc(B(O)O)cc2[nH]cnc12 306917370 YZZXCUDEPCGJEJ-UHFFFAOYSA-N 176.972 -1.175 50 10 AAGE CN(CC(=O)NN)[C@@H]1COC[C@@H]1O 708110463 CMRGALRSRFARHO-RITPCOANSA-N 189.215 -2.332 50 10 AAGE C[C@@H]1CN(CC(=O)NN)C[C@@H]1CO 708123599 GMSPVPCXNNGBPQ-RNFRBKRXSA-N 187.243 -1.464 50 10 AAGE NC[C@H]1CCO[C@H]1C(=O)NN 715316205 JCDHDJORYFDRFN-RFZPGFLSSA-N 159.189 -1.660 50 10 AAGE NNC(=O)[C@H]1C[C@H]1CN1CCOCC1 725608135 VDNGPFBCYOJLJP-YUMQZZPRSA-N 199.254 -1.055 50 10 AAGE CN1NC(C(=O)NN)=C=C1N 885250262 JNDSCZXNOVANDI-UHFFFAOYSA-N 155.161 -2.291 50 10 AAGE C#CC(=O)NNC(=O)[C@@H]1CCC(=O)N1 1611607830 CYEYEFYBASOJJM-YFKPBYRVSA-N 195.178 -1.954 50 10 AAGE OCc1ccnc(B(O)O)c1 1880252847 ZKNRYPYDXADQSI-UHFFFAOYSA-N 152.946 -1.746 50 10 AAGE O=C(F)N[C@@H]1C[C@H](O)[C@H](O)[C@H]1O 1881051319 LJBUFLRSGWYIIJ-STGXQOJASA-N 179.147 -1.480 50 10 AAGE NNC(=O)C(=O)N[C@H]1COC[C@@H]1F 1883141616 XEXITHXKGJRQLH-IMJSIDKUSA-N 191.162 -2.171 50 10 AAGE C[C@H](C(=O)NN)N1[C@H]2COC[C@H]1C2 1883760625 GYLRXJMUJPTCEC-FSDSQADBSA-N 185.227 -1.162 50 10 AAGE OC[C@H](O)CN1CC[C@@H](B(O)O)C1 1891490172 AXSLHQQGYXOATN-RNFRBKRXSA-N 189.020 -2.112 50 10 AAGE O=C(NCB(O)O)[C@H]1C[C@@H](F)C1 1893598375 AUOODLVLSVIXMI-SYDPRGILSA-N 174.968 -1.137 50 10 AAGE CN1CCC[C@@H]1C(=O)NNCCO 1931440505 RTINCPRTZQDWJO-SSDOTTSWSA-N 187.243 -1.306 50 10 AAGE NNC(=O)C(=O)N1CC(CCO)C1 1932108111 LOPOEFUFUZEWTD-UHFFFAOYSA-N 187.199 -2.183 50 10 AAGE COC1(Cn2cc(B(O)O)cn2)CC1 1956522278 PRHFVNIDXNNZFR-UHFFFAOYSA-N 196.015 -1.258 50 10 AAGE N[C@]12C[C@H]1C(=O)OC2=O 100180973 GAVGHGRWCNPBET-JLAZNSOCSA-N 127.099 -1.213 50 10 AAGE N#Cc1ccnc(O)c1B(O)O 238614486 VIRLFZKXMGQOSJ-UHFFFAOYSA-N 163.929 -1.661 50 10 AAGE NNC(=O)N1C[C@@H](CO)[C@@H](CO)C1 704800293 CEBKIPDQOAISFL-OLQVQODUSA-N 189.215 -1.898 50 10 AAGE C#CC[C@H](C)C(=O)NCB(O)O 1881336524 VCIGSANMDFAQOX-LURJTMIESA-N 168.989 -1.226 50 10 AAGE NNC(=O)[C@@H]1C[C@H]1CN1CC(CO)C1 1929743966 WPAKXNMYEOCKGW-JGVFFNPUSA-N 199.254 -1.464 50 10 AAGE CNNC(=O)[C@]1(C)CNC(=O)C1 1953704789 BXBRWZJSTAOFIY-ZETCQYMHSA-N 171.200 -1.237 50 10 AAGE NNC(=O)C(=O)NCCC1COC1 1953866492 XNEKSVLSLCBHPX-UHFFFAOYSA-N 187.199 -1.871 50 10 AAGE C=C(Cn1cncc(F)c1=O)B(O)O 2210074772 DXCOCXDXUNKBHH-UHFFFAOYSA-N 197.962 -1.049 50 10 AAGE C[C@H]1OC2(C(=O)NN)CC1(N)C2 2241400657 XSBFJWHKUHROLJ-SIZQZZMJSA-N 171.200 -1.375 50 10 AAGE N[C@H]1C[C@H]1NC(=O)C#CB(O)O 2241468011 FWGHUNZBLAYMIX-CRCLSJGQSA-N 167.961 -2.782 50 10 AAGE O=C(C#CB(O)O)N1C[C@H]2C[C@H]2C1 2241471728 LMHZVJQWVSMJIO-KNVOCYPGSA-N 178.984 -1.520 50 10 AAGE NC/C=C/CNC(=O)[C@H]1C[C@H]1B(O)O 2241475298 VKMPXTYIFPRICB-FJZRIBRESA-N 198.031 -1.520 50 10 AAGE NC/C=C/CNC(=O)C1(B(O)O)CC1 2241481376 RUHQRRNGCUMBRY-OWOJBTEDSA-N 198.031 -1.376 50 10 AAGE CC(=O)N(CC(=O)O)NCC(=O)O 238141621 HXPGXAOYRLSDHS-UHFFFAOYSA-N 190.155 -1.491 50 10 AAGE Cc1nccn(CC(=O)NN)c1=O 307332988 FIRYQMCEYZNWPK-UHFFFAOYSA-N 182.183 -1.458 50 10 AAGE C=C(C#N)C[C@H](O)[C@H](O)[C@H](O)CO 308192554 KMVUDXPMQMKZOL-RNJXMRFFSA-N 187.195 -1.469 50 10 AAGE N[C@H]1CNN[C@@H]1Cl 585663007 ICHFHKGIMZPYIE-HRFVKAFMSA-N 121.571 -1.014 50 10 AAGE NNC(=O)[C@H]1[C@H]2CNCC[C@H]21 720943186 HZQSXKOOFQVEFI-NGJCXOISSA-N 155.201 -1.168 50 10 AAGE C[C-]1ON=C=C1CNC(=O)C(=O)NN 885890113 VVAOABFNOLRGPS-UHFFFAOYSA-N 197.174 -1.814 50 10 AAGE CNCC(=O)NN(C)S(C)(=O)=O 1888562129 PNIHOEOZXAFZRU-UHFFFAOYSA-N 195.244 -1.872 50 10 AAGE CN(NC(=O)CN)S(C)(=O)=O 1888606431 ZYOCDGFNGMEOHM-UHFFFAOYSA-N 181.217 -2.132 50 10 AAGE OCC1(O)CN(C[C@@H](O)CCl)C1 1953699389 FGUAVRITEZKVKQ-LURJTMIESA-N 195.646 -1.375 50 10 AAGE NNC(=O)CN1CC[C@@H]2C[C@]2(O)C1 1954024796 NRCBNQVAXRLVOL-SVRRBLITSA-N 185.227 -1.567 50 10 AAGE CN(CC(=O)NN)c1ccnn1C 1954105893 TXSINKNEEWRRNN-UHFFFAOYSA-N 183.215 -1.154 50 10 AAGE O=C(NCCO)c1cc(B(O)O)c[nH]1 2241468334 LXHMCPFPQOUKMZ-UHFFFAOYSA-N 197.987 -2.583 50 10 AAGE C/C(=N\O)NNC(N)=O 104634123 DFWRTHDTAKXISJ-UHFFFAOYSA-N 132.123 -1.033 50 10 AAGE COC(=O)[C@@H]1CCN[C@H]1B(O)O 238335877 CYEIEMSURJTRRY-RFZPGFLSSA-N 172.977 -1.851 50 10 AAGE Cc1cc(B(O)O)ccc1C(N)=O 306635669 DFGHKPPTZOWOJU-UHFFFAOYSA-N 178.984 -1.226 50 10 AAGE CCC(=O)NNC(=O)CNC(C)=O 308314405 UJEXTFWQJCAZJQ-UHFFFAOYSA-N 187.199 -1.320 50 10 AAGE C[C@@H]1C[C@H](O)CCN1CC(=O)NN 606258765 OXAZUDASYKRXJJ-RNFRBKRXSA-N 187.243 -1.179 50 10 AAGE C[C@H]1C[C@@]1(F)C(=O)NCB(O)O 1881630553 UVFKXPLHEQROJM-NJGYIYPDSA-N 174.968 -1.137 50 10 AAGE N#C[C@@H](O)[C@H](N)Cc1nn[nH]n1 1952795321 SAHGDVHOMDVEJE-QWWZWVQMSA-N 168.160 -2.046 50 10 AAGE NNC(=O)C[C@@H]1CCN1 1953147040 NZSHTQVXDXWXRW-BYPYZUCNSA-N 129.163 -1.272 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2C[C@H]1C[C@@H]2O 1956910769 GAIWHVJHBDFUCH-NGJRWZKOSA-N 199.254 -1.180 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@H](CO)[C@@H]2C1 1957215934 GZXQXQHWRXGSRI-XLPZGREQSA-N 199.254 -1.464 50 10 AAGE C[C@@H](N)CN=c1ncc(B(O)O)c[nH]1 2210061253 SDOGUSBXXNLAGD-RXMQYKEDSA-N 196.019 -2.663 50 10 AAGE C[C@H]1CC(=O)N1C(=O)C#CB(O)O 2241467837 BSBMKVURBFZSLK-YFKPBYRVSA-N 180.956 -1.851 50 10 AAGE C[C@H]1C[C@]1(F)CNC(=O)C#CB(O)O 2241467896 CUNZGHMMWPRNMV-XPUUQOCRSA-N 198.990 -1.134 50 10 AAGE CCn1cc(C(N)=O)nc1B(O)O 2241478321 CCFIYGRRXZDBBL-UHFFFAOYSA-N 182.976 -2.318 50 10 AAGE O=C(C#CB(O)O)Nc1ncon1 2241479230 UIXDIPVHQQKKTN-UHFFFAOYSA-N 180.916 -1.977 50 10 AAGE NC(=O)[C@H]1C[C@@H]1C(=O)NNCCO 2241522436 HGNOFMQZJJHURC-WHFBIAKZSA-N 187.199 -2.279 50 10 AAGE Cc1nn(C)c(C(=O)NN)c1N 26471571 IPPBWOUSOOZHHA-UHFFFAOYSA-N 169.188 -1.086 50 10 AAGE CN(C)CCN(C)CC(=O)NN 58841148 PRHWWYJNJCOGMQ-UHFFFAOYSA-N 174.248 -1.530 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2C[C@H]2C1=O 82924165 SGHHOPUEZOACCH-ZXZARUISSA-N 183.167 -2.019 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H](CO)C1 159411138 ASEPVZMCNIHZAS-RXMQYKEDSA-N 187.199 -2.183 50 10 AAGE COC(=O)c1cc(B(O)O)ccc1O 204052465 CSZNZZKWTLBZNA-UHFFFAOYSA-N 195.967 -1.141 50 10 AAGE OB(O)c1cc(F)cnc1O 238618426 SYPUOOQWURYPOJ-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE O=Cc1cncc(B(O)O)c1F 238636510 XQDXIVSNELKVHQ-UHFFFAOYSA-N 168.920 -1.287 50 10 AAGE OCc1cc(B(O)O)cnc1F 238712699 LXJBAUNZYYOMJB-UHFFFAOYSA-N 170.936 -1.607 50 10 AAGE Cc1cc(N)cc(B(O)O)n1 307180796 PLDFRAZFWQVQDJ-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE N#Cc1cc(B(O)O)cc(C#N)c1C#N 308783913 AHEQXTOTHQWSMZ-UHFFFAOYSA-N 196.962 -1.019 50 10 AAGE COC(=O)[C@H]1C[C@@H]1C(=O)NNC=O 379368149 XBCPIQQVBFQYMC-WHFBIAKZSA-N 186.167 -1.427 50 10 AAGE ON=Cc1ccc(B(O)O)o1 382769816 HZHNCGMNIFLZES-UHFFFAOYSA-N 154.918 -1.233 50 10 AAGE N[C@@H]1N[C@H](Cl)N[C@H]2NCN[C@H]12 585663896 IDFMJJJXQBRRKV-AIHAYLRMSA-N 177.639 -2.169 50 10 AAGE Cn1cc(CC(=O)NCB(O)O)cn1 701964687 HRHCNNQUCXKCCK-UHFFFAOYSA-N 197.003 -1.909 50 10 AAGE N#C[C@@H](O)[C@@H]1CNCCO1 1880121163 OSPAPYZOHAITAV-RITPCOANSA-N 142.158 -1.141 50 10 AAGE N#C[C@@H](O)[C@@H](N)c1nc[nH]n1 1952884475 HKLGLUAXSIZBSW-QWWZWVQMSA-N 153.145 -1.311 50 10 AAGE NNC(=O)NCc1nnnn1C1CC1 1956715971 IMKRUKNIFNGEAT-UHFFFAOYSA-N 197.202 -1.319 50 10 AAGE C[C@H](NC(=O)C#CB(O)O)C(C)(C)O 2241467870 CGUVISNAIVACCV-LURJTMIESA-N 199.015 -1.723 50 10 AAGE C=C[C@H](C)ONC(=O)C#CB(O)O 2241478201 ADANQYMINAPQKF-LURJTMIESA-N 182.972 -1.376 50 10 AAGE CCOC(=O)c1cc(B(O)O)n(C)n1 2241494298 WPGPPAFZRNBKNX-UHFFFAOYSA-N 197.987 -1.723 50 10 AAGE NNC(=O)N1CCC[C@H]1C(N)=O 36948133 ZBCYFOCUQJZQSV-BYPYZUCNSA-N 172.188 -1.481 50 10 AAGE OC[C@H](O)[C@@H](O)Cl 113142800 URWVQQSVEPXYET-STHAYSLISA-N 126.539 -1.103 50 10 AAGE O=C1NC(=O)[C@H](Cl)[C@H](NO)N1 167569996 JXZRXCWDXFCZOD-NCGGTJAESA-N 179.563 -1.262 50 10 AAGE CC(=O)N(C)CB(O)O 195953186 QSUIVIHTPQGKIT-UHFFFAOYSA-N 130.940 -1.523 50 10 AAGE C[C@@H](NC(=O)[C@@H](C)N)B(O)O 222266654 CHOIZHQITXLUNX-QWWZWVQMSA-N 159.982 -2.150 50 10 AAGE C=C(B(O)O)C(=O)OC 238350943 KAUVWUIBVVRMNH-UHFFFAOYSA-N 129.908 -1.272 50 10 AAGE CNC(=O)C[C@H](C)NC(=O)NN 306500007 XFFVNUOVCNGJSN-BYPYZUCNSA-N 174.204 -1.316 50 10 AAGE CN(N)C(=O)[C-]1C#CC(=O)NN1 642841848 PKUOWSNOUJHCQZ-UHFFFAOYSA-N 167.148 -2.512 50 10 AAGE O=C(NCB(O)O)c1cnns1 702016885 AKKYGKFOEVXKBY-UHFFFAOYSA-N 186.989 -1.720 50 10 AAGE CN(CC(=O)NN)C[C@H]1C[C@@H](O)C1 703796666 JURCXNOTDWUCCW-KNVOCYPGSA-N 187.243 -1.321 50 10 AAGE CC1=C=C(C(=O)NN)N[N]1 885194079 YYMKMEIOUATOFJ-UHFFFAOYSA-N 139.138 -1.515 50 10 AAGE C#CCOCC(=O)NNC(N)=O 1881028917 NDOBLGULBMBFHY-UHFFFAOYSA-N 171.156 -1.664 50 10 AAGE CN1C[C@@H]2C[C@H](C1)N2C(=O)NN 1881033284 MCSOYLPILJNIOJ-OLQVQODUSA-N 170.216 -1.042 50 10 AAGE Cn1cc(C(=O)O)c(B(O)O)n1 1881526710 TYFSHCACBICKJS-UHFFFAOYSA-N 169.933 -2.202 50 10 AAGE CCS(=O)(=O)N(C)NC=O 1888562639 YLWCHOQCGWWRBX-UHFFFAOYSA-N 166.202 -1.071 50 10 AAGE C[C@@H](C(=O)NN)N(C)C1CC(O)C1 1914601204 LEQLHPWNURBZEA-VTSJMVTISA-N 187.243 -1.180 50 10 AAGE CN1CC[C@@H](CNC(=O)NN)C1=O 1968131896 QCQQIQDVDNVCMH-YFKPBYRVSA-N 186.215 -1.362 50 10 AAGE CCO[C@H](C)CNC(=O)C#CB(O)O 2241470865 DLPUVLKRHGQXSB-SSDOTTSWSA-N 199.015 -1.457 50 10 AAGE CN(O)C(=O)c1ccc(B(O)O)o1 2241472767 XLJZBWZAJYHNMU-UHFFFAOYSA-N 184.944 -1.579 50 10 AAGE C[C@H](CCN)N(C)C(=O)C#CB(O)O 2241478897 NEZQMJMEKFCCRN-SSDOTTSWSA-N 198.031 -1.803 50 10 AAGE CN[C@H](C)CCNC(=O)C#CB(O)O 2241479284 VQGIHRLAHUAYFO-SSDOTTSWSA-N 198.031 -1.884 50 10 AAGE O=C(N[C@H]1C[C@H](O)C1)C1(B(O)O)CC1 2241481926 XFJZLLSVYPMNQP-IZLXSQMJSA-N 199.015 -1.367 50 10 AAGE O=C1C[C@@]2(CN1)CC(=O)OC2=O 100462049 FVYAKGFRJJGRPR-ZETCQYMHSA-N 169.136 -1.034 50 10 AAGE O=NN(CCO)C(=O)NCCO 142382096 MGJFUNNFROBLRL-UHFFFAOYSA-N 177.160 -1.336 50 10 AAGE C[C@H](N)C(=O)NN(C)C 147240530 QSUHSTBECLPSNP-BYPYZUCNSA-N 131.179 -1.074 50 10 AAGE CCNc1ncc(B(O)O)c(OC)n1 217586129 BUCUTWJVAYAYOQ-UHFFFAOYSA-N 197.003 -1.403 50 10 AAGE O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](Cl)[C@H]1O 306225864 BSMLUJHFZGTHOG-SHFUYGGZSA-N 198.602 -2.588 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@@H](N)C1 306430604 ZOAUACUQCCPLJA-PHDIDXHHSA-N 172.232 -1.602 50 10 AAGE NNC(=O)CCc1nnc[nH]1 307711115 SCKUFZQLIUGFKG-UHFFFAOYSA-N 155.161 -1.273 50 10 AAGE NNC(=O)C[C@@H](O)[C@@H](O)[C@@H](O)CO 379360420 BECUBMLLHUYFKV-ALEPSDHESA-N 194.187 -3.559 50 10 AAGE C[C@H]1C[C@H]1C(=O)NCB(O)O 575452330 WYWIAAUQGKFUOJ-CRCLSJGQSA-N 156.978 -1.229 50 10 AAGE NP(N)(N)=O 606532869 DMSZORWOGDLWGN-UHFFFAOYSA-N 95.042 -1.029 50 10 AAGE CC(C)[N+]1=C=C([C@@H](O)C#N)NN1 642842861 WDPSIGOLPXFIAN-ZETCQYMHSA-N 167.192 -1.132 50 10 AAGE C[C@H](NC(N)=O)C(=O)NNC(N)=O 700880593 XJNFDJDLKOGDSX-REOHCLBHSA-N 189.175 -2.257 50 10 AAGE C[C@H](CC(=O)NN)N1C#CNN1 885308364 AXUZILRRKDNBPR-RXMQYKEDSA-N 169.188 -2.002 50 10 AAGE CC[C@@H](C(=O)NN)N1CC=C[C@H]1CO 1884400145 PAAGDUMVACEXGX-YUMQZZPRSA-N 199.254 -1.012 50 10 AAGE NNC(=O)C(=O)NC1CC2(COC2)C1 1885766670 INOIQCMJIIVPOT-UHFFFAOYSA-N 199.210 -1.729 50 10 AAGE NNC(=O)C(=O)N1CCC2(COC2)C1 1915568019 MKPBKWUEEVKACY-UHFFFAOYSA-N 199.210 -1.775 50 10 AAGE C[C@H](CF)C(=O)NNC(=O)CO 1923695671 WZLSMNYZVRXEKD-SCSAIBSYSA-N 178.163 -1.268 50 10 AAGE NNC(=O)NCCN1CCNC1=O 1928983123 VFPVQIVKNGTNIA-UHFFFAOYSA-N 187.203 -1.816 50 10 AAGE O=C(C#CB(O)O)N[C@H]1CCC[C@H]1O 2241472697 WJIKEEAWINVSQW-NKWVEPMBSA-N 196.999 -1.969 50 10 AAGE C[C@@H](N)CNC(=O)[C@H]1C[C@@H]1B(O)O 2241474801 LFMLJXBPJVRITI-SRQIZXRXSA-N 186.020 -1.687 50 10 AAGE N[C@@H]1C[C@@H]1NC(=O)[C@H]1C[C@H](B(O)O)C1 2241496927 XKVAKBBMOAWJSY-GBNDHIKLSA-N 198.031 -1.545 50 10 AAGE CCN(CCC(=O)NN)CC(N)=O 231828532 TYAWVADIAKEDBY-UHFFFAOYSA-N 188.231 -1.826 50 10 AAGE N[C@@H](C(=O)NO)[C@@H](Cl)C(=O)NO 238604557 UHJFHOUBAICLHE-JCYAYHJZSA-N 197.578 -2.068 50 10 AAGE OB(O)c1ccccc1C1NCCN1 238628014 IPCFTWJQSUDDTD-UHFFFAOYSA-N 192.027 -1.442 50 10 AAGE N#C[C@@H]1C(=O)N[C@H](N)N[C@@H]1Cl 306371141 IXYQRNOIJKOMGK-TXQLHFEISA-N 174.591 -1.347 50 10 AAGE C=C(CN1CCOCC1)B(O)O 306412086 PFMGTVKKAJKIGM-UHFFFAOYSA-N 171.005 -1.113 50 10 AAGE NNC(=O)N1CC(CC(N)=O)C1 306535468 GFVJKMARGCCIKG-UHFFFAOYSA-N 172.188 -1.623 50 10 AAGE C/C(=N\NC(N)=O)[C@@H]1NCCNC1=O 306682589 RUIBUAOXPKEXDZ-QCGUHCPDSA-N 199.214 -1.881 50 10 AAGE C#CCCS(=O)(=O)NCB(O)O 710142532 FTDJDFKEGUVYJM-UHFFFAOYSA-N 191.017 -2.059 50 10 AAGE C[C@@H](C(=O)NN)N1C#C[C-](C(N)=O)N1 885843449 SVOYELLJODTHPL-BYPYZUCNSA-N 196.190 -2.837 50 10 AAGE COC[C@@H]1C[C@@H]1C(=O)NNC(N)=O 1882998561 WLYUQEWTKGRJLI-WHFBIAKZSA-N 187.199 -1.032 50 10 AAGE C[C@@H]1CCN(C(=O)NN)[C@H]1C(N)=O 1928670811 CXTUJJMNPGIOAT-RFZPGFLSSA-N 186.215 -1.235 50 10 AAGE CN(C)NC(=O)C[C@H]1CNC[C@@H]1O 1954193878 GDGSUGDUVDAYGO-BQBZGAKWSA-N 187.243 -1.450 50 10 AAGE C=CCOC(=O)NCC#CB(O)O 2209347124 CMYCFCROZZJESM-UHFFFAOYSA-N 182.972 -1.086 50 10 AAGE C[C@@H](N)CN=c1ncc(B(O)O)c[nH]1 2210068437 SDOGUSBXXNLAGD-RXMQYKEDSA-N 196.019 -2.663 50 10 AAGE O=C(C#CB(O)O)N1CC2(COC2)C1 2241478402 DOKJJCIAOJVZDU-UHFFFAOYSA-N 194.983 -2.139 50 10 AAGE Cn1nccc1C#CB(O)O 2297009482 GVOMPTFLUYMUOY-UHFFFAOYSA-N 149.946 -1.216 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H](O)[C@H]1C2 2297052157 OCJZMOHFTZITBH-JKUQZMGJSA-N 199.210 -2.042 50 10 AAGE CN(N)C(=O)N(C)N 75519713 GEHSPUUOOBRSAF-UHFFFAOYSA-N 118.140 -1.283 50 10 AAGE OCC(O)(CO)CCl 104725027 OLRCQHCLDPABNH-UHFFFAOYSA-N 140.566 -1.059 50 10 AAGE C#Cc1ccc(B(O)O)cn1 238620245 GEJRDYXQYVDHFX-UHFFFAOYSA-N 146.942 -1.257 50 10 AAGE O=CNNc1n[nH]c(=O)[nH]c1=O 238630165 DFOQMKZAZCXDCZ-UHFFFAOYSA-N 171.116 -2.469 50 10 AAGE O=C1NCc2ccc(B(O)O)nc21 238647766 CIKOTAFCEFRJQW-UHFFFAOYSA-N 177.956 -1.995 50 10 AAGE COc1ccnc(NNC(=O)CN)n1 306406451 WJZCQWHAUDGVLG-UHFFFAOYSA-N 197.198 -1.113 50 10 AAGE O[C@H](CCl)[C@H](O)[C@H](O)[C@@H]1CO1 307648302 DQODCZOZAFGOJJ-DPYQTVNSSA-N 182.603 -1.293 50 10 AAGE C[C@H](CCC(=O)NN)N1CC(O)C1 384104241 FWDFXAKPAMKPPU-ZCFIWIBFSA-N 187.243 -1.179 50 10 AAGE N#CC[S@@](=O)CC(=O)NN 526867904 FCSZCUSATSRGHW-SNVBAGLBSA-N 161.186 -1.751 50 10 AAGE Cn1ncc(B(O)O)c1CCl 584881737 ONPKPJNJQFQAQA-UHFFFAOYSA-N 174.396 -1.161 50 10 AAGE CO[C@@H](C)[C@@H](N)C(=O)NN 885234285 FOZYZGQIVZHPSG-IUYQGCFVSA-N 147.178 -1.662 50 10 AAGE Cc1ncnc(B(O)O)c1C 1880516649 WXKBMUWCJSFWLQ-UHFFFAOYSA-N 151.962 -1.227 50 10 AAGE O=C1C[C@H](CN2CC[C@@H](B(O)O)C2)N1 1891516057 DEWCAPZREBXKSE-RNFRBKRXSA-N 198.031 -1.576 50 10 AAGE Cc1nc(B(O)O)nn1C 1929098684 MWKLGJHQYKQRDX-UHFFFAOYSA-N 140.939 -2.197 50 10 AAGE CN(C)NC(=O)CNCCO 1953302205 AWTVKLCNEXSTAG-UHFFFAOYSA-N 161.205 -1.839 50 10 AAGE N[C@]1(B(O)O)COCCC1(F)F 1953404485 LIZQZPHNBIVIRN-SCSAIBSYSA-N 180.947 -1.249 50 10 AAGE NNc1nccc(B(O)O)c1F 2209094661 WHFBDAWMYDZTHB-UHFFFAOYSA-N 170.940 -1.814 50 10 AAGE N[C@@H]1C[C@@H]1Nc1ccc(B(O)O)cn1 2210060427 KEOBVLMWCOTXIS-RQJHMYQMSA-N 193.015 -1.727 50 10 AAGE CCn1cc(B(O)O)cc1C(=O)NN 2241473893 RXSVWWHTHIVCQD-UHFFFAOYSA-N 197.003 -2.209 50 10 AAGE NCCNC(=O)c1occc1B(O)O 2241474068 VWZACYKQXVLEQC-UHFFFAOYSA-N 197.987 -2.352 50 10 AAGE CN(N)C(=O)C1(O)CC1 2297007015 GCFJWXATFONFSW-UHFFFAOYSA-N 130.147 -1.157 50 10 AAGE C[C@@H](O)CN[C@H](C)CC(=O)NN 58839079 MHJHFCJXOIUGEU-PHDIDXHHSA-N 175.232 -1.275 50 10 AAGE Cc1ccnn(CC(=O)NN)c1=O 71773355 HUXUUCKNBFUYSB-UHFFFAOYSA-N 182.183 -1.458 50 10 AAGE NC[C@@H](O)/C=N/NC(N)=O 104657331 VNHDCAWCEVBZLJ-DEVJWOQWSA-N 146.150 -2.040 50 10 AAGE N#C[C@@H](O)CO 116317421 GLZDDCMPOSSPQC-GSVOUGTGSA-N 87.078 -1.137 50 10 AAGE Cc1cc(B(O)O)nc(N)n1 199487424 ALYXCOOMZUJUES-UHFFFAOYSA-N 152.950 -1.953 50 10 AAGE CO[C@H]1CCN(CC(=O)NN)C1 234793484 RBEWMSPCTLUNEZ-LURJTMIESA-N 173.216 -1.303 50 10 AAGE CC[C@H](CO)C(=O)NN 238306911 CLSAJSSACJKBCC-SCSAIBSYSA-N 132.163 -1.005 50 10 AAGE NCc1ccc2c(c1B(O)O)OCO2 258160611 UZKYUDNJYHMAHE-UHFFFAOYSA-N 194.983 -1.446 50 10 AAGE CC(C)n1nnnc1CB(O)O 698414524 CHNMCEKISYAEED-UHFFFAOYSA-N 169.981 -1.192 50 10 AAGE COCC1=S=C=C(C(=O)NN)N1 885505455 RLZYXNYDHGPYNJ-UHFFFAOYSA-N 187.224 -1.626 50 10 AAGE CC(=O)NNC(=O)/C=C/C(=O)N(C)C 1290392037 QESZXLAJHLMLLG-SNAWJCMRSA-N 199.210 -1.202 50 10 AAGE CN(C)NC(=O)C[C@H]1COC[C@@H]1N 1882796296 BSGPJKWJFHLAFO-BQBZGAKWSA-N 187.243 -1.057 50 10 AAGE O=C(COC1CC1)NCC#CB(O)O 1895149054 NRCWJIOISXXDBZ-UHFFFAOYSA-N 196.999 -1.703 50 10 AAGE N#C[C@@H](O)[C@H](N)c1nc(O)nc(O)n1 1953071259 LYYDVTSVZWBDKN-GBXIJSLDSA-N 197.154 -1.833 50 10 AAGE C[C@@H](O)[C@H](N)C(=O)NN(C)C 1953343253 APOPFPMGCYSXQC-UHNVWZDZSA-N 161.205 -1.713 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2C[C@H]1[C@H]1C[C@H]21 1955370181 VJOPVIUPOLJXBY-AXMZGBSTSA-N 195.222 -1.157 50 10 AAGE OCCN1CC[C@H](B(O)O)C1 2208964911 WLEBTYJLRFIBEG-LURJTMIESA-N 158.994 -1.473 50 10 AAGE Cc1cnc(NN(C)C)cc1B(O)O 2210066482 VHLWXFNCNJLCQM-UHFFFAOYSA-N 195.031 -1.042 50 10 AAGE CO[C@]1(C)C[C@H]1NC(=O)C#CB(O)O 2241468588 QVVUJBFMTUPQJT-HTRCEHHLSA-N 196.999 -1.705 50 10 AAGE O=C(C#CB(O)O)NCC1[C@H]2CC[C@H]12 2241478509 GUAVQTWLNPVWFN-BQBZGAKWSA-N 193.011 -1.226 50 10 AAGE CON(C)C(=O)[C@H]1C[C@@H]1B(O)O 2241480489 LFKCAXVWEJARHM-WHFBIAKZSA-N 172.977 -1.131 50 10 AAGE CN(C)C(=O)c1cnn(C)c1B(O)O 2241481209 PZHLKRFMYIIALK-UHFFFAOYSA-N 197.003 -2.198 50 10 AAGE CN(O)C(=O)c1cn(C)nc1B(O)O 2241496587 VIDDWDANUCVGLC-UHFFFAOYSA-N 198.975 -2.439 50 10 AAGE OC[C@H](O)[C@@H](Cl)CO 39074080 FKAYVCGCODVBDC-IMJSIDKUSA-N 140.566 -1.061 50 10 AAGE CCNC(=O)NNC1=NCCN1 45821102 PCZKFLOKMOMWRE-UHFFFAOYSA-N 171.204 -1.231 50 10 AAGE NNC(=O)c1c[nH]cc1C(=O)NN 78746406 RKERXSDUKBVIBM-UHFFFAOYSA-N 183.171 -1.778 50 10 AAGE CN(CCC(=O)NN)CC(N)=O 82467297 HLIGRMXJYPHZPI-UHFFFAOYSA-N 174.204 -2.217 50 10 AAGE CCN(CCO)[C@H](C)C(=O)NN 82468809 XRQAGHMYAQUZCR-ZCFIWIBFSA-N 175.232 -1.321 50 10 AAGE O=C1CC(O)(C(=O)O)CC(=O)O1 140920148 VCWXNLBZWBSDIB-UHFFFAOYSA-N 174.108 -1.334 50 10 AAGE NNC(=O)[C@@H](O)C1CC1 143066580 HSOXOSXOKBEILN-BYPYZUCNSA-N 130.147 -1.253 50 10 AAGE OB(O)c1cnn([C@H]2CCCOC2)c1 222670700 MMLBCXFAUVOUFP-QMMMGPOBSA-N 196.015 -1.086 50 10 AAGE COc1cccc(B(O)O)c1CO 238358527 SKNBIIMDMOFNPW-UHFFFAOYSA-N 181.984 -1.133 50 10 AAGE NCc1nc(O)ccc1B(O)O 238593973 MTGONOUYNZAGOV-UHFFFAOYSA-N 167.961 -2.074 50 10 AAGE O=C(O)CNC(=O)[C@@H](O)CCl 238672510 ISTMBDGKSJFOBZ-VKHMYHEASA-N 181.575 -1.213 50 10 AAGE C[C@@H](C(N)=O)[S@@](=O)CC(=O)NN 526910988 ORTFNSRQCCFNOS-CMEQDNRLSA-N 193.228 -2.401 50 10 AAGE N[C@@]1(B(O)O)CCO[C@]12CCOC2 885503645 DMNHAQGJSDSUGI-BQBZGAKWSA-N 187.004 -1.725 50 10 AAGE N#CC1=C(N2C[C@H](O)CO2)NNC#C1 885589596 QHXKQZWBYBBASS-ZETCQYMHSA-N 192.178 -1.602 50 10 AAGE CC(=NNC(=O)C(N)=O)c1cn[nH]c1 1321107185 VOOUGTRQILZXHF-UHFFFAOYSA-N 195.182 -1.265 50 10 AAGE N=c1[nH][nH]cc1B(O)O 1879961632 LYIHOLWLUMKZEP-UHFFFAOYSA-N 126.912 -2.498 50 10 AAGE NNC(=O)C(=O)NC[C@@H]1C[C@H]1F 1881096900 DBJGARQBVUVCNJ-IUYQGCFVSA-N 175.163 -1.550 50 10 AAGE N[C@@]1(B(O)O)CO[C@]2(CCOC2)C1 1882151833 JOZBGAKLSCAVCD-RNFRBKRXSA-N 187.004 -1.725 50 10 AAGE NNC(=O)CN1CCC2CC1(CO)C2 1887074065 YCGZDMPNWGKULI-UHFFFAOYSA-N 199.254 -1.177 50 10 AAGE C[S@@](=O)N1CC[C@H](B(O)O)C1 1891606630 GTLDCXADGUKTAV-ULHQUTTKSA-N 177.034 -1.171 50 10 AAGE O=C(C#CB(O)O)NCCC#CCO 1892464396 SMZHISTYTRVYBL-UHFFFAOYSA-N 194.983 -2.496 50 10 AAGE NNC(=O)N1CCOC[C@@H](CO)C1 1933580982 IHQCNKHASZSJHY-ZCFIWIBFSA-N 189.215 -1.490 50 10 AAGE C=CCN(C)c1ncc(B(O)O)cn1 2210060284 IJDVIVYDURCMDK-UHFFFAOYSA-N 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2241495853 NQPMTJRFSAYRJF-UHNVWZDZSA-N 194.987 -1.367 50 10 AAGE O=CNc1cc(B(O)O)ccn1 2241556675 ZQMIWWDERLRFOV-UHFFFAOYSA-N 165.945 -1.670 50 10 AAGE CC(=O)NCCC#CB(O)O 2241910975 YYBYRIIWZFTLRW-UHFFFAOYSA-N 154.962 -1.472 50 10 AAGE CN1CCN(C(=O)NN)CC1=O 82775014 RGFZUIJEDBOFSI-UHFFFAOYSA-N 172.188 -1.656 50 10 AAGE CN(C)C(=O)NCCNC(=O)NN 133441156 LKBPJVXQBFSODS-UHFFFAOYSA-N 189.219 -1.570 50 10 AAGE CC(=O)N[C@@H](C(=O)NN)[C@H](C)O 238470546 CBVHCLYCQVWDIK-WVZVXSGGSA-N 175.188 -2.138 50 10 AAGE C[C@H](SCC(N)=O)C(=O)NN 300774230 RQTYIIRKMOAJHH-VKHMYHEASA-N 177.229 -1.417 50 10 AAGE NNC(=O)[C@@]12CCOC[C@@H]1CNC2 715428107 YLYJOGAXWSWYLQ-POYBYMJQSA-N 185.227 -1.398 50 10 AAGE C[C@H](C(=O)NN)N1C#[N+]C(=C=N)N1 885374985 XTTBJRIRRBKLLM-SCSAIBSYSA-O 181.179 -1.435 50 10 AAGE NNC(=O)[C@@H]1C[C@H]1CN1C#CNN1 885390060 HDGCQNBNGUSHAZ-NTSWFWBYSA-N 181.199 -2.144 50 10 AAGE C[C-]1NC#CN1C[C@H]1C[C@H]1C(=O)NN 885687531 MUQNUIPRMTXDAY-HTQZYQBOSA-N 193.230 -1.055 50 10 AAGE CCNC(=O)NNC(=O)C=NOC 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Nc1ncc(C=O)cc1B(O)O 238685947 KYWXBTYDPXJYLQ-UHFFFAOYSA-N 165.945 -1.844 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H](O)[C@H](O)C1 300192036 QRJDCKJRZZHQQZ-HSUXUTPPSA-N 189.215 -2.598 50 10 AAGE NNC(=O)[C@@H]1CC(=O)N(N)C1 306375598 MBBDGWPFNHMOME-GSVOUGTGSA-N 158.161 -2.302 50 10 AAGE C[C@H](CN1CC(O)C1)C(=O)NN 307449740 RDXFCEJJULFFTK-RXMQYKEDSA-N 173.216 -1.711 50 10 AAGE N#C[C@]1(O)C[C@@H](O)[C@H]2O[C@H]21 307657259 ZZFYRSMSXDWPRD-KVTDHHQDSA-N 141.126 -1.227 50 10 AAGE COCC(COC)NC(=O)NN 388433676 NWKAZDRLHBXBGX-UHFFFAOYSA-N 177.204 -1.179 50 10 AAGE Cc1nn(CC(=O)NN)c(=O)o1 606253138 GIAUXKKUHRVLLI-UHFFFAOYSA-N 172.144 -1.865 50 10 AAGE O=C(NCCN[N+](=O)[O-])N[N+](=O)[O-] 687758572 ZASIHNYPEOHWMG-UHFFFAOYSA-N 193.119 -1.741 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2CC[C@@H]2C1 711124528 DYPCXYNADMKUPO-PHDIDXHHSA-N 183.211 -1.155 50 10 AAGE CC(F)(F)[C@H](N)C(=O)NN 1880054561 QWDWCQVIPGJDRP-UWTATZPHSA-N 153.132 -1.041 50 10 AAGE CCN1CCC[C@](N)(B(O)O)C1 1953484267 VRYPVPWHIQWRGT-SSDOTTSWSA-N 172.037 -1.188 50 10 AAGE C[C@@H]1CNC(=O)C[C@@](N)(B(O)O)C1 1954486336 QTGNQUPAMAYLRE-CAHLUQPWSA-N 186.020 -1.758 50 10 AAGE Cc1cc(C(=O)NC#N)oc1B(O)O 2241481163 PIXPMKXIZDNXHP-UHFFFAOYSA-N 193.955 -1.521 50 10 AAGE C=C=CCC(=O)NCC#CB(O)O 2241555707 PRNYPSRCRQYVKI-UHFFFAOYSA-N 178.984 -1.151 50 10 AAGE CS(=O)(=O)NCCNC(=O)NN 36733406 KLJVTZAZWCZEJU-UHFFFAOYSA-N 196.232 -2.292 50 10 AAGE C[C@@H](N)C(=O)OC(=O)[C@@H](C)N 103722725 NHJBLCGVMVJTBN-QWWZWVQMSA-N 160.173 -1.249 50 10 AAGE OCc1cccc(CO)c1B(O)O 204759640 AXZKCBMJVKLMFI-UHFFFAOYSA-N 181.984 -1.649 50 10 AAGE NNC(=O)CN(N)CC(=O)NN 224745066 UDUMBGWUYNXPDW-UHFFFAOYSA-N 176.180 -3.858 50 10 AAGE COc1c(B(O)O)cccc1B(O)O 230544476 CTFUAXLXSNIVFI-UHFFFAOYSA-N 195.776 -2.945 50 10 AAGE NCc1nccc(F)c1B(O)O 238610953 RQFCNDLPZYIEME-UHFFFAOYSA-N 169.952 -1.641 50 10 AAGE [C-]#[N+][C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@H]1O 306387866 UJALVCFSKOLTHI-IECVIRLLSA-N 189.167 -2.294 50 10 AAGE C/C(=C\C(=O)NNC(N)=O)C(=O)O 307020808 ZYWRZJQHDJOXEF-NSCUHMNNSA-N 187.155 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CC[C@H](N)C(=O)N(C)[C@@H](C)B(O)O 222268583 XLDOIPBSVVFRIC-WDSKDSINSA-N 188.036 -1.417 50 10 AAGE O=Cc1n[nH]c2ncc(B(O)O)cc12 238655630 FNSPTWKYOSPOCV-UHFFFAOYSA-N 190.955 -1.550 50 10 AAGE O[C@@H]1O[C@H](CCl)[C@H](O)[C@H]1O 306282769 BFLITKCZBOUHRA-KKQCNMDGSA-N 168.576 -1.336 50 10 AAGE COC1CN([C@@H](C)C(=O)NN)C1 306305025 RPCGHJZCROKRRP-YFKPBYRVSA-N 173.216 -1.305 50 10 AAGE C=CC(=O)NCB(O)O 575563643 PVFQMYXEWRFDNG-UHFFFAOYSA-N 128.924 -1.699 50 10 AAGE OB(O)c1cnn([C@@H]2CCCO2)c1 606256349 AWOQJJIAXDXXID-ZETCQYMHSA-N 181.988 -1.128 50 10 AAGE ClCS[C@@H]1NN[C@H]2NCNN21 953055312 VRNJZESRJTYCFO-QWWZWVQMSA-N 195.679 -1.042 50 10 AAGE O=C(CO)NNC(=O)[C@H]1C[C@H]1F 1654451196 VWAIDUQJTRMYEY-IUYQGCFVSA-N 176.147 -1.516 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@H](C1)O2 1881448801 TYGLJPUILOEKHR-OLQVQODUSA-N 171.200 -1.551 50 10 AAGE CON(C)c1ncc(F)cc1B(O)O 1887686508 ASLODYXPUYUIBJ-UHFFFAOYSA-N 199.978 -1.102 50 10 AAGE NNC(=O)CN1CCC1=O 1928992177 NAWOWMWRGLKCNI-UHFFFAOYSA-N 143.146 -1.791 50 10 AAGE C#CCOc1ncc(B(O)O)cn1 2209388728 ZNYIHQQIFGXURB-UHFFFAOYSA-N 177.956 -1.832 50 10 AAGE O=C(N1CCOCC1)C1(B(O)O)CC1 2241474035 VMBBXHAXYUDXLA-UHFFFAOYSA-N 199.015 -1.148 50 10 AAGE CN(CC(=O)NC1CC1)C(=O)NN 42692516 HFCSIOIMISJYBC-UHFFFAOYSA-N 186.215 -1.220 50 10 AAGE NNC(=O)CN(CCO)C1CC1 82470827 BHRLEZGDWQUYIC-UHFFFAOYSA-N 173.216 -1.567 50 10 AAGE O=CNNC(=O)NC=O 104617961 SBEOXPUUJVLOCP-UHFFFAOYSA-N 131.091 -1.897 50 10 AAGE OC[C@H]1O[C@@H](Cl)[C@H](O)[C@@H](O)[C@H]1O 139948847 JPYHXSWNADKGBI-FPRJBGLDSA-N 198.602 -1.975 50 10 AAGE CC(=O)N1C(=O)N[C@H]2C(=O)OC(=O)[C@@H]21 238053832 OZKKVMOXYNOZIO-QWWZWVQMSA-N 198.134 -1.621 50 10 AAGE NCc1nc(N)ccc1B(O)O 238592415 XCZATRLIFKUVPC-UHFFFAOYSA-N 166.977 -2.198 50 10 AAGE NNC(=O)C(NC(N)=O)NC(N)=O 238654599 XBYFHVALCFLATB-UHFFFAOYSA-N 190.163 -3.361 50 10 AAGE [C-]#[N+]C1=C[C@H](O)[C@](O)([C@H](C)O)[C@@H]1O 306234463 DIACYUPTLLZTEL-ZAKLUEHWSA-N 185.179 -1.363 50 10 AAGE NNc1ccc(F)cc1B(O)O 307050056 LDCDHLGNUPBCQK-UHFFFAOYSA-N 169.952 -1.209 50 10 AAGE CC[C@@H](CNC(=O)C(=O)NN)OC 308370385 KKZGHJZZTZDQHV-YFKPBYRVSA-N 189.215 -1.483 50 10 AAGE N#C/C(N)=C(/C#N)N=CNN 382416273 WRAVHIIGHHERKU-SNAWJCMRSA-N 150.145 -1.305 50 10 AAGE NNC(=O)C(=O)NC[C@@]12COC[C@@H]1C2 689283606 XBZLIWPVALNZJL-XNCJUZBTSA-N 199.210 -1.871 50 10 AAGE NNC(=O)NC1CC(CC(N)=O)C1 718462831 YTTFBLZZJCGMCC-UHFFFAOYSA-N 186.215 -1.187 50 10 AAGE NNC(=O)c1nc[nH]c1C(=O)O 1914775012 NULSWCSJABYLOH-UHFFFAOYSA-N 170.128 -1.289 50 10 AAGE C#CCN=c1cc(B(O)O)c(C)c[nH]1 2210066264 SZRVMVTZVQKWNC-UHFFFAOYSA-N 190.011 -1.463 50 10 AAGE CN(C(=O)C#CB(O)O)C1CC(N)C1 2241467809 BHXOOLZHONKSMS-UHFFFAOYSA-N 196.015 -2.050 50 10 AAGE CN(C[C@@H]1C[C@H]1F)C(=O)C#CB(O)O 2241478403 DOLNICWZUFLDGK-NKWVEPMBSA-N 198.990 -1.182 50 10 AAGE C=CCNC(=O)c1cc(B(O)O)n[nH]1 2241480394 ICLKERFJCMQSMD-UHFFFAOYSA-N 194.987 -1.995 50 10 AAGE N[C@H]1C[C@H]1NC(=O)C1(B(O)O)CCC1 2241481777 VLSLDIKJCJIRBO-NTSWFWBYSA-N 198.031 -1.401 50 10 AAGE CCOC(=O)c1c(B(O)O)nnn1C 2241493447 NJMBACZXYZNLOA-UHFFFAOYSA-N 198.975 -2.328 50 10 AAGE O=C1Cc2cccc(B(O)O)c2O1 238650524 DGEHKHACAYIWTJ-UHFFFAOYSA-N 177.952 -1.172 50 10 AAGE N#CC1=C[C@H](O)[C@H](O)[C@@H](CO)O1 238656911 XEFNLUVAZWYCPL-XVMARJQXSA-N 171.152 -1.493 50 10 AAGE C[C@@H](C(=O)NN)N(C)CCCO 300773590 RIVSXABVQCGUJU-LURJTMIESA-N 175.232 -1.321 50 10 AAGE C[C@@H]1NC(=O)[C@H](Cl)[C@@H](O)N1 306786045 KHVWBDHZOIDPHQ-PZGQECOJSA-N 164.592 -1.022 50 10 AAGE C[C@H](O)[C@H](O)[C@H](O)[C@H](O)C(=O)F 308010726 PDNVQOUXEOAXBR-FCAWWPLPSA-N 182.147 -2.054 50 10 AAGE COC[C@H](C)NNC(=O)C(=O)OC 308407246 KASIMIIQEVXOHZ-YFKPBYRVSA-N 190.199 -1.185 50 10 AAGE CCc1nnc(CB(O)O)n1C 698418009 MRRNBWSUCVEMHQ-UHFFFAOYSA-N 168.993 -1.068 50 10 AAGE C[C@@H]1OCC[C@@H]1C(=O)NCB(O)O 706525768 CBNCUAUKRQQMTF-WDSKDSINSA-N 187.004 -1.460 50 10 AAGE CN(CCn1cnnc1)C(=O)NN 707386583 UMBUTIPKZDVBGB-UHFFFAOYSA-N 184.203 -1.207 50 10 AAGE CS(=O)(=O)CNC(=O)NN 1880128596 RUDSCIZKMWOHGN-UHFFFAOYSA-N 167.190 -1.839 50 10 AAGE NNC(=O)C(=O)N1CC=C[C@@H]1CO 1881713697 FNPOXEJXFZMBMF-RXMQYKEDSA-N 185.183 -2.264 50 10 AAGE C[C@@H]1[C@H](O)CN1CC1(C(=O)NN)CC1 1885889133 PNXIXXQYTZWUKL-RNFRBKRXSA-N 199.254 -1.179 50 10 AAGE CCCc1nc(B(O)O)n(C)n1 1888376742 KOSIEFHWTPELEY-UHFFFAOYSA-N 168.993 -1.553 50 10 AAGE CONCCNC(=O)NN 1923407566 XQHPQDZFGARMFW-UHFFFAOYSA-N 148.166 -1.690 50 10 AAGE C[C@@H]1COC[C@H]1C(=O)NNCCO 1929837163 VQLJIWDRVNRCPV-RNFRBKRXSA-N 188.227 -1.118 50 10 AAGE C[C@]12C[C@H]1C(=O)N(CC(=O)NN)C2=O 1932149349 ZVEOESPSHRFNDY-NVNXEXLPSA-N 197.194 -1.629 50 10 AAGE O=C1CN(C2COC2)CC(=O)O1 1953647147 FTFAJLUKOYHHJU-UHFFFAOYSA-N 171.152 -1.229 50 10 AAGE O=C(NCB(O)O)c1ncc[nH]c1=O 1956427672 LWLOPDNMQCSRSM-UHFFFAOYSA-N 196.959 -2.488 50 10 AAGE CN1CC[C@H](CNC(=O)NN)C1=O 1968131895 QCQQIQDVDNVCMH-RXMQYKEDSA-N 186.215 -1.362 50 10 AAGE CNCCNc1cc(B(O)O)ccn1 2210067699 DDMWIDXMANKCFM-UHFFFAOYSA-N 195.031 -1.607 50 10 AAGE O=C(C#CB(O)O)Nc1nccnn1 2241468048 GLKBLFQIVXCNCG-UHFFFAOYSA-N 191.943 -2.175 50 10 AAGE CC(C)(CO)NCCC(=O)NN 58854912 AKMOLUSSLBARTA-UHFFFAOYSA-N 175.232 -1.273 50 10 AAGE NNC(=O)CCN1CCOCC1=O 86433413 PRHZCLGPMLZDAU-UHFFFAOYSA-N 187.199 -1.775 50 10 AAGE N#CC(O)(CO)CO 212462770 ASEFMDUYXPXIPT-UHFFFAOYSA-N 117.104 -1.774 50 10 AAGE C#CCNCC(=O)NNC(C)=O 379323092 NUXNQASVCMKPKN-UHFFFAOYSA-N 169.184 -1.624 50 10 AAGE NNC(=O)[C@H]1C[C@@H]1CN1CCOCC1 725608134 VDNGPFBCYOJLJP-SFYZADRCSA-N 199.254 -1.055 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2[C@H](O)C[C@H]2C1 1878211872 JEVUDIYIMUOKIR-ULAWRXDQSA-N 199.254 -1.323 50 10 AAGE CC(C)(N)[C@@H](O)C(=O)NN 1880008910 JTIQEKKVOYTLPS-VKHMYHEASA-N 147.178 -1.926 50 10 AAGE NC(=O)C1(O)CN(C(=O)CCl)C1 1915235687 DQPRLDAURJEROT-UHFFFAOYSA-N 192.602 -1.716 50 10 AAGE COCC1CN(CCC(=O)NN)C1 1916281035 GXIAAUUWOKMKQT-UHFFFAOYSA-N 187.243 -1.055 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@H]1CO 1929742135 VHGGTAMFIRGJGV-RITPCOANSA-N 173.216 -1.569 50 10 AAGE Cn1ncc2ccc(B(O)O)nc21 2209190477 CRLRNRVKFXQCFA-UHFFFAOYSA-N 176.972 -1.352 50 10 AAGE C[C@@H]1C[C@@]1(C)NC(=O)C#CB(O)O 2241476719 YGTCVZYYZUJUPE-HTRCEHHLSA-N 181.000 -1.084 50 10 AAGE CN=c1cc(B(O)O)c(F)c[nH]1 2297008402 IFYJMWDXPXDHSI-UHFFFAOYSA-N 169.952 -1.636 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2CC[C@H]1C2 49725055 JXODXXDEFRNOHJ-RITPCOANSA-N 183.211 -1.013 50 10 AAGE C[C@H](CO)N(C)CC(=O)NN 123715871 SYBQCQKYCCQEEK-RXMQYKEDSA-N 161.205 -1.711 50 10 AAGE C[C@@H](NC(=O)NN)C(=O)NN 220969341 LEAFOSBREAHKGK-UWTATZPHSA-N 161.165 -2.462 50 10 AAGE N#Cc1ncc(B(O)O)cc1C(=O)O 238631777 KULQZYRZUQYDQA-UHFFFAOYSA-N 191.939 -1.669 50 10 AAGE NCc1ccnc(O)c1B(O)O 238690533 VYAWDARVDHGSCJ-UHFFFAOYSA-N 167.961 -2.074 50 10 AAGE C[C@H](CC(=O)NN)N1CC(O)C1 307029295 JBBCEBBMSJLMMH-RXMQYKEDSA-N 173.216 -1.569 50 10 AAGE OB(O)c1cncc([C@H]2CCNC2)c1 307118635 QVSWJOZUQRAXDI-ZETCQYMHSA-N 192.027 -1.162 50 10 AAGE CC(=O)NNC(=O)[C@H]1CNC(=O)N1 307750642 KWPUKCIYAJVUBV-SCSAIBSYSA-N 186.171 -2.165 50 10 AAGE NC(=O)NN=C[C@H](O)CC(=O)O 383469682 ABIQLZDXXHSREG-GSVOUGTGSA-N 175.144 -1.524 50 10 AAGE CN(C)NC(=O)C[C@H](O)CN 703301216 HOFHCULHYHHRLY-YFKPBYRVSA-N 161.205 -1.711 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@@H]2[C@H]1CO 1877582643 JAVIRFTZKSAMOT-LYFYHCNISA-N 185.227 -1.711 50 10 AAGE Cn1nnnc1CCNC(=O)NN 1881886376 IKGWHIZDAQLPCE-UHFFFAOYSA-N 185.191 -2.075 50 10 AAGE NS(=O)(=O)C1=CC(=O)OC1=O 1887590333 VIJBHQDJQWWWON-UHFFFAOYSA-N 177.137 -1.758 50 10 AAGE CN(C)C(=O)C1(C(=O)NN)CC1 1923954015 NAXIGCUKISAARF-UHFFFAOYSA-N 171.200 -1.155 50 10 AAGE CO[C@@]1(C)C[C@@H]1NC(=O)C#CB(O)O 2241468590 QVVUJBFMTUPQJT-XPUUQOCRSA-N 196.999 -1.705 50 10 AAGE C[C@@H]1CC[C@H]1NC(=O)C#CB(O)O 2241475767 FBPMHISCULMIQD-RNFRBKRXSA-N 181.000 -1.084 50 10 AAGE C[C@@H]1CN(CC(=O)NN)CCO1 82466152 BJMICTPVJLCMOV-ZCFIWIBFSA-N 173.216 -1.303 50 10 AAGE O=C1NCc2ncc(B(O)O)cc21 238655193 XLQGIIPPQBVHRN-UHFFFAOYSA-N 177.956 -1.995 50 10 AAGE O[C@H]1[C@@H]2O[C@H]2[C@@H](O)[C@H]2O[C@H]2[C@H]1Cl 306314676 WFGOXUXPFAZWNB-QZSGLMCJSA-N 192.598 -1.136 50 10 AAGE Cc1cnc(B(O)O)cc1O 306661352 RUHLEQHAZKLPEX-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE NNC(=O)N1CC[C@@H](O)[C@H](CO)C1 306910978 QGBTXNPVUZXOPE-NTSWFWBYSA-N 189.215 -1.755 50 10 AAGE N#CSC[C@H]1OC(=O)[C@H](O)[C@@H]1O 307443377 BIHOZRIUSOSOLT-UOWFLXDJSA-N 189.192 -1.152 50 10 AAGE COC(=O)[C@@H]1C[C@H]1C(=O)NNC=O 379368147 XBCPIQQVBFQYMC-RFZPGFLSSA-N 186.167 -1.427 50 10 AAGE CC(=O)NNC(=O)Cn1ncnn1 1440724759 YIKSULPLVOCOEL-UHFFFAOYSA-N 184.159 -2.160 50 10 AAGE OB(O)c1ccnc(F)n1 1880029145 ASBXSFYIDICAIC-UHFFFAOYSA-N 141.898 -1.705 50 10 AAGE O=C(NNCCO)[C@@H]1[C@@H]2CCO[C@H]21 1881756461 KXEZXIQVYWDLAJ-RRKCRQDMSA-N 186.211 -1.366 50 10 AAGE NNC(=O)C(=O)N[C@H]1COC[C@H]1F 1883141615 XEXITHXKGJRQLH-DMTCNVIQSA-N 191.162 -2.171 50 10 AAGE COCC(=O)NN(C)S(C)(=O)=O 1888592346 NGMBVUWHDQPLQE-UHFFFAOYSA-N 196.228 -1.445 50 10 AAGE NNC(=O)C(=O)N(CCF)CCF 1888748808 NMKRIJFRYLTZMW-UHFFFAOYSA-N 195.169 -1.256 50 10 AAGE CN(O)C(=O)c1ccccc1B(O)O 1897481784 PSMOHIWLKWSYNK-UHFFFAOYSA-N 194.983 -1.172 50 10 AAGE N#C[C@@H](O)[C@H](N)Cn1cnnn1 1952862243 MBIWZTSYGVCMEE-RFZPGFLSSA-N 168.160 -2.115 50 10 AAGE CN(C)NC(=O)CN1CC(N)C1 1953670260 CVFMNEOFZXSDSB-UHFFFAOYSA-N 172.232 -1.778 50 10 AAGE C[C@@]12CN(CC(=O)NN)C[C@]1(CO)C2 1956312269 NYLKZOXHQUEFAL-BDAKNGLRSA-N 199.254 -1.319 50 10 AAGE CO[C@@H](C)CNC(=O)C#CB(O)O 2241468786 UXUPDAYCGDEQMI-LURJTMIESA-N 184.988 -1.847 50 10 AAGE O=C([C@H]1C[C@@H]1B(O)O)N1CC[C@H](O)C1 2241479814 FTPDQERZDIORRO-ACZMJKKPSA-N 199.015 -1.558 50 10 AAGE CC#CCNC(=O)[C@H]1C[C@@H]1B(O)O 2241496270 QSTMDAZERQLUFB-BQBZGAKWSA-N 181.000 -1.011 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H](O)[C@H](O)C1 235200378 QRJDCKJRZZHQQZ-PBXRRBTRSA-N 189.215 -2.598 50 10 AAGE O=C1NC(=O)[C@@H]2N[C@H](Cl)N[C@@H]2N1 306922712 WPCSRVACOYKESZ-ICJMABJWSA-N 190.590 -1.764 50 10 AAGE CC[C@@H](Cn1cc(B(O)O)cn1)OC 694537254 WARGYXWXABKXRD-QMMMGPOBSA-N 198.031 -1.012 50 10 AAGE CN(C)NC(=O)C1=C[C@@H](O)[C@@H](N)C1 1882799366 HMCZIBJTQPSGAL-NKWVEPMBSA-N 185.227 -1.403 50 10 AAGE NNC(=O)CCN1C[C@H](F)[C@H](O)C1 1929910234 LQCUWRBFRRGQFV-NTSWFWBYSA-N 191.206 -1.619 50 10 AAGE C[C@@H]1CN(C(=O)C(=O)NN)C[C@H]1F 1932369501 UKUGCRXOLMBSCE-RFZPGFLSSA-N 189.190 -1.207 50 10 AAGE CN1CCN(C)[C@H](C(=O)N(C)N)C1 1934626141 CRIAYOGGKQEFSQ-ZETCQYMHSA-N 186.259 -1.436 50 10 AAGE Cn1nnc2c1CCN(C(=O)NN)C2 1956774309 NRKPSQHCNGPZKT-UHFFFAOYSA-N 196.214 -1.244 50 10 AAGE NNC(=O)C1=NNCC1 39340979 PXOBJGBKVQEMNK-UHFFFAOYSA-N 128.135 -1.674 50 10 AAGE N#Cc1ccc(B(O)O)c(C#N)n1 238620588 GWROYAYQIJNLIS-UHFFFAOYSA-N 172.940 -1.495 50 10 AAGE O=C(O)c1nc(O)ccc1B(O)O 238624562 GNDZWHJCHXMBLB-UHFFFAOYSA-N 182.928 -1.835 50 10 AAGE C[C@@H]1CCO[C@H]1C(=O)NCB(O)O 702018238 RXSNCUKADTVQNW-PHDIDXHHSA-N 187.004 -1.460 50 10 AAGE NNC(=O)N1C[C@H](O)C[C@@H](O)C1 1880965829 CVKKGMXEYNSYMG-RFZPGFLSSA-N 175.188 -2.003 50 10 AAGE C[C@@H](C(=O)NN(C)C)N1CC(N)C1 1882833431 FXAUMDXHFVZEJR-LURJTMIESA-N 186.259 -1.389 50 10 AAGE NNC(=O)C(=O)N1[C@H]2COC[C@H]1C2 1883761784 YNUVSSPYEYJMFL-RFZPGFLSSA-N 185.183 -2.024 50 10 AAGE NNC(=O)[C@@H]1C[C@H]1N 1923218573 YPGNRODCJVIYRF-PWNYCUMCSA-N 115.136 -1.677 50 10 AAGE N[C@@]1(B(O)O)C[C@@H]2COC[C@@H]2C1 1934819161 CEXOZXBNTSHXNG-ZMONIFLSSA-N 171.005 -1.248 50 10 AAGE CCOC[C@H](N)C(=O)NN 1953153301 OPCOUAICMSWALN-BYPYZUCNSA-N 147.178 -1.660 50 10 AAGE C[C@@H]1CN[C@H](C(=O)NN)C1 1953183593 NXWPVDAKROTQBW-WHFBIAKZSA-N 143.190 -1.026 50 10 AAGE CO[C@H](C(=O)O)C(=O)NN 1953184125 VZNNMFOBQHBBHW-REOHCLBHSA-N 148.118 -1.924 50 10 AAGE CCCN1CC[C@](N)(B(O)O)C1 1953479225 VAIJMXAALFDIFP-SSDOTTSWSA-N 172.037 -1.188 50 10 AAGE CC[C@H](C(=O)NN)N1CC=C[C@H](O)C1 1956306179 HPLSVHOBZAJUCD-JGVFFNPUSA-N 199.254 -1.012 50 10 AAGE O=C(C#CB(O)O)NC[C@H]1CC[C@@H]1O 2241468739 UCDKMINAOYTNDO-RQJHMYQMSA-N 196.999 -2.111 50 10 AAGE CCOC(=O)c1ncncc1B(O)O 2241494570 ZPALLFYMDGKUGN-UHFFFAOYSA-N 195.971 -1.667 50 10 AAGE CO[C@@H]1C[C@@H]1NC(=O)[C@H]1C[C@@H]1B(O)O 2241495746 LXMRACGZGBGXJI-ZTYPAOSTSA-N 199.015 -1.247 50 10 AAGE N#Cc1cc(B(O)O)cc(C(N)=O)c1 2241596045 SEAKTGZNGPBIDH-UHFFFAOYSA-N 189.967 -1.663 50 10 AAGE CC[C@H]1[C@@H](O)CCN1CC(=O)NN 2242160546 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ASLDYZCDDFORKY-NTSWFWBYSA-N 158.994 -1.105 50 10 AAGE CNC1(C(N)=O)CN(C(=O)F)C1 1881051861 SOWNGFISJYHYJH-UHFFFAOYSA-N 175.163 -1.165 50 10 AAGE CP(C)(=O)C[C@@H](N)C(=O)NN 1886394844 DYDFQDFXIJRXSB-SCSAIBSYSA-N 179.160 -1.074 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@H]2OCC[C@H]12 1931663974 ZCQNEBNDSKFBDE-HSUXUTPPSA-N 199.210 -1.730 50 10 AAGE C[C@@]12C[C@@H]1CN(C(=O)C(=O)NN)C2 1932260613 AFUNODJZLZSFFZ-XRGYYRRGSA-N 183.211 -1.155 50 10 AAGE C[C@H](O)CNc1cc(B(O)O)ccn1 2210060292 IQOJVKQDZIJXJO-LURJTMIESA-N 196.015 -1.446 50 10 AAGE NC[C@H]1CCN(C(=O)C#CB(O)O)C1 2241468284 KTHRSEGUWUKQKK-SSDOTTSWSA-N 196.015 -2.191 50 10 AAGE CC[C@H](CCO)NC(=O)C#CB(O)O 2241469030 YYILAZWJYGIEDL-SSDOTTSWSA-N 199.015 -1.721 50 10 AAGE C[C@@H](O)C[C@@H](C)NC(=O)C#CB(O)O 2241471217 HDMYFRYEYWJTBX-RNFRBKRXSA-N 199.015 -1.723 50 10 AAGE CONC(=O)c1cc(B(O)O)oc1C 2241472451 RSJWLHODOZNPAW-UHFFFAOYSA-N 198.971 -1.441 50 10 AAGE CN1CC[C@@H](NC(=O)C#CB(O)O)C1 2241476317 POVAHWWUGZTGBB-SSDOTTSWSA-N 196.015 -2.178 50 10 AAGE NNC(=O)[C@]1(N)C[C@@H]2OCCC[C@H]21 2242114124 LICVVKBZEMGRBS-CHKWXVPMSA-N 185.227 -1.127 50 10 AAGE O=C1N[C@@H]2C(=O)OC(=O)[C@@H]2N1 169187886 IWWJKYUSLCVQBT-XIXRPRMCSA-N 156.097 -1.880 50 10 AAGE NCC(=O)N1CCC[C@H]1B(O)O 169987504 BZTBBVKEKPNNBE-YFKPBYRVSA-N 171.993 -2.052 50 10 AAGE in-vivo OB(O)c1cnc(-n2cccn2)nc1 198019857 CUJAGUQCHFZMRL-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE C[C@@H](CC(=O)NN)N1CC[C@H](N)C1 203229518 ZVGVMQPVMLRUIU-BQBZGAKWSA-N 186.259 -1.212 50 10 AAGE Nc1ccc(B(O)O)c(O)c1 203764478 XOACFGIYOAODFE-UHFFFAOYSA-N 152.946 -1.346 50 10 AAGE CC(=O)NNC1=NC(=O)C(=O)N1 306530311 JMGXFPVIDZWHMS-UHFFFAOYSA-N 170.128 -2.361 50 10 AAGE C[S@](=O)NCB(O)O 575462780 QTHNEMPUIMDDGT-QMMMGPOBSA-N 136.969 -2.119 50 10 AAGE CCS(=O)(=O)CC(=O)N(C)N 1880346613 MIEOTWIICACNBN-UHFFFAOYSA-N 180.229 -1.247 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2C[C@H](C1)O2 1883763025 GXBJRPZIQQPVTD-QYNIQEEDSA-N 185.227 -1.162 50 10 AAGE C[C@@H](CN1CC=C[C@@H](O)C1)C(=O)NN 1956307672 SKSZNOQRQZJYML-JGVFFNPUSA-N 199.254 -1.155 50 10 AAGE O=C(C#CB(O)O)NCc1cnn[nH]1 2241469063 ZMHVLVVRPOIWQW-UHFFFAOYSA-N 193.959 -2.564 50 10 AAGE O=C(NC1COC1)C1(B(O)O)CCC1 2241471280 HXYQYEVAAKKUHJ-UHFFFAOYSA-N 199.015 -1.102 50 10 AAGE CC1(O)CN(C(=O)C2(B(O)O)CC2)C1 2241478650 JQVWDJKSKCKCLE-UHFFFAOYSA-N 199.015 -1.413 50 10 AAGE CN(C)CCN(C)C(=O)C#CB(O)O 2241479476 YVMXHKMHILNTNV-UHFFFAOYSA-N 198.031 -1.978 50 10 AAGE NC[C@H]1C[C@H]1NC(=O)C#CB(O)O 2241479489 ZBZWBNMEGDTTRD-PHDIDXHHSA-N 181.988 -2.535 50 10 AAGE Cc1c(C(=O)O)c(B(O)O)nn1C 2241493673 PNCPBSSMDYHDIY-UHFFFAOYSA-N 183.960 -1.893 50 10 AAGE OB(O)c1ccnc2ncnn12 238630656 UFIHKLCNLUOVKH-UHFFFAOYSA-N 163.933 -2.196 50 10 AAGE CNc1nc(B(O)O)cs1 306900916 FUXBURRXVLOBMJ-UHFFFAOYSA-N 157.991 -1.135 50 10 AAGE CC1(/C=N/NC(=O)C(N)=O)COC1 307360035 FDCWLYYITVDORA-XNWCZRBMSA-N 185.183 -1.390 50 10 AAGE OC[C@H](O)[C@@H](O)[C@H](Cl)CO 307594987 KWMWIVMWKJNWIY-WISUUJSJSA-N 170.592 -1.700 50 10 AAGE N#C/C(N)=C(\C#N)N=C[C@@H](O)CO 307983109 HIYZPVFQXAFLGY-AJCAMKBJSA-N 180.167 -1.372 50 10 AAGE CN(C)CCn1ccc(B(O)O)n1 694278167 YASHSEBATOZHRM-UHFFFAOYSA-N 183.020 -1.876 50 10 AAGE O=C(NCB(O)O)c1cnc(O)[nH]1 702028226 DKOPLOHQDWEYNU-UHFFFAOYSA-N 184.948 -2.143 50 10 AAGE C=C(Cn1cnccc1=O)B(O)O 1883744132 HUWSFLKCDAHMTD-UHFFFAOYSA-N 179.972 -1.189 50 10 AAGE OB(O)c1ccc(N2CCCO2)nc1 1956961671 IHYHRRIHAAWDFK-UHFFFAOYSA-N 193.999 -1.097 50 10 AAGE O=C(C#CB(O)O)N[C@H]1[C@@H]2C[C@@H]1CN2 2241468046 GKGZVKGSILKKTI-GKROBHDKSA-N 193.999 -2.522 50 10 AAGE O=C(C#CB(O)O)NC[C@@H]1CC[C@@H]1O 2241468737 UCDKMINAOYTNDO-BQBZGAKWSA-N 196.999 -2.111 50 10 AAGE NNC(=O)c1ncccc1B(O)O 2241474048 VTFCRKODBPKKSF-UHFFFAOYSA-N 180.960 -2.635 50 10 AAGE O=C(NC1CNC1)C1CC(B(O)O)C1 2241475344 WBULQNBQSKLMMV-UHFFFAOYSA-N 198.031 -1.673 50 10 AAGE NC(=O)NCCNC(=O)C#CB(O)O 2241479272 VFEIQWHFQBXTQG-UHFFFAOYSA-N 198.975 -3.214 50 10 AAGE O=C1O[C@H](CCl)[C@H](O)[C@H]1O 27756730 CBQUKTYYJALFIT-FLRLBIABSA-N 166.560 -1.128 50 10 AAGE CC(=O)N/N=C(\N)c1nnc(N)o1 75576400 VDKOBAJQFLKYJB-UHFFFAOYSA-N 184.159 -1.592 50 10 AAGE C[C@](O)(C#N)[C@@H](O)C(=O)O 104734957 FKGDUKDFBWCKQU-UCORVYFPSA-N 145.114 -1.294 50 10 AAGE CN(C)NC(=O)NOCC(=O)O 135188588 CTESISSGEWUCEA-UHFFFAOYSA-N 177.160 -1.222 50 10 AAGE Cc1nn(CC(=O)NN)c(=O)n1N 138832131 CUPDCOZGLLBLMZ-UHFFFAOYSA-N 186.175 -2.943 50 10 AAGE Cc1ccc(B(O)O)cc1B(O)O 208611672 IIGRFXPPHAJPIL-UHFFFAOYSA-N 179.777 -2.645 50 10 AAGE C[C@@H](CC(N)=O)NC(=O)NN 220592188 BXBRTCZRECSZKL-VKHMYHEASA-N 160.177 -1.577 50 10 AAGE CO[C@H]1CCN(C(=O)C(=O)NN)C1 234777751 FAKMHTLYWIGJIO-YFKPBYRVSA-N 187.199 -1.776 50 10 AAGE N#Cc1cc(C=O)ncc1B(O)O 238633226 XTOIRJWSEFHWNY-UHFFFAOYSA-N 175.940 -1.554 50 10 AAGE O=C(CO)NNc1cnccn1 306375227 WREZPNQYCYANRZ-UHFFFAOYSA-N 168.156 -1.088 50 10 AAGE CN1CC/C(=N\NC(=O)CO)C1=O 306703476 ASXDZAXJTVNDMQ-VMPITWQZSA-N 185.183 -1.687 50 10 AAGE NNc1ccc(CO)cc1B(O)O 306705784 PINOFWFCUBGUDF-UHFFFAOYSA-N 181.988 -1.856 50 10 AAGE CO[C@@H]1CN(CC(=O)NN)C[C@H]1O 307326799 IASJKEFGMJBYCD-PHDIDXHHSA-N 189.215 -2.332 50 10 AAGE CN1C=C[C@@]2(C(=O)NN)C[C@@H]2C1=O 307336967 FUGIVDMTEKFFRB-SVGQVSJJSA-N 181.195 -1.032 50 10 AAGE NNC(=O)CCSCCC(N)=O 399159389 JSTXFEKWNCAMBE-UHFFFAOYSA-N 191.256 -1.025 50 10 AAGE CNNC(=O)Cc1cc(O)nc(O)n1 704664354 DPJHHCNGBSOGOD-UHFFFAOYSA-N 198.182 -1.319 50 10 AAGE C[C@@]12C[C@@H](CO1)N(CC(=O)NN)C2 885473647 KJQZCHRKVGZDJR-XPUUQOCRSA-N 185.227 -1.161 50 10 AAGE NNC(=O)N[C@H]1COC[C@H]1F 1880383066 BHNCHJYKRLIYNB-DMTCNVIQSA-N 163.152 -1.104 50 10 AAGE NNC(=O)CCN1CC=CC[C@H]1CO 1884400086 ORSSGKDIQGWNCT-QMMMGPOBSA-N 199.254 -1.011 50 10 AAGE N#C[C@]1(O)CNCCOC1 1931926295 FCEANBJPIMJNPS-LURJTMIESA-N 142.158 -1.139 50 10 AAGE NOCCOc1ncc(B(O)O)cn1 2210066679 WODJAKMZOYVTHF-UHFFFAOYSA-N 198.975 -2.575 50 10 AAGE CC(F)(F)C(=O)NCC#CB(O)O 2241554250 ANDIQUFUUXZYOV-UHFFFAOYSA-N 190.942 -1.227 50 10 AAGE O=C(CO)N[C@H]1CCC=C1B(O)O 2241561681 BFXXQJTYBWSZAK-LURJTMIESA-N 184.988 -1.804 50 10 AAGE CN(C)C(=O)NCC(=O)NN 1604714 WVKLTUQUPZXBGS-UHFFFAOYSA-N 160.177 -1.753 50 10 AAGE CN(C)CCN(C)C(=O)C(=O)NN 58850154 YVODLZJGKGGUFP-UHFFFAOYSA-N 188.231 -2.004 50 10 AAGE CNC(=O)[C@@H](O)C#N 104693690 FIYUTZRHNUKXGE-VKHMYHEASA-N 114.104 -1.383 50 10 AAGE NNC(=O)C(=O)Nc1nccnn1 165209172 ODAGAPVNAHQSPV-UHFFFAOYSA-N 182.143 -2.200 50 10 AAGE OB(O)c1cccc(-n2cnnn2)c1 169919974 BWLZCUPNMRZUPF-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE NNC(=O)[C@@H]1CCCN1C(N)=O 222396428 KUGWFFABVNNTOL-BYPYZUCNSA-N 172.188 -1.481 50 10 AAGE CO[C@@H]1OC(C=O)=C[C@@H](O)[C@@H]1O 238340231 YISYJKZMQGJXSO-DSYKOEDSSA-N 174.152 -1.206 50 10 AAGE O=C1NCN[C@@H](C(=O)O)[C@@H]1Cl 306441315 OKVVFOYKAOUYGE-STHAYSLISA-N 178.575 -1.276 50 10 AAGE C=C(C(N)=O)c1cccc(B(O)O)c1 307055102 SJRMKKOFDUNQAU-UHFFFAOYSA-N 190.995 -1.135 50 10 AAGE O[C@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1Cl 307159005 BSMLUJHFZGTHOG-ZIQZFLOESA-N 198.602 -2.588 50 10 AAGE CO/C(C=O)=C\[C@H](O)[C@@H](O)CO 307903924 LOUBRDMWHMERSC-UMTIGCAMSA-N 176.168 -1.570 50 10 AAGE CN(NC(=O)C(=O)C(=O)O)C(N)=O 308262175 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C=CCNC(=O)COCC(=O)NN 58847528 LMUHMXDCEIKHPO-UHFFFAOYSA-N 187.199 -1.705 50 10 AAGE NNC(=O)CCN1CCC[C@@H](N)C1 82470160 UZUUNVVSDIPPPQ-SSDOTTSWSA-N 186.259 -1.211 50 10 AAGE COCCn1ccc(B(O)O)c1 206160402 FBGLXAPZWJBQQV-UHFFFAOYSA-N 168.989 -1.186 50 10 AAGE CN1CC[C@@H]1C(=O)NN 211655612 NSQWYHFGEXGOAY-SCSAIBSYSA-N 129.163 -1.320 50 10 AAGE CN1CC(=O)N/C1=C(\C#N)C(N)=O 238328310 DRYHEFVEWWFJRE-DAXSKMNVSA-N 180.167 -1.732 50 10 AAGE COC(=O)B(O)O 307642911 KTLULULPGFGEGR-UHFFFAOYSA-N 103.870 -1.193 50 10 AAGE C[C@@H](F)CNC(=O)C(=O)NN 885271474 XXYCBDCFQIJHOR-GSVOUGTGSA-N 163.152 -1.550 50 10 AAGE CN(NC(=O)C(=O)O)S(C)(=O)=O 1888563727 QVCXIXYFJQEFKP-UHFFFAOYSA-N 196.184 -2.006 50 10 AAGE O=C(C#CB(O)O)N1CCCOCC1 2241468972 XXQNJKPWFRPNSJ-UHFFFAOYSA-N 196.999 -1.749 50 10 AAGE O=C(C#CB(O)O)N1CC(CCO)C1 2241478342 CJAAIFUOANBFET-UHFFFAOYSA-N 196.999 -2.157 50 10 AAGE O=C(NC1CC1)c1ccc(B(O)O)o1 2241481952 XSOLPSOKTRMVRU-UHFFFAOYSA-N 194.983 -1.148 50 10 AAGE C#CC(=O)Nc1ccccc1B(O)O 2241554955 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-1.543 50 10 AAGE Cc1c(B(O)O)cccc1C(=O)NN 2241474028 VKDFEOVBKNIJFI-UHFFFAOYSA-N 193.999 -1.722 50 10 AAGE O=C(NO)Nc1ccc(B(O)O)cc1 2241584223 KTUSINIWBWBTDM-UHFFFAOYSA-N 195.971 -1.123 50 10 AAGE OC[C@H](O)[C@@H](O)CCl 104734067 DGGUDQTUJAPWME-IMJSIDKUSA-N 140.566 -1.061 50 10 AAGE CN(C)NC(=O)C/C(N)=N/O 149699390 BLFCWRKLWXYJQB-UHFFFAOYSA-N 160.177 -1.284 50 10 AAGE OB(O)c1ncncn1 203866289 XPKWANFGUBBTOD-UHFFFAOYSA-N 124.896 -2.449 50 10 AAGE COC[C@H](SCCN)C(=O)NN 232421519 RMBZBVIURJCSBX-YFKPBYRVSA-N 193.272 -1.317 50 10 AAGE O=Cc1ccnc(O)c1B(O)O 238614562 NXONIAKGUUHDMS-UHFFFAOYSA-N 166.929 -1.721 50 10 AAGE O=C1NCc2cc(B(O)O)cnc21 238654848 DIYAVMXLDMJTOX-UHFFFAOYSA-N 177.956 -1.995 50 10 AAGE O=CC(C=O)=CN[C@H](CO)C(=O)O 238702570 FKIAIDDDOMVECY-ZCFIWIBFSA-N 187.151 -1.697 50 10 AAGE OCc1ccc(B(O)O)c(F)n1 238724999 RAGUQRPSSHUJAB-UHFFFAOYSA-N 170.936 -1.607 50 10 AAGE OB(O)c1ncccc1C1OCCO1 306487891 JKNSXMGWJZMSMR-UHFFFAOYSA-N 194.983 -1.193 50 10 AAGE CC1(C)CCN1C(=O)C(=O)NN 606252665 TYURFQYQKWDYCJ-UHFFFAOYSA-N 171.200 -1.013 50 10 AAGE Cc1n[nH]cc1C(=O)NCB(O)O 701933366 XGUJPOWCDLRHNO-UHFFFAOYSA-N 182.976 -1.540 50 10 AAGE O=C(NCB(O)O)N1C[C@@H]2C[C@H]2C1 885449169 KIFGMHLPDNYAOR-WDSKDSINSA-N 184.004 -1.340 50 10 AAGE CON(C(=O)C(=O)NN)C(C)C 1928665275 DIGWJPNMUSQTCT-UHFFFAOYSA-N 175.188 -1.225 50 10 AAGE O=C(O)c1c[nH]c(B(O)O)c1 1951325905 NWDOZQBLBTTYML-UHFFFAOYSA-N 154.918 -1.607 50 10 AAGE N#C[C@H](O)[C@H](N)CO 1952792136 FYRPWEWOPQMSFW-DMTCNVIQSA-N 116.120 -1.810 50 10 AAGE NNC(=O)CN1CC(N)C1 1953167529 WQMAKMHFSYKCJN-UHFFFAOYSA-N 144.178 -2.381 50 10 AAGE C[C@@H]1CC[C@H]([C@@H](N)C(=O)NN)O1 1953709386 YBCDVCFGIKWHNC-HSUXUTPPSA-N 173.216 -1.129 50 10 AAGE NNC(=O)N1CC(O)(C(F)F)C1 1953710241 SUXJHDLTHBUGQB-UHFFFAOYSA-N 181.142 -1.119 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2CCO[C@H]2C1 1956919904 SXXGTNGCYMFBHZ-WDSKDSINSA-N 199.210 -1.776 50 10 AAGE CC#CCC(=O)NCC#CB(O)O 2241569555 ANDHRWYZLJGJCB-UHFFFAOYSA-N 178.984 -1.469 50 10 AAGE NNC(=O)[C@@H]1C(=O)C2CCN1CC2 100904626 QQGXWMVPAPNALU-LURJTMIESA-N 183.211 -1.360 50 10 AAGE Cc1nc(CC(=O)O)ccc1B(O)O 238520407 KIORMONFWVHYEB-UHFFFAOYSA-N 194.983 -1.303 50 10 AAGE NC(=O)C[C@@H](N)C(=O)NCCCl 238610935 DKLUKHOUXMGLCH-SCSAIBSYSA-N 193.634 -1.456 50 10 AAGE OB(O)c1cccc(C2(O)COC2)c1 306397992 IXPHFCJANMKNCY-UHFFFAOYSA-N 193.995 -1.416 50 10 AAGE COCCOc1cc(B(O)O)ccn1 308589051 NOKKAASJSFTVRX-UHFFFAOYSA-N 196.999 -1.213 50 10 AAGE NC/C=C\B(O)O 394734743 UYVMTOKKKKFXAS-UPHRSURJSA-N 100.914 -1.487 50 10 AAGE CN(CC(=O)NN)C[C@@]12COC[C@@H]1C2 689277105 FYWVIFHUEGRGMP-CBAPKCEASA-N 199.254 -1.055 50 10 AAGE CNNC(=O)[C-]1C#CN(C)N1 885247580 BMNWUTPZYKGSTG-UHFFFAOYSA-N 153.165 -1.820 50 10 AAGE C[C@@H](OCCn1cncn1)C(=O)NN 1886294480 RSEICUHTAJSLJY-ZCFIWIBFSA-N 199.214 -1.327 50 10 AAGE NNC(=O)N1C[C@@H]2OCCO[C@H]2C1 1930254190 SFZIZWIOBAPLDU-WDSKDSINSA-N 187.199 -1.331 50 10 AAGE OCCCN=c1cc(B(O)O)cc[nH]1 2210061685 XNLMXLNGRIWTKJ-UHFFFAOYSA-N 196.015 -2.022 50 10 AAGE Cc1ccc(C(N)=O)c(B(O)O)c1 2241473655 NOCSARRHBHSAHH-UHFFFAOYSA-N 178.984 -1.226 50 10 AAGE NC(=O)c1ccc(F)cc1B(O)O 2241473712 OPZZPQASJZTMOK-UHFFFAOYSA-N 182.947 -1.396 50 10 AAGE CN(O)C(=O)[C@H]1C[C@H]1B(O)O 2241494657 AUBSFFPWUYOREM-IUYQGCFVSA-N 158.950 -1.303 50 10 AAGE CC(=O)NNC(=O)[C@@H]1CCC(=O)N1 39116947 ZAGIGEFVMRDMKG-YFKPBYRVSA-N 185.183 -1.568 50 10 AAGE CC(C)N(CCO)CC(=O)NN 58837174 VDRNRQILPKZBPW-UHFFFAOYSA-N 175.232 -1.321 50 10 AAGE COC[C@@H](C)N(C)CC(=O)NN 82469588 NBODTXSFROBYFS-ZCFIWIBFSA-N 175.232 -1.057 50 10 AAGE NCC(=O)NNCC(=O)O 104655711 JLCZXOPKDDRAEN-UHFFFAOYSA-N 147.134 -2.350 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@H](N)C1 203220988 ZOAUACUQCCPLJA-RITPCOANSA-N 172.232 -1.602 50 10 AAGE CS(=O)(=O)n1cccc1B(O)O 206165977 CTIDFYQDKLRGSF-UHFFFAOYSA-N 189.001 -2.024 50 10 AAGE CC[C@H]1C[C@H]1NC(=O)C(=O)NN 234060941 ZFCRBNGZEABZDY-CRCLSJGQSA-N 171.200 -1.109 50 10 AAGE NNC(=O)CN(N)C(N)=S 238657256 LEGRMHWHLVYONI-UHFFFAOYSA-N 163.206 -2.604 50 10 AAGE N[C@H](CO)C(=O)NNCc1ncc[nH]1 238687307 XXVXCBLOPFWEOT-RXMQYKEDSA-N 199.214 -2.150 50 10 AAGE O=C(CO)N/N=C/c1cnccn1 306791653 YLXBKWKXLBGTDK-ONNFQVAWSA-N 180.167 -1.081 50 10 AAGE Cc1cccc(NN)c1B(O)O 307279880 XWWQTKKZLUABGP-UHFFFAOYSA-N 165.989 -1.040 50 10 AAGE NNC(=O)[C@H]1C[C@@H](N)C1 575513313 QOIUQKOHJRJHSL-ZXZARUISSA-N 129.163 -1.286 50 10 AAGE O=C(Cc1cccnc1)NCB(O)O 702007994 RXEGYMVPBCFFEU-UHFFFAOYSA-N 193.999 -1.248 50 10 AAGE CCOC1([C@H](N)B(O)O)CC1 1931496926 KUJCVTLUMBGQOW-YFKPBYRVSA-N 158.994 -1.105 50 10 AAGE CC(C)[C@H](O)CN(C)CC(=O)NN 1953871362 OFTRFHIRWHZSCZ-SSDOTTSWSA-N 189.259 -1.075 50 10 AAGE C[C@@]1(C(=O)NN)C=CCN1 2208926076 OVVCULGWVVTIEG-LURJTMIESA-N 141.174 -1.106 50 10 AAGE CC[C@@H](CNC(=O)C#CB(O)O)OC 2241479437 XZQHZUOBJSWXRT-ZETCQYMHSA-N 199.015 -1.457 50 10 AAGE O=C(NC1CC(O)C1)[C@@H]1C[C@@H]1B(O)O 2241496579 VEOQNCNISYOJSS-KBGZMJGOSA-N 199.015 -1.511 50 10 AAGE O=C(O)CCCC(=O)NCB(O)O 2242208847 XNBPZJARJYJCDM-UHFFFAOYSA-N 188.976 -1.631 50 10 AAGE NNC(=O)[C@@]12CCO[C@H]1CNC2 2242596790 KDZOGGXREMVFFU-CAHLUQPWSA-N 171.200 -1.645 50 10 AAGE NNC(=O)[C@@H](N)CCC(=O)O 82962593 HACMXPVQBHWNHX-VKHMYHEASA-N 161.161 -1.832 50 10 AAGE CN[C@H]1COC[C@@H]1C(=O)NN(C)C 147238626 RTRJNXRTCIEDAM-BQBZGAKWSA-N 187.243 -1.186 50 10 AAGE COC(=O)/C(NN)=C(/C#N)C(=O)O 211849331 DIHCYJMOQZNMRA-ONEGZZNKSA-N 185.139 -1.515 50 10 AAGE CCC(=O)NN[C@H]1CCNC1=O 306209660 BQBDBSMPCAIBMV-YFKPBYRVSA-N 171.200 -1.094 50 10 AAGE NNC(=O)[C@H]1C[C@H](O)[C@@H](O)[C@H](O)C1 306993891 LZUWSBBZPIKWMQ-RJYLNQFNSA-N 190.199 -2.531 50 10 AAGE CC[C@H](Cn1ccc(B(O)O)n1)OC 694267060 BOZTUNTZZRFAIR-SSDOTTSWSA-N 198.031 -1.012 50 10 AAGE OB(O)c1cnn(CCOC2CC2)c1 711754597 GARHCHFGLHKYJJ-UHFFFAOYSA-N 196.015 -1.258 50 10 AAGE NNC(=O)[C@H]1CCOCC[C@H]1N 1880610044 NEWNOPYTUPUWIP-NTSWFWBYSA-N 173.216 -1.270 50 10 AAGE CN(C(=O)C(=O)NN)[C@H]1C[C@H](O)C1 1882175526 AHVUBFQGCPWXOJ-URHBZAFASA-N 187.199 -2.042 50 10 AAGE NNC(=O)CN1[C@H]2CC[C@H]1[C@H](CO)C2 1935287546 YPYUUGHLJMYKIN-FXQIFTODSA-N 199.254 -1.179 50 10 AAGE OB(O)c1cncn1C(F)F 1951326568 JFJWAJSCMDNWDH-UHFFFAOYSA-N 161.904 -1.042 50 10 AAGE CC[C@@H](CCO)NC(=O)C#CB(O)O 2241472886 YYILAZWJYGIEDL-ZETCQYMHSA-N 199.015 -1.721 50 10 AAGE O=C(N[C@H]1CCNC1)C1(B(O)O)CC1 2241473841 RAOBHUWAKQWEQA-LURJTMIESA-N 198.031 -1.529 50 10 AAGE C[C@@H](C#N)CN(C)C(=O)C#CB(O)O 2241476219 NXKWPTZWKGTNMJ-ZETCQYMHSA-N 193.999 -1.380 50 10 AAGE C=C[C@H](CO)NC(=O)[C@H]1C[C@@H]1B(O)O 2241494828 DRKAXGYHKCZKKT-VQVTYTSYSA-N 199.015 -1.488 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@H](C1)[C@H]2O 2241815773 SFINWZBQMIHZDQ-SRSLHRDFSA-N 199.254 -1.321 50 10 AAGE C[C@H](O)CN[C@H](C)CC(=O)NN 58839085 MHJHFCJXOIUGEU-RITPCOANSA-N 175.232 -1.275 50 10 AAGE C[C@H](C(=O)NN)N(CCO)C1CC1 82470826 AKDFXRFZSRSCKD-ZCFIWIBFSA-N 187.243 -1.179 50 10 AAGE C[C@@H](C(=O)NN)[C@@H](C)N(C)CCO 86313487 GOZVTAMBCBATKQ-RNFRBKRXSA-N 189.259 -1.075 50 10 AAGE CCN(CB(O)O)C(=O)CNC 200993872 OPYJHRBCPDGZFM-UHFFFAOYSA-N 174.009 -1.934 50 10 AAGE OB(O)c1cnc(OCC2CC2)nc1 202464800 RDNWWFKTCRDFBE-UHFFFAOYSA-N 193.999 -1.055 50 10 AAGE NNC(=O)CN1C[C@H](O)[C@@H](O)C1 236238687 YZDYVEPNOIZKJX-WHFBIAKZSA-N 175.188 -2.986 50 10 AAGE COc1c(O)cncc1B(O)O 238438816 SCRHTMKXUAVOES-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE CC(=NNC(=O)C(N)=O)C(=O)O 379289533 VEMPJCLHPKIGOQ-UHFFFAOYSA-N 173.128 -1.952 50 10 AAGE N#C/C(=C\NN)C(=O)NC=O 387927239 LIDKSTBEFYTLJR-DUXPYHPUSA-N 154.129 -1.870 50 10 AAGE NCC(=O)NN=Cc1cnc[nH]1 396142514 RFROVOBMLXHZJE-UHFFFAOYSA-N 167.172 -1.182 50 10 AAGE N#CC[S@](=O)CC(=O)NN 526867903 FCSZCUSATSRGHW-JTQLQIEISA-N 161.186 -1.751 50 10 AAGE NC(=O)CNC(=O)C=CC(=O)Cl 1881389771 XDPOSYMDYTXDFK-UHFFFAOYSA-N 190.586 -1.091 50 10 AAGE O=C=NC(=O)Cn1cnnn1 1928687626 VWRFDSOVCNAGHF-UHFFFAOYSA-N 153.101 -1.465 50 10 AAGE NNC(=O)CN1CC(CO)C1 1929743844 VGBRAINFVJCKFY-UHFFFAOYSA-N 159.189 -2.100 50 10 AAGE Cn1nccc1C(=O)NNCCO 1929831870 JOZQJYTWGFVVTH-UHFFFAOYSA-N 184.199 -1.353 50 10 AAGE C=C(Cn1ccc(B(O)O)n1)OC 1954029406 BDIZJIIIYNAHPP-UHFFFAOYSA-N 181.988 -1.277 50 10 AAGE O=C(C#CB(O)O)N1CC(F)(F)C1 2241467912 DCKDNPHPQXDUKJ-UHFFFAOYSA-N 188.926 -1.521 50 10 AAGE O=CN1Cc2ccc(B(O)O)cc2C1 2241557902 COKXBSYOYKRCFQ-UHFFFAOYSA-N 190.995 -1.162 50 10 AAGE O=CN/N=C/c1c[nH]c(=O)[nH]c1=O 1702911 CHDKLHSEMZKNNP-KRXBUXKQSA-N 182.139 -1.857 50 10 AAGE NCCC(=O)NNC(=O)CCN 224744158 GTUKUUBXRFRWAM-UHFFFAOYSA-N 174.204 -2.169 50 10 AAGE CC(C)NNC(=O)[C@H]1NCC[C@@H]1O 238197394 PWLDFDWAJAUNIM-BQBZGAKWSA-N 187.243 -1.262 50 10 AAGE Cc1[nH]nc(CCO)c1C(=O)NN 238495242 UGXCFLBQVWQEBF-UHFFFAOYSA-N 184.199 -1.144 50 10 AAGE OB(O)[C@H]1COCCO1 238610455 NVPVSMRXAWQFIK-SCSAIBSYSA-N 131.924 -1.586 50 10 AAGE OCc1cnc(O)c(B(O)O)c1 238729161 GJMWXYRHQBQOFU-UHFFFAOYSA-N 168.945 -2.041 50 10 AAGE CCC(=O)NN[C@@H]1CCNC1=O 306209655 BQBDBSMPCAIBMV-RXMQYKEDSA-N 171.200 -1.094 50 10 AAGE N#C/C(=C\NCCO)C(=O)NC(N)=O 306236845 OJOGYRSTEGXXQQ-SNAWJCMRSA-N 198.182 -1.829 50 10 AAGE NC[C@@H](O)C=NNC(N)=O 383593802 VNHDCAWCEVBZLJ-GSVOUGTGSA-N 146.150 -2.040 50 10 AAGE CN(C)NC(=O)[C@H]1CO[C@H](CN)C1 713837995 PMSRXWGTZKNUBI-RQJHMYQMSA-N 187.243 -1.057 50 10 AAGE O=C(CO)NNC(=O)[C@@H]1C[C@@H]1F 1654451194 VWAIDUQJTRMYEY-DMTCNVIQSA-N 176.147 -1.516 50 10 AAGE NC(=O)NNC(=O)C1COC1 1880147932 NSMFPCYBFHKEMH-UHFFFAOYSA-N 159.145 -1.668 50 10 AAGE N#C[C@H](O)[C@H](N)c1nc(O)nc(O)n1 1953071260 LYYDVTSVZWBDKN-HRFVKAFMSA-N 197.154 -1.833 50 10 AAGE C[C@H]1C[C@]1(C)NC(=O)C#CB(O)O 2241476722 YGTCVZYYZUJUPE-XPUUQOCRSA-N 181.000 -1.084 50 10 AAGE C#C[C@@H](CO)NC(=O)C#CB(O)O 2241478932 NWLGNFIAQGBUIP-LURJTMIESA-N 180.956 -2.888 50 10 AAGE CONC(=O)c1ncc(B(O)O)cn1 2241480485 LEVZKHURDWKVMZ-UHFFFAOYSA-N 196.959 -2.552 50 10 AAGE NNC(=O)c1cnc(NN)nc1 39120890 JNYOEANNGJUISB-UHFFFAOYSA-N 168.160 -1.634 50 10 AAGE NNS(=O)(=O)CCl 104728004 SRSMTPLLSHKLPS-UHFFFAOYSA-N 144.583 -1.024 50 10 AAGE NC(=O)NNC(=O)C(F)F 114403680 WTANKNXRMGXFGS-UHFFFAOYSA-N 153.088 -1.049 50 10 AAGE CC(=O)NCCNC(=O)N[N+](=O)[O-] 238089098 RAHYTKIUNKRDNB-UHFFFAOYSA-N 190.159 -1.387 50 10 AAGE OB(O)c1nc2c(o1)CCOC2 238658370 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C[C@@H](CO)CN(C)C(=O)C#CB(O)O 2241478957 OIKWQYJFNKDBRD-SSDOTTSWSA-N 199.015 -1.911 50 10 AAGE N#CCNC(=O)c1coc(B(O)O)c1 2241480757 LALOLBAAMINMLS-UHFFFAOYSA-N 193.955 -1.787 50 10 AAGE O=C1CCN1C(=O)[C@@H]1C[C@@H]1B(O)O 2241496275 QUGCCGDKWDVVQP-UHNVWZDZSA-N 182.972 -1.392 50 10 AAGE NNC(=O)N1CC[C@@H](O)[C@H](O)CC1 2241587178 JTLPUPNMMHNJNU-PHDIDXHHSA-N 189.215 -1.613 50 10 AAGE NNC(=O)CN1CCOC1=O 39136568 DAJRFANQWLZNSF-UHFFFAOYSA-N 159.145 -1.572 50 10 AAGE CCNC(=O)[C@H](C)NC(=O)NN 49231313 BZHCBAGEHSXDHD-BYPYZUCNSA-N 174.204 -1.316 50 10 AAGE COCCN[C@@H](C)CC(=O)NN 58862817 RYMCQYZHOAUJIY-LURJTMIESA-N 175.232 -1.009 50 10 AAGE O=CNCB(O)O 169879808 UMNZDZYPRHOFGC-UHFFFAOYSA-N 102.886 -2.256 50 10 AAGE CN(CC(=O)O)NC(=O)CCN 238318520 VZHRXCQLOWXAHX-UHFFFAOYSA-N 175.188 -1.617 50 10 AAGE OB(O)c1ccnc(-n2cncn2)c1 238652124 YSDGCXZACRVCRQ-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE O=C1C[C@@H](B(O)O)CO1 306475992 UKXFWZWSBBFKBQ-GSVOUGTGSA-N 129.908 -1.224 50 10 AAGE 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NNC(=O)N[C@@H]1CCC[C@@H]1C(N)=O 1954183604 WFUBOOPJVDWXFQ-CRCLSJGQSA-N 186.215 -1.187 50 10 AAGE Cn1cc(B(O)O)c(C(=O)NN)n1 2241468564 QKAUSBQZPGKRAF-UHFFFAOYSA-N 183.964 -3.297 50 10 AAGE CC1(N)CC(NC(=O)C#CB(O)O)C1 2241479201 TWWAYVPEKOYCLT-UHFFFAOYSA-N 196.015 -2.002 50 10 AAGE CC[C@H](CN)NC(=O)C#CB(O)O 2241479499 ZFRRPEPDVLWIAI-ZCFIWIBFSA-N 184.004 -2.145 50 10 AAGE CNC(=O)c1sncc1B(O)O 2241496877 XBNZZIIXTUHQES-UHFFFAOYSA-N 186.001 -1.818 50 10 AAGE NNC(=O)CCSCC(N)=O 37390039 SPRVMOZDTVAKFJ-UHFFFAOYSA-N 177.229 -1.415 50 10 AAGE NNC(=O)COc1ncccn1 113552068 GLGQEBUBNQOFLF-UHFFFAOYSA-N 168.156 -1.155 50 10 AAGE N#C[C@H](O)[C@@H](O)CO 141346703 YDXGXFDEPLKGAQ-IMJSIDKUSA-N 117.104 -1.776 50 10 AAGE CC(=O)NN[C@H]1CC(=O)NC(=O)N1 211770754 WRTVIYDHXUVTPP-BYPYZUCNSA-N 186.171 -1.817 50 10 AAGE NNC(=O)c1ccc(C(N)=O)o1 306544286 XTILGZWQBZSGPK-UHFFFAOYSA-N 169.140 -1.018 50 10 AAGE NNC(=O)C(=O)N1CCC[C@H](F)C1 606261081 YBSADQIFXLRHPI-YFKPBYRVSA-N 189.190 -1.063 50 10 AAGE O=C(CCn1ccnc1)NCB(O)O 701961597 WGTJLMGXLLHPCP-UHFFFAOYSA-N 197.003 -1.599 50 10 AAGE C[C@H](O)C(=O)NNC(=O)c1cnn[nH]1 1136677043 AOJHINDSOCUUNU-VKHMYHEASA-N 199.170 -2.054 50 10 AAGE C[C@@H]1CCN1c1ncc(B(O)O)cn1 1886964251 RPYTZPWGVQQUEW-ZCFIWIBFSA-N 193.015 -1.245 50 10 AAGE CN(N)C(=O)N1CCN(C)C(=O)C1 1892506647 SKQNMHZVLLVIFD-UHFFFAOYSA-N 186.215 -1.314 50 10 AAGE CN(C)NC(=O)CO 1917971153 ZEFHPNWCNRMKNA-UHFFFAOYSA-N 118.136 -1.429 50 10 AAGE C[C@@H]1CCOC[C@@]1(N)B(O)O 1932287527 QTRJLQNAWRQLDJ-RITPCOANSA-N 158.994 -1.248 50 10 AAGE C[C@H]([C@H](N)[C@H](O)C#N)S(C)(=O)=O 1952838312 IWXMYGXXLJYVHT-PBXRRBTRSA-N 192.240 -1.369 50 10 AAGE C[C@@H]1CN[C@@H](C(=O)NN)CO1 1953299242 BROXZZIELHTYDM-RFZPGFLSSA-N 159.189 -1.647 50 10 AAGE C[C@H]1C[C@@H]1N(CCO)CC(=O)NN 1953834818 DGSCVHRIGUKIML-BQBZGAKWSA-N 187.243 -1.321 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CC[C@H]2C[C@@H]21 2241467883 COOLDGNXDRUXLN-BIIVOSGPSA-N 193.011 -1.084 50 10 AAGE CCN(C)C(=O)c1c[nH]nc1B(O)O 2241475255 ULUXSAYVBYKDBJ-UHFFFAOYSA-N 197.003 -1.819 50 10 AAGE O=C(NO)c1cc(B(O)O)co1 2241747573 DRZOVLDQNLNMBY-UHFFFAOYSA-N 170.917 -1.922 50 10 AAGE OCCc1c(O)cccc1B(O)O 204503531 CGVFKKDKUHIDTJ-UHFFFAOYSA-N 181.984 -1.393 50 10 AAGE Nc1nccc(B(O)O)c1C=O 206091632 WVHRSPVBOORCTE-UHFFFAOYSA-N 165.945 -1.844 50 10 AAGE COC[C@@H](C(=O)NN)N(C)CCO 232419400 MNIVEZYKXOGOOR-LURJTMIESA-N 191.231 -2.085 50 10 AAGE CCOC(=O)C(=O)CC(=O)NN 238289434 OLJPEFPNOZJPAN-UHFFFAOYSA-N 174.156 -1.501 50 10 AAGE Nc1c(O)ncnc1NNC=O 238591365 HZNXEYQPRBYQKX-UHFFFAOYSA-N 169.144 -1.163 50 10 AAGE COc1cc(B(O)O)ccc1C(N)=O 306303255 HKOXKQCSGGJUIW-UHFFFAOYSA-N 194.983 -1.526 50 10 AAGE N[C@@H]1N[C@H](Cl)N[C@@H]2NCN[C@@H]21 585663897 IDFMJJJXQBRRKV-MBMOQRBOSA-N 177.639 -2.169 50 10 AAGE CN(C)NC(=O)[C@H]1CNCCN1C 686928457 YSJSEZYGMAKWKS-SSDOTTSWSA-N 186.259 -1.517 50 10 AAGE CN(CCO)/C(N)=C(/C#N)[N+](=O)[O-] 687728873 MLDWJAUTMIREON-WAYWQWQTSA-N 186.171 -1.161 50 10 AAGE O=C(NNCCO)c1ncccn1 1893723421 FFOGMQXDGOYAEG-UHFFFAOYSA-N 182.183 -1.297 50 10 AAGE CC[C@]1(O)CCN(CC(=O)NN)C1 1930890295 OYNULZDTOSFBBQ-QMMMGPOBSA-N 187.243 -1.177 50 10 AAGE N[C@@H]1CC[C@@H]1NC(=O)C1(B(O)O)CC1 2241474097 WLEZQTJGBYSXSA-RITPCOANSA-N 198.031 -1.401 50 10 AAGE CN(C)NC(=O)[C@H]1C[C@@H](B(O)O)C1 2241475150 RLINFMRRAOBLTF-OLQVQODUSA-N 186.020 -1.168 50 10 AAGE CC(C)N(CCN)C(=O)C#CB(O)O 2241478465 FYCKEMUFKMKJKF-UHFFFAOYSA-N 198.031 -1.803 50 10 AAGE O=C(O)CCCNC(=O)C#CB(O)O 2241478485 GHCBULQIEZRYBP-UHFFFAOYSA-N 198.971 -2.017 50 10 AAGE CNN(C)C(=O)CN 95936434 LBLVEFYHQBCYAU-UHFFFAOYSA-N 117.152 -1.462 50 10 AAGE OB(O)c1cnc2nccn2c1 199028042 JBAMJKYLBKNTDG-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE OB(O)c1ccc2c(c1)CNCCO2 203652478 JRWCKZNTCRIPOV-UHFFFAOYSA-N 193.011 -1.152 50 10 AAGE N#Cc1cnc(C#N)c(B(O)O)c1 238615780 SHNYOJHCVGVHRH-UHFFFAOYSA-N 172.940 -1.495 50 10 AAGE NNC(=O)CCNCCS 238656634 AXIQESSLSMOJET-UHFFFAOYSA-N 163.246 -1.114 50 10 AAGE CN1CC[C@H](C[C@H](N)C(=O)NN)C1 258975553 IRLFOQNQOAPYKG-RQJHMYQMSA-N 186.259 -1.355 50 10 AAGE NC(=O)N/N=C/c1c[nH]c(=O)[nH]1 306352003 YTWHWNCVHQYLFE-KRXBUXKQSA-N 169.144 -1.295 50 10 AAGE C/C(=N\NC(N)=O)[C@H]1NCCNC1=O 306682590 RUIBUAOXPKEXDZ-WRFGPZLNSA-N 199.214 -1.881 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H]2C1 307584350 ICPOYIBCLZJEGG-WHFBIAKZSA-N 169.184 -1.545 50 10 AAGE CC[C@@](N)(COC)C(=O)NN 307624435 NRCIYYIDVDTVGD-ZCFIWIBFSA-N 161.205 -1.270 50 10 AAGE CC(=O)NNC(=O)CN(C)C(N)=O 308273089 TYOFCVVSPYOTKS-UHFFFAOYSA-N 188.187 -1.836 50 10 AAGE OB(O)c1ccn(CC2CC2)n1 694273703 ZPNJUODLNMESJK-UHFFFAOYSA-N 165.989 -1.027 50 10 AAGE CN(C)c1ncc(B(O)O)cc1F 716784843 WDUHUWJTEXJZHP-UHFFFAOYSA-N 183.979 -1.034 50 10 AAGE NNC(=O)C(=O)N[C@]12COC[C@@H]1C2 717977259 UMADTHMMZNHRKF-MHTLYPKNSA-N 185.183 -2.119 50 10 AAGE NNC(=O)N[C@H]1C[C@@H](C(N)=O)C1 1326800532 LRYVBQZPOJFFFM-ZXZARUISSA-N 172.188 -1.577 50 10 AAGE CC1(C(=O)NCC#CB(O)O)CC1 1883750317 JLHWCGAXGBBRBW-UHFFFAOYSA-N 181.000 -1.082 50 10 AAGE NNC(=O)CCN1CC2(CCO2)C1 1954052656 MZMIRQHYLMUPLK-UHFFFAOYSA-N 185.227 -1.159 50 10 AAGE O=C(N1CC[C@@H](O)C1)C1(B(O)O)CC1 2241473348 IQCNEMVDYRNJJY-ZCFIWIBFSA-N 199.015 -1.413 50 10 AAGE C#CC(C)(C)NC(=O)C#CB(O)O 2241475900 HUZKUJOHXPKIKG-UHFFFAOYSA-N 178.984 -1.470 50 10 AAGE CONC(=O)c1ccncc1B(O)O 2241480348 HACBEHRYOWHTLF-UHFFFAOYSA-N 195.971 -1.947 50 10 AAGE CONC(=O)c1ncncc1B(O)O 2241481938 XKPVYXZMOLBJFH-UHFFFAOYSA-N 196.959 -2.552 50 10 AAGE C[C@H](O)C(=O)NCC#CB(O)O 2241562496 OVELRPPELSEHBY-YFKPBYRVSA-N 170.961 -2.501 50 10 AAGE Cc1nncn1CC(=O)NN 45823814 VVILRPGDSWCZAR-UHFFFAOYSA-N 155.161 -1.424 50 10 AAGE COc1nc(N(C)C)ccc1B(O)O 238389653 YCSXYARIHUKWAH-UHFFFAOYSA-N 196.015 -1.164 50 10 AAGE NCc1nccc(N)c1B(O)O 238611166 UABFXRLFZOPGTE-UHFFFAOYSA-N 166.977 -2.198 50 10 AAGE O=Cc1cnc(B(O)O)s1 307488915 FPIFNMHNZVRFND-UHFFFAOYSA-N 156.959 -1.365 50 10 AAGE COC[C@](C)(CO)N(C)C(=O)NN 689776046 RWUMXQIAJJZNMB-ZETCQYMHSA-N 191.231 -1.101 50 10 AAGE O=CC1=C=[N+](C[C@H]2CCCO2)NN1 885389304 PQPBJCARFKOLNV-MRVPVSSYSA-N 182.203 -1.047 50 10 AAGE N[C@]1(B(O)O)C[C@H]2[C@H]3CC[C@@H](O3)[C@H]21 1882907489 PUZCYZJYPXHRLB-FMGWEMOISA-N 183.016 -1.107 50 10 AAGE C[C@@H]1[C@H](O)CCN1CC(=O)NN 1914258325 VTDBQZUZJPTMBA-PHDIDXHHSA-N 173.216 -1.569 50 10 AAGE Cc1cnc(B(O)O)[nH]1 1930365426 IVNURIPSKSIBJG-UHFFFAOYSA-N 125.924 -1.602 50 10 AAGE C=CCN=c1cc(B(O)O)cc[nH]1 2209387420 JFQBGVLBOAOVHB-UHFFFAOYSA-N 178.000 -1.219 50 10 AAGE N#CCNC(=O)c1ccoc1B(O)O 2241478582 IHXUVSWREGMGHU-UHFFFAOYSA-N 193.955 -1.787 50 10 AAGE O=C(C#CB(O)O)NCCCCO 2241478731 KVMXJSKZNHLINT-UHFFFAOYSA-N 184.988 -2.110 50 10 AAGE COc1cc(N)ccc1B(O)O 204772646 KFOUDPZIGRKSMY-UHFFFAOYSA-N 166.973 -1.043 50 10 AAGE C[C@H](O)[C@]1(O)C=C(C#N)[C@H](O)[C@@H]1O 306758109 OCMULJGMLXGWNT-YDLFOAGRSA-N 185.179 -1.716 50 10 AAGE CC(=O)NN[C@@H](C)C(=O)NC(N)=O 307458191 ACMYJVYPKMNQDZ-VKHMYHEASA-N 188.187 -1.790 50 10 AAGE O=CC1=C=[N+](C[C@@H]2CCC(=O)N2)NN1 885666688 DACLIIAYUZWFLI-LURJTMIESA-O 195.202 -1.947 50 10 AAGE CN(C)C(=O)NNC(=O)c1nc[nH]n1 1142535209 OGEGNIYFGQPTOF-UHFFFAOYSA-N 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CRNMWTNRXKNYTF-RXMQYKEDSA-N 171.200 -1.155 50 10 AAGE CN(C)NC(=O)CN1CCNCC1 147268402 OQLLJAYXQBPVDG-UHFFFAOYSA-N 186.259 -1.516 50 10 AAGE COC(=O)c1cccc(B(O)O)c1N 203764252 WXMONJRORKKLFA-UHFFFAOYSA-N 194.983 -1.265 50 10 AAGE CN[C@@H](CC(=O)NN)C(=O)NN 238344982 GPXVLRDWRNLDFC-VKHMYHEASA-N 175.192 -3.056 50 10 AAGE CNC(=O)C1=NS(=O)(=O)C(C#N)=C1 260289295 WAEJOTYFWHWNFT-UHFFFAOYSA-N 199.191 -1.076 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1Cl 306312995 UDOJFSFHKNQOHC-XKTQNOIPSA-N 198.602 -1.975 50 10 AAGE N#C[C@@H]1C(=O)N[C@@H](N)N[C@@H]1Cl 306371120 IXYQRNOIJKOMGK-FFKNPPMGSA-N 174.591 -1.347 50 10 AAGE NNc1cccc(O)c1B(O)O 307165944 NQZGKIPRDNZGJK-UHFFFAOYSA-N 167.961 -1.642 50 10 AAGE N#C[C@H](O)[C@H](O)[C@@H](O)[C@H](O)CO 307933519 GQXJZINGMGHWDU-FSIIMWSLSA-N 177.156 -3.054 50 10 AAGE COC[C@H](C(=O)NN)N1CC(O)C1 384150735 PFBTZUBPGCZXKG-ZCFIWIBFSA-N 189.215 -2.332 50 10 AAGE N[C@]1(B(O)O)CCO[C@]12CCOC2 885503646 DMNHAQGJSDSUGI-NKWVEPMBSA-N 187.004 -1.725 50 10 AAGE CN(C)NC(=O)[C@@H](O)CCN 1880299863 OUZRWIPTUXJWMR-YFKPBYRVSA-N 161.205 -1.711 50 10 AAGE O=C(O)c1cc(F)c(B(O)O)cc1O 1888373776 DNDIKPCFLXLDIP-UHFFFAOYSA-N 199.930 -1.091 50 10 AAGE CC(=O)NN(C)S(C)(=O)=O 1888592769 WPYXZSQEVZSKMK-UHFFFAOYSA-N 166.202 -1.071 50 10 AAGE O=C1NCc2cccc(B(O)O)c2O1 1951329673 SNLNEEGPYUUPIE-UHFFFAOYSA-N 192.967 -1.032 50 10 AAGE COC1(C)CN(C(=O)C#CB(O)O)C1 2241478973 ORYZQMZTBNESFX-UHFFFAOYSA-N 196.999 -1.751 50 10 AAGE CNC(=O)CN(C)[C@@H](C)C(=O)NN 82467405 XNMSOGUQGRIITP-YFKPBYRVSA-N 188.231 -1.957 50 10 AAGE NC/C(CO)=N\NC(N)=O 104657350 DJKCKLRJHUYTRX-XVNBXDOJSA-N 146.150 -2.038 50 10 AAGE O=C[C@H](Cl)[C@H](O)S(=O)(=O)O 141304102 FLHGOUWURQMLKC-STHAYSLISA-N 188.588 -1.001 50 10 AAGE NNC(=O)N1CCC[C@@H]2C(=O)NC[C@@H]21 232296332 KKXCKPMOOXHWTE-WDSKDSINSA-N 198.226 -1.220 50 10 AAGE N#CC1(O)CCN(CC(N)=O)CC1 306359019 BQHZUDLCRNWYMS-UHFFFAOYSA-N 183.211 -1.178 50 10 AAGE CC[C@H](NC(N)=O)C(=O)NN 306437098 FAKACKKMIQLRER-VKHMYHEASA-N 160.177 -1.577 50 10 AAGE Cn1ccc(C(=O)NCB(O)O)n1 702018653 YBNMYYHNNFUDIS-UHFFFAOYSA-N 182.976 -1.838 50 10 AAGE COC(=O)c1c(B(O)O)ncn1C 1887430488 KLTBCTFFJRNHMW-UHFFFAOYSA-N 183.960 -2.114 50 10 AAGE CNNC(=O)[C@@H]1CCS1(=O)=O 1930853742 RETHUJUCNGSBKA-BYPYZUCNSA-N 178.213 -1.576 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H]1[C@@H]1C[C@@H]21 1955373193 NLQWWKIUZXFQJN-YTLHQDLWSA-N 195.222 -1.157 50 10 AAGE CN1C[C@H]2C[C@H]1CN(CC(=O)NN)C2 1955524852 MUUAXLUENIMENV-SFYZADRCSA-N 198.270 -1.388 50 10 AAGE C[C@@H](CC(=O)NN)N1CC=C[C@H](O)C1 1956305918 FREKJCOEQKYSRA-YUMQZZPRSA-N 199.254 -1.012 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2C[C@H](C1)C2O 1957010207 PHRMLJVRVJLURZ-HBFKVTOISA-N 199.254 -1.323 50 10 AAGE NNC(=O)[C@@]12CCCO[C@H]1CNC2 2209305880 ZVYUEVYSSRLWPR-POYBYMJQSA-N 185.227 -1.255 50 10 AAGE CC(C)NCCNC(=O)C#CB(O)O 2241468102 HINMSOWMGVJXED-UHFFFAOYSA-N 198.031 -1.884 50 10 AAGE C[C@@H](OC1COC1)C(=O)NN 165765949 KWICUMKBCNAUCF-SCSAIBSYSA-N 160.173 -1.220 50 10 AAGE NNC(=O)C(=O)NC1C[C@@H]2C[C@H]2C1 306612061 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NCC1(CNC(=O)C#CB(O)O)CC1 2241468407 NSJMJPOCCQQUEC-UHFFFAOYSA-N 196.015 -2.143 50 10 AAGE N#CNC(=O)c1cc(B(O)O)c[nH]1 2241471768 MLGIQRRYKNVOKJ-UHFFFAOYSA-N 178.944 -2.095 50 10 AAGE CN(C)NC(=O)[C@@H](N)CC(=O)O 147270359 QXIIJDQVENWNGV-BYPYZUCNSA-N 175.188 -1.619 50 10 AAGE Nc1ccc(O)cc1B(O)O 204765821 XHKYKCAXYBFTDA-UHFFFAOYSA-N 152.946 -1.346 50 10 AAGE N#Cc1cc(B(O)O)cc(B(O)O)c1 220900551 FLTAFGBYWZLPJL-UHFFFAOYSA-N 190.760 -3.082 50 10 AAGE C[C@@H](C[S@](C)=O)NC(=O)NN 229034919 AGVYQVGURXBSAC-AUIPBDMJSA-N 179.245 -1.074 50 10 AAGE NC[C@H](O)C[C@H](N)CC(=O)NN 238806062 OYCSBHNCMBEVDU-CRCLSJGQSA-N 176.220 -2.597 50 10 AAGE NCC1CCN(CC(=O)NN)CC1 260646499 VRBABYLHSZNOMZ-UHFFFAOYSA-N 186.259 -1.353 50 10 AAGE NNc1cccc(C(=O)O)c1B(O)O 306863673 IXTNCJHGDUDMIM-UHFFFAOYSA-N 195.971 -1.650 50 10 AAGE NNC(=O)C[S@](=O)CC(N)=O 526840281 YJFNJFOKCOTTNE-LLVKDONJSA-N 179.201 -2.790 50 10 AAGE CN(C)NC(=O)[C@@H]1OCC[C@H]1N 575576743 AOUUXHJWCKZOJP-PHDIDXHHSA-N 173.216 -1.305 50 10 AAGE NNC(=O)c1nc(CO)ns1 724345371 IHUZBMUQJABSCT-UHFFFAOYSA-N 174.185 -1.366 50 10 AAGE NNC(=O)[C@H]1CCNC[C@@H]1F 1953298327 ICRCGRJHNWRRTN-WHFBIAKZSA-N 161.180 -1.076 50 10 AAGE O=C(NCCO)C1(B(O)O)CCC1 2241481438 SPMHBETUMYHQGO-UHFFFAOYSA-N 187.004 -1.508 50 10 AAGE CS(=O)(=O)C1(C(=O)NN)CNC1 2297011041 DENOPPJBVDAUEB-UHFFFAOYSA-N 193.228 -2.637 50 10 AAGE CCCNC(=O)NCC#CB(O)O 1883737735 BGXGZNWMNXTXHT-UHFFFAOYSA-N 184.004 -1.289 50 10 AAGE NNC(=O)CN1[C@H](CO)[C@H]2CC[C@@H]1C2 1885165605 CPUVLLRHMVTGNQ-XLPZGREQSA-N 199.254 -1.179 50 10 AAGE CC(=O)NNC(=O)Cn1ccc(=N)[nH]1 1888929506 JXNVGMYAUPHGLJ-UHFFFAOYSA-N 197.198 -1.537 50 10 AAGE CON(C)[C@H](C)C(=O)NN 1928677075 SVKXXUBIGWNNEV-SCSAIBSYSA-N 147.178 -1.142 50 10 AAGE CC(=O)NC[C@@H](N)[C@H](O)C#N 1952895406 HSUVJVYSVIHSTK-PHDIDXHHSA-N 157.173 -1.666 50 10 AAGE C[S@@](=O)CC1CN(C(=O)NN)C1 1953366188 SIJFHMDXYDFEKG-GFCCVEGCSA-N 191.256 -1.120 50 10 AAGE CN(C)C(=O)c1ccoc1B(O)O 2241469087 ZYFXDFSSBRHGQZ-UHFFFAOYSA-N 182.972 -1.339 50 10 AAGE O=C(N[C@H]1CCOC1)[C@@H]1C[C@@H]1B(O)O 2241474376 BUOHAZYFTPZLOQ-XVMARJQXSA-N 199.015 -1.246 50 10 AAGE O=C(C#CB(O)O)N1CC=C[C@H](O)C1 2241478333 CFHCFAFPCQIGMD-ZETCQYMHSA-N 194.983 -2.239 50 10 AAGE C#C[C@H]1C[C@@H](NC(=O)C#CB(O)O)C1 2241478374 DBACHTJBBGYAMM-OCAPTIKFSA-N 190.995 -1.470 50 10 AAGE NNC(=O)[C@H]1CSCC(=O)N1 238556674 SBMZUEWKHHNKEZ-GSVOUGTGSA-N 175.213 -1.792 50 10 AAGE NCc1cnc(CN)c(B(O)O)c1 238565496 RBQUTDXWEAFPMP-UHFFFAOYSA-N 181.004 -2.321 50 10 AAGE NC(=O)NNC(=O)CCCO 238590050 AVECHDKIGZBNGD-UHFFFAOYSA-N 161.161 -1.542 50 10 AAGE O=Cc1c(F)cncc1B(O)O 238636736 YYWJDSCCQNFFQX-UHFFFAOYSA-N 168.920 -1.287 50 10 AAGE CC(=NNC(=O)NC(=N)N)C(=O)O 383513280 NJHYFFPGQOEEPB-UHFFFAOYSA-N 187.159 -1.360 50 10 AAGE NNC(=O)[C@H]1OCC[C@@H]1N 575579052 WWXUXKKJKFGNHZ-IMJSIDKUSA-N 145.162 -1.908 50 10 AAGE NNC(=O)C(F)(F)CN1C#CNN1 885570752 SGMJELOZWRZGFY-UHFFFAOYSA-N 191.141 -2.145 50 10 AAGE C[C@]1(C(=O)NN)C[C@@H](O)CN1 1521508472 VJQAOITWVCXQGU-INEUFUBQSA-N 159.189 -1.911 50 10 AAGE CNC(=O)NNC(=O)c1cn(C)cn1 1583198321 UHXYAUVEHCSDID-UHFFFAOYSA-N 197.198 -1.006 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@H]1F 1880344370 QKGCDSVEWPJHPV-PWNYCUMCSA-N 161.136 -1.797 50 10 AAGE CC[C@H](O)C(=O)NCC#CB(O)O 1888708323 RKIYGPIQZXGNOU-LURJTMIESA-N 184.988 -2.111 50 10 AAGE CN(C)NC(=O)C(N)(CO)CO 1892586902 BEQIPZMWQFHAAR-UHFFFAOYSA-N 177.204 -2.739 50 10 AAGE NNC(=O)CN1C[C@H]2CC[C@H]1[C@@H](O)C2 1893251253 IRFICOZIPLNAGN-FXQIFTODSA-N 199.254 -1.179 50 10 AAGE COC[C@@H](C)C(=O)NNC(N)=O 1923995910 SMNJISQZYLBRQI-SCSAIBSYSA-N 175.188 -1.032 50 10 AAGE NNC(=O)[C@H]1CN2CCN1CC2 1934628609 URHCNZOGLBQLSH-ZCFIWIBFSA-N 170.216 -2.024 50 10 AAGE Cn1nc([C@H](N)[C@@H](O)C#N)ccc1=O 1953021872 QEIXGIQGFTVLBA-XPUUQOCRSA-N 194.194 -1.335 50 10 AAGE O=C(O)CCc1ccc(B(O)O)o1 2081144586 VHHRSDNEWQYSHS-UHFFFAOYSA-N 183.956 -1.023 50 10 AAGE CN(O)C(=O)c1ncc(B(O)O)cn1 2241468047 GKZHOVFVUYCYPZ-UHFFFAOYSA-N 196.959 -2.382 50 10 AAGE CNC(=O)C#CB(O)O 2241478466 FZJHJLCRIHTGHX-UHFFFAOYSA-N 126.908 -2.252 50 10 AAGE O=C[C@H](O)[C@H](Cl)[C@H](O)[C@H](O)CO 83301100 JWYWFHQMFHJVRH-BGPJRJDNSA-N 198.602 -2.132 50 10 AAGE CNCCCN(C)[C@H](C)C(=O)NN 87472902 UNHOTGYJQKYRIR-SSDOTTSWSA-N 188.275 -1.094 50 10 AAGE COc1cc(CN)cc(B(O)O)c1 238403379 RIKCNJGEDLJYMI-UHFFFAOYSA-N 181.000 -1.166 50 10 AAGE O=C1O[C@@H]2[C@H](O)[C@H](O)O[C@@H]2[C@H]1Cl 306298380 JVPLUSMMESVGIN-PTPXTALPSA-N 194.570 -1.403 50 10 AAGE CCNc1nccc(B(O)O)n1 306788483 XBIDSBWZNNDBNK-UHFFFAOYSA-N 166.977 -1.412 50 10 AAGE CC(C)C(=O)NCCNC(=O)NN 393125971 ITUJUJNOGVZIET-UHFFFAOYSA-N 188.231 -1.069 50 10 AAGE COCCOCC(=O)N(C)N 704704481 ZXLOZTJQORHANX-UHFFFAOYSA-N 162.189 -1.019 50 10 AAGE Cn1cc(S(=O)(=O)N=C=O)nn1 953104560 WYFHBQKJTXYPDO-UHFFFAOYSA-N 188.168 -1.160 50 10 AAGE OB(O)C=Cc1cnn[nH]1 1880008572 FEDLULGVMCPONT-UHFFFAOYSA-N 138.923 -1.170 50 10 AAGE NNC(=O)[C@@H]1C=C[C@@H]1C(=O)O 1880145099 CWYQDBYKJLIQED-DMTCNVIQSA-N 156.141 -1.137 50 10 AAGE OCC#CCN1CC[C@H](B(O)O)C1 1891540565 XNEMSAUBMKESMZ-QMMMGPOBSA-N 183.016 -1.469 50 10 AAGE O=C(NCB(O)O)[C@@]12CC[C@@H](CO1)C2 1896735235 MPLZOPDAQVOUED-SVRRBLITSA-N 199.015 -1.316 50 10 AAGE O=C(NNCCO)c1cccnn1 1929837403 ZYJGRWSJNDXTOT-UHFFFAOYSA-N 182.183 -1.297 50 10 AAGE C[C@@H]1CN[C@H](C(=O)NN(C)C)CO1 1954886691 DYYALVVRRBZNPT-RQJHMYQMSA-N 187.243 -1.044 50 10 AAGE CO[C@@H](C)CCn1cc(B(O)O)cn1 1956351137 BGXDHZQGAGCMGP-ZETCQYMHSA-N 198.031 -1.012 50 10 AAGE NNC(=O)CN1CC[C@@H]2[C@@H](O)C[C@H]2C1 2209418997 AFJSIODYXDPMRZ-FXQIFTODSA-N 199.254 -1.321 50 10 AAGE OB(O)c1cnc(N2CCCN2)nc1 2210060969 OUIJQLQHARCDEA-UHFFFAOYSA-N 194.003 -2.129 50 10 AAGE CC(C)[C@@H](N)CNC(=O)C#CB(O)O 2241468060 GQVOOSWWHKBYRW-ZETCQYMHSA-N 198.031 -1.899 50 10 AAGE C=C(CS(=O)(=O)NC)B(O)O 2241480828 MMGWGTZLXKYHGL-UHFFFAOYSA-N 179.006 -1.896 50 10 AAGE CN(C)C(=O)c1cc(B(O)O)n(C)n1 2241495717 LVOLVUIXDMQTMP-UHFFFAOYSA-N 197.003 -2.198 50 10 AAGE O=C=N[C@@H](CO)C(=O)O 59911200 CWIIFKDNPCQXNV-VKHMYHEASA-N 131.087 -1.232 50 10 AAGE C[C@H](CS(C)(=O)=O)NC(=O)NN 81905636 RDPFCWGSKSQGDP-SCSAIBSYSA-N 195.244 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1929830910 SDHLGZGMODVALB-UHFFFAOYSA-N 142.158 -1.377 50 10 AAGE COCc1c(B(O)O)cnn1C 1929941895 KSDFGGSZFOCXNZ-UHFFFAOYSA-N 169.977 -1.754 50 10 AAGE CCCN1CC[C@@](N)(B(O)O)C1 1953479226 VAIJMXAALFDIFP-ZETCQYMHSA-N 172.037 -1.188 50 10 AAGE C[C@@]12CN(CC(=O)NN)C[C@]1(CO)C2 1956317315 NYLKZOXHQUEFAL-BDAKNGLRSA-N 199.254 -1.319 50 10 AAGE CCCn1ncc(B(O)O)c1OC 2059972361 HRCHOVOAZMZXRJ-UHFFFAOYSA-N 184.004 -1.019 50 10 AAGE O=C(C#CB(O)O)N1CC=C[C@H]1CO 2241467967 FFHVXUGOZOOKIO-ZETCQYMHSA-N 194.983 -2.239 50 10 AAGE C[C@@H](CN)NC(=O)C#CB(O)O 2241478813 LREJMZFVYMHYMK-YFKPBYRVSA-N 169.977 -2.535 50 10 AAGE Cn1cc(B(O)O)cc1C(=O)NC#N 2241479984 CPYYZTLRMQXMOT-UHFFFAOYSA-N 192.971 -2.084 50 10 AAGE CONC(=O)c1nccnc1B(O)O 2241505224 BNJFPQBAIOXYDV-UHFFFAOYSA-N 196.959 -2.552 50 10 AAGE NC(=O)NC(=O)c1occc1B(O)O 2241584104 JLKKPPXLPGVGHW-UHFFFAOYSA-N 197.943 -2.232 50 10 AAGE NNC(=O)CN1CCOC[C@@H]1CO 123898572 YFPFJWUUQYVGLF-LURJTMIESA-N 189.215 -2.331 50 10 AAGE CO[C@@H]1CN[C@@H](C(=O)NN(C)C)C1 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NNC(=O)[C@@]12CCO[C@@H]1CNC2 2242596791 KDZOGGXREMVFFU-IYSWYEEDSA-N 171.200 -1.645 50 10 AAGE C[C@H](N)C(=O)N1CCC[C@H]1B(O)O 169987542 WDFZXMUIFGGBQF-WDSKDSINSA-N 186.020 -1.663 50 10 AAGE in-vivo OB(O)c1ccc2c(c1)CNC2 196418358 PFCRRGCZGUSSFY-UHFFFAOYSA-N 162.985 -1.030 50 10 AAGE CCCC(=O)NNC(=O)C(N)=O 196434078 YPVHNOAZLLUKQN-UHFFFAOYSA-N 173.172 -1.581 50 10 AAGE C/C(=N/N)C(=O)NN 219765734 YOERZSZIODPOEH-KXFIGUGUSA-N 116.124 -1.689 50 10 AAGE COC[C@@H](O)C(=O)NN 232418017 ZDNDCDPLBKABCO-GSVOUGTGSA-N 134.135 -2.016 50 10 AAGE Nc1ncc(F)cc1B(O)O 238692119 XBYNFTBUXXFSNY-UHFFFAOYSA-N 155.925 -1.517 50 10 AAGE O=CC1=C[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O 238720837 KQQCGAKRCKYICB-VZFHVOOUSA-N 174.152 -2.431 50 10 AAGE NC/C=C/B(O)O 306201155 UYVMTOKKKKFXAS-OWOJBTEDSA-N 100.914 -1.487 50 10 AAGE CNC(=O)CN1CC[C@@H](B(O)O)C1 1891492363 NZKZCSGUVYNZPR-ZCFIWIBFSA-N 186.020 -1.719 50 10 AAGE Cc1nnc(NC(=O)C#CB(O)O)o1 2241475965 JBEZMRXFCJSAFF-UHFFFAOYSA-N 194.943 -1.668 50 10 AAGE CCNC(=O)c1c[nH]nc1B(O)O 2241479131 RWNMVDKQPNRTES-UHFFFAOYSA-N 182.976 -2.161 50 10 AAGE NNC(=O)c1cnsc1B(O)O 2297002484 ONBZBVWWMPTRJW-UHFFFAOYSA-N 186.989 -2.574 50 10 AAGE Cc1c(C(=O)NN)nnc2ncnn12 72416676 PZXBDKJSEYFZKZ-UHFFFAOYSA-N 193.170 -1.569 50 10 AAGE CCNC(=O)CN(C)CC(=O)NN 82470125 ZURJCKJRNUKHEK-UHFFFAOYSA-N 188.231 -1.956 50 10 AAGE O=C1NC(=O)[C@H](Cl)[C@@H](NO)N1 167570216 JXZRXCWDXFCZOD-JCYAYHJZSA-N 179.563 -1.262 50 10 AAGE NNC(=O)[C@H]1C=N1 206956091 HUXHODLQWILNIO-UWTATZPHSA-N 99.093 -1.571 50 10 AAGE O=[N+]([O-])c1ccc(B(O)O)o1 211129167 JEMVFZLZEPDTDR-UHFFFAOYSA-N 156.890 -1.132 50 10 AAGE NNC(=O)[C@@H]1CNC(=O)CN1 230896394 DEBINGXCVPYYIO-VKHMYHEASA-N 158.161 -2.936 50 10 AAGE C[C@@H]1COCCN(CC(=O)NN)C1 307154282 UQHOXQUJOYJBNS-ZETCQYMHSA-N 187.243 -1.055 50 10 AAGE CN(CCO)CC(F)(F)C(=O)NN 685957899 KWDLMDKMIXRHAR-UHFFFAOYSA-N 197.185 -1.464 50 10 AAGE C[C@@H]1COC[C@H]1N(C)CC(=O)NN 688148947 VSWRGSKDKGKMES-RNFRBKRXSA-N 187.243 -1.057 50 10 AAGE CO[C@@H](C(=O)NCB(O)O)C1CC1 706495958 SPCRNGGYHIZMSH-ZCFIWIBFSA-N 187.004 -1.460 50 10 AAGE O=C(NCB(O)O)c1ccc(O)nc1 706509297 BDFCYNBSUUQPKG-UHFFFAOYSA-N 195.971 -1.471 50 10 AAGE CN1NNN/C1=C1\N=C=C=C=C1C=O 885535248 JROFPWUCJNGCAI-BQYQJAHWSA-N 189.178 -1.267 50 10 AAGE N#CC1=C(N2C[C@@H](O)CO2)NNC#C1 885589595 QHXKQZWBYBBASS-SSDOTTSWSA-N 192.178 -1.602 50 10 AAGE COC[C@](C)(O)C(=O)NNC(C)=O 1539518161 LVWBPGGACCDIPA-ZETCQYMHSA-N 190.199 -1.449 50 10 AAGE OB(O)[C@H]1CCN(Cc2nc[nH]n2)C1 1891493248 SVOMNHCVTLWHPQ-LURJTMIESA-N 196.019 -1.147 50 10 AAGE NNC(=O)C[C@H](N)C(=O)NN 5131700 UWPWADIHIRRSNS-REOHCLBHSA-N 161.165 -3.316 50 10 AAGE NC(=O)NNC(=O)[C@H]1CCOC1 70044644 ZEAFXADKGIAKFE-BYPYZUCNSA-N 173.172 -1.278 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2C[C@@H]2C1=O 115205306 SGHHOPUEZOACCH-IMJSIDKUSA-N 183.167 -2.019 50 10 AAGE Nc1c(CO)cccc1B(O)O 204750774 GLPJMMUXYNEEAD-UHFFFAOYSA-N 166.973 -1.559 50 10 AAGE Cc1cc(B(O)O)cc([N+](=O)[O-])n1 206086146 JTLWZBCVSOAFSZ-UHFFFAOYSA-N 181.944 -1.022 50 10 AAGE C#CC(=O)NNC(=O)c1c[nH]nn1 306574607 RNIUUQPKLTZXQU-UHFFFAOYSA-N 179.139 -1.801 50 10 AAGE N[C@@H](CO)C(=O)NN=Cc1ncc[nH]1 308254481 BHCRYFQQEFOZMR-YFKPBYRVSA-N 197.198 -1.821 50 10 AAGE C[C@@H](CO)CN(C)CC(=O)NN 688389128 YKVPYWDJKGAYRV-ZCFIWIBFSA-N 175.232 -1.464 50 10 AAGE C[C@H]1CN([C@@H](C)C(=O)NN)C[C@@H]1O 1890259178 QUIDFGZODFRZFB-ACZMJKKPSA-N 187.243 -1.323 50 10 AAGE NC[C@H](C(=O)NN)[C@H]1CCOC1 1930479476 FHIHOYYSMHXTIS-WDSKDSINSA-N 173.216 -1.412 50 10 AAGE NNC(=O)N[C@@H]1CO[C@H]2COC[C@@H]12 1954357893 RTJMRVGAWLRPTN-JKUQZMGJSA-N 187.199 -1.427 50 10 AAGE Cc1c[nH]c(=NCCF)cc1B(O)O 2210065362 NPYVUBHZORQTNC-UHFFFAOYSA-N 198.006 -1.127 50 10 AAGE C[C@H](N)CNc1cc(B(O)O)ccn1 2210067770 FMBNLQQAAWUCCR-LURJTMIESA-N 195.031 -1.480 50 10 AAGE C[C@@]1(F)CCN(C(=O)C#CB(O)O)C1 2241468833 VPDYWMYGYHYSDN-MRVPVSSYSA-N 198.990 -1.038 50 10 AAGE O=C(NCCO)[C@H]1C[C@@H](B(O)O)C1 2241475002 OTRONANXKKKJPJ-OLQVQODUSA-N 187.004 -1.652 50 10 AAGE N#CNC(=O)c1cc(B(O)O)co1 2241748329 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JXODXXDEFRNOHJ-NTSWFWBYSA-N 183.211 -1.013 50 10 AAGE C[C@H]1C[C@@H]1NC(=O)C(=O)NN 52298218 JMVIIAHMQOFZJR-IMJSIDKUSA-N 157.173 -1.499 50 10 AAGE NNC(=O)CN1C[C@H]2[C@H](O)CC[C@H]2C1 125784708 ZNRYQNPVKNSERG-XLPZGREQSA-N 199.254 -1.321 50 10 AAGE CN(C)CC#CB(O)O 197884149 BBMZVOFMOVWMFI-UHFFFAOYSA-N 126.952 -1.437 50 10 AAGE OCCNc1ccc(B(O)O)cc1 204519315 SRNMLPPHPWWOBD-UHFFFAOYSA-N 181.000 -1.229 50 10 AAGE CCc1cncc(N)c1B(O)O 238324929 DOARGWVGNPGFOO-UHFFFAOYSA-N 165.989 -1.094 50 10 AAGE CCO[C@H](CN)CC(=O)NN 300770764 QEDPADVTGJROIH-YFKPBYRVSA-N 161.205 -1.270 50 10 AAGE NNC(=O)CN1CC(C(N)=O)C1 307568635 UDCDRBZQQDTBTK-UHFFFAOYSA-N 172.188 -2.607 50 10 AAGE COC(=O)C1(C(=O)NNC=O)CC1 379388354 JIZAQUGIZLUQLS-UHFFFAOYSA-N 186.167 -1.283 50 10 AAGE NNC(=O)C[C]1C#CNN1 885194037 QQBRONLZACOGTB-UHFFFAOYSA-N 139.138 -2.033 50 10 AAGE C[S@](=O)N[C@@H]1CCC=C1B(O)O 1881335127 GHNFAPZXMHMKLZ-INWYIAFRSA-N 189.045 -1.030 50 10 AAGE C[C@@]1(O)CN(C(=O)NN)CC[C@H]1O 1883995938 NSHLVTWOQQSIMT-IYSWYEEDSA-N 189.215 -1.613 50 10 AAGE C[C@H](O)CN1CC[C@H](B(O)O)C1 1891517414 OHLXMWPMJYHQML-BQBZGAKWSA-N 173.021 -1.084 50 10 AAGE C[C@H](O)[C@H](N)C(=O)NN(C)C 1953343254 APOPFPMGCYSXQC-WHFBIAKZSA-N 161.205 -1.713 50 10 AAGE CC(C)([C@H](N)B(O)O)S(C)(=O)=O 1953375096 FYBWDSJQLPKUJB-BYPYZUCNSA-N 195.049 -1.851 50 10 AAGE CC[C@@H](N)CNC(=O)C#CB(O)O 2241468153 IHNIMOOURYBGOP-ZCFIWIBFSA-N 184.004 -2.145 50 10 AAGE C[C@@H](O)C1CN(C(=O)C#CB(O)O)C1 2241468229 JPSXGAFEBBUDFF-ZCFIWIBFSA-N 196.999 -2.159 50 10 AAGE CC[C@H](O)CCNC(=O)C#CB(O)O 2241471296 IGUWVPQRTXQZEG-ZETCQYMHSA-N 199.015 -1.721 50 10 AAGE NNC(=O)C(=O)N[C@]12COC[C@H](C1)C2 2242146707 WFSBPFWZMNSWNX-AIDJGGAASA-N 199.210 -1.729 50 10 AAGE O=C(F)N[C@H]1C[C@@H](CO)[C@H](O)[C@@H]1O 2297160357 VOODKVCPHUUBTM-OMMKOOBNSA-N 193.174 -1.232 50 10 AAGE N[C@]1(B(O)O)C[C@H]2[C@@H]3CC[C@@H](O3)[C@H]21 2297204744 PUZCYZJYPXHRLB-YOWKYNACSA-N 183.016 -1.107 50 10 AAGE O=C1C(CO)=C[C@@H](O)[C@@H](O)[C@@H]1Cl 13385904 JUFBJBDOBZYSDT-WYDQCIBASA-N 192.598 -1.183 50 10 AAGE NCCSCC(=O)NN 82472984 ULEANOBQJGACDV-UHFFFAOYSA-N 149.219 -1.332 50 10 AAGE O[C@@H]1[C@@H](CCl)O[C@@H](O)[C@H](O)[C@@H]1O 104399153 QMWDIHPSUCUMFU-QZABAPFNSA-N 198.602 -1.975 50 10 AAGE N#Cc1cc(B(O)O)c(F)cn1 238616051 NQKTXNPAMWUHFA-UHFFFAOYSA-N 165.920 -1.228 50 10 AAGE NC(=O)CCB(O)O 238639867 IZRAKIOYQUUVTO-UHFFFAOYSA-N 116.913 -1.665 50 10 AAGE Cc1nc[nH]c1B(O)O 306883919 LDNIEYJDFPVWHH-UHFFFAOYSA-N 125.924 -1.602 50 10 AAGE NNC(=O)CN1CC(CC(N)=O)C1 382477450 HFHSILSBEWDWFV-UHFFFAOYSA-N 186.215 -2.217 50 10 AAGE CN1NC[C@@H]2N[C@H](Cl)NC(=O)[C@H]21 605704574 UVPYFCYJSVXQOF-FKZODXBYSA-N 190.634 -1.585 50 10 AAGE CNNC(=O)[C@@H]1CCS(=O)(=O)C1 606265143 QZSKHRHFPVHMPV-RXMQYKEDSA-N 192.240 -1.328 50 10 AAGE CC[S@@](=O)NCB(O)O 701948604 BGHPYMAMBHKUSM-SECBINFHSA-N 150.996 -1.728 50 10 AAGE NNC(=O)OC1CNC1 885223793 ITKQHBSLLRXABB-UHFFFAOYSA-N 131.135 -1.442 50 10 AAGE O=C(F)N[C@H](CB(O)O)C(=O)O 1881054610 DNPKZKBWCYLFLX-UWTATZPHSA-N 178.912 -1.409 50 10 AAGE NNC(=O)C(=O)N1CCOCCO1 1883761412 STCAOFCDTYHBKM-UHFFFAOYSA-N 189.171 -2.233 50 10 AAGE CCc1c(B(O)O)cnn1C 1929941195 FWJZPJREUXXCJM-UHFFFAOYSA-N 153.978 -1.338 50 10 AAGE CCN1CC[C@@](N)(B(O)O)C1 1953249644 CDANMQQOGIYHET-LURJTMIESA-N 158.010 -1.579 50 10 AAGE NNC(=O)CCN1CC(F)(CO)C1 1954084216 CTPFDKWVVJYNSW-UHFFFAOYSA-N 191.206 -1.617 50 10 AAGE C[C@@H](N)CNc1cc(B(O)O)ccn1 2210059952 FMBNLQQAAWUCCR-ZCFIWIBFSA-N 195.031 -1.480 50 10 AAGE CCC(CO)(CO)C(=O)NNC 2241244673 COZZZTDTYXPNPZ-UHFFFAOYSA-N 176.216 -1.382 50 10 AAGE O=C(C#CB(O)O)NCc1ncno1 2241472846 YLNFWOFDHFVQJB-UHFFFAOYSA-N 194.943 -2.299 50 10 AAGE C[C@H](O)CN(C)C(=O)C#CB(O)O 2241479257 UVZTZCAXESHHFO-LURJTMIESA-N 184.988 -2.159 50 10 AAGE NNC(=O)[C@@H](N)Cc1cnc[nH]1 5605734 HIQSHBQGIXVMBC-YFKPBYRVSA-N 169.188 -1.731 50 10 AAGE NNC(=O)NNCCCO 142136351 LPYTTXQKSXEMRK-UHFFFAOYSA-N 148.166 -1.954 50 10 AAGE CCOC(=O)/C(C#N)=C(/N)NN 211812769 XSOWLASWXKSYJI-PLNGDYQASA-N 170.172 -1.293 50 10 AAGE O=CC1=C[C@@H](O)[C@H](CO)O1 218199330 NWVFGYOPLJREHQ-RITPCOANSA-N 144.126 -1.179 50 10 AAGE COc1c(C=O)cncc1B(O)O 238373423 ZRTQFQSRSGILKY-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE C[C@H]1C[C@@H](C(=O)NN)NC1=O 238491908 WRVJLRJMCCSQSM-IMJSIDKUSA-N 157.173 -1.499 50 10 AAGE NCc1ncc(O)cc1B(O)O 238608971 YRWQGAMKJSMHFX-UHFFFAOYSA-N 167.961 -2.074 50 10 AAGE OB(O)c1c(O)cncc1F 238614419 HDFNRVUMTBQOKA-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE OCc1occc1B(O)O 238669728 NVATYHOEZNUABN-UHFFFAOYSA-N 141.919 -1.548 50 10 AAGE CO[C@@H]1C[C@@H](C(=O)NN)N(C)C1 307155844 WEWGHEBGPCJNLS-RITPCOANSA-N 173.216 -1.305 50 10 AAGE COC[C@H](C(=O)NN)N1C[C@H]2C[C@@H]2C1 380334557 DZNVCGHAVUHMJR-BWZBUEFSSA-N 199.254 -1.057 50 10 AAGE CC(=O)NNC(=O)c1cc(O)ncn1 1136046573 XYKKTOKAQUUVNZ-UHFFFAOYSA-N 196.166 -1.037 50 10 AAGE Cn1ncc(C(=O)NNC(=O)CO)n1 1611094800 NEYYRFZNUVIVNC-UHFFFAOYSA-N 199.170 -2.432 50 10 AAGE NNC(=O)C[C@@H]1CNC2(CC2)CO1 1882655214 KJWVKYRIVZPZCA-ZCFIWIBFSA-N 185.227 -1.113 50 10 AAGE NNC(=O)CN1C[C@@H](O)C2(CCC2)C1 1956265395 PRLMGIMCWUSWJF-SSDOTTSWSA-N 199.254 -1.177 50 10 AAGE COCCCNCC(=O)NN 58839448 IDVXNSUERGDQPA-UHFFFAOYSA-N 161.205 -1.398 50 10 AAGE COC(=O)c1ccc(B(O)O)c(C)n1 238379458 HBYNJTOVKQTBKA-UHFFFAOYSA-N 194.983 -1.144 50 10 AAGE CN(CCCO)C(=O)NN 300783684 GEBNDLQVTSRSJD-UHFFFAOYSA-N 147.178 -1.116 50 10 AAGE Cc1nn(CC(C)(C)O)cc1B(O)O 306809706 SJFDKRICTQPNJK-UHFFFAOYSA-N 198.031 -1.358 50 10 AAGE C/C=C/C(=O)NNC(=O)C(=O)OC 308392360 BRGFPWLVHHBQRA-ONEGZZNKSA-N 186.167 -1.117 50 10 AAGE CN[C-]1N=C=C(C#N)C(=O)N1 642855061 ATNYCYQMXNNBOA-UHFFFAOYSA-N 149.133 -1.098 50 10 AAGE C[C@@H](C(N)=O)N(C)CCC(=O)NN 711140411 YYVYRFSQYZZMDX-YFKPBYRVSA-N 188.231 -1.828 50 10 AAGE C[C@]12C[C@@H]1CN(C(=O)C(=O)NN)C2 1932260611 AFUNODJZLZSFFZ-SVGQVSJJSA-N 183.211 -1.155 50 10 AAGE NCc1nc(C(=O)NN)co1 1932896019 HXLCJEJBJFEDCP-UHFFFAOYSA-N 156.145 -1.263 50 10 AAGE NNC(=O)CN1CC[C@@H]2C[C@H]2C1=O 2209322270 KWHDTHFTNHIGCI-PHDIDXHHSA-N 183.211 -1.155 50 10 AAGE O=C(C#CB(O)O)N=c1nc[nH]s1 2241468449 ONPUMPARWPYVLZ-UHFFFAOYSA-N 196.984 -2.086 50 10 AAGE C[C@@H]1C[C@@H](N)CN1C(=O)C#CB(O)O 2241479086 RATZOZIWVKIEJQ-RNFRBKRXSA-N 196.015 -2.050 50 10 AAGE CCCN(CCO)CC(=O)NN 58849199 DBDYYMISEILMKK-UHFFFAOYSA-N 175.232 -1.319 50 10 AAGE C[C@H](N)C(=O)N[C@@H](C)B(O)O 169954388 CHOIZHQITXLUNX-IMJSIDKUSA-N 159.982 -2.150 50 10 AAGE CN(C)c1ncc(C(=O)NN)c(N)n1 238321263 UBDHHUSHTJEIJB-UHFFFAOYSA-N 196.214 -1.272 50 10 AAGE COc1cc(N)c(B(O)O)cn1 238369861 JKEXIGWMSTUMBE-UHFFFAOYSA-N 167.961 -1.648 50 10 AAGE NNC(=O)[C@@H](N)[C@@H]1CCCO1 306477007 ZPICSRSZEDAOTF-WHFBIAKZSA-N 159.189 -1.517 50 10 AAGE NNC(=O)c1n[nH]n(N)c1=O 306674898 RNKRKVYHMKRLMV-UHFFFAOYSA-N 158.121 -3.111 50 10 AAGE NNc1ccc(F)c(B(O)O)c1 307412946 GZAWPIXOGVSRMF-UHFFFAOYSA-N 169.952 -1.209 50 10 AAGE CN[C@@]1(C(=O)NN)CCOC1 307549304 PLPYIODNNWONMN-LURJTMIESA-N 159.189 -1.645 50 10 AAGE CC[C@](N)(COC)C(=O)NN 307624434 NRCIYYIDVDTVGD-LURJTMIESA-N 161.205 -1.270 50 10 AAGE O=C(O)[C@H](Cl)C[C@@H](O)[C@H](O)CO 307918673 VKFUMESKFQTBCR-UOWFLXDJSA-N 198.602 -1.217 50 10 AAGE NNC(=O)CN1C[C@H](O)C[C@@H]1CO 699289760 UFPCIJNNSUXGHD-PHDIDXHHSA-N 189.215 -2.596 50 10 AAGE N[C@H](CO)CNC(=O)F 1879973851 PZTVJKDSTUQWRZ-VKHMYHEASA-N 136.126 -1.015 50 10 AAGE CC(=O)Nc1ncc(B(O)O)c(C)n1 1888086867 RERGUUADWHUYSO-UHFFFAOYSA-N 194.987 -1.577 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H](O)[C@@H](F)C1 1929910418 MTVYMMZHYJKXGL-SRQIZXRXSA-N 191.206 -1.621 50 10 AAGE CNNC(=O)[C@@H]1CO[C@@H]2COC[C@@H]21 1954357618 OZPIEGGWXRNQIA-FSDSQADBSA-N 186.211 -1.102 50 10 AAGE NNC(=O)C(=O)N1CC2CC(C2)C1 1954723491 ORFBVKXAMRNJHB-UHFFFAOYSA-N 183.211 -1.155 50 10 AAGE CCOC(=O)c1nc(C)c(B(O)O)o1 2049399237 AGTAXDRMWUBZCN-UHFFFAOYSA-N 198.971 -1.160 50 10 AAGE C[C@]1(CO)C=CCN1CC(=O)NN 2209322220 KGNSQBUYOWOATJ-MRVPVSSYSA-N 185.227 -1.401 50 10 AAGE CN(C)NC(=O)[C@@H]1CC[C@@H](O)CN1 2241252298 QELUVJQCYQQJBL-RQJHMYQMSA-N 187.243 -1.308 50 10 AAGE C=C[C@H](CO)NC(=O)[C@H]1C[C@H]1B(O)O 2241494827 DRKAXGYHKCZKKT-DSYKOEDSSA-N 199.015 -1.488 50 10 AAGE O=C1C[C@H](C(=O)NCCCl)NN1 170233015 NNTFLJSKOQQVAO-SCSAIBSYSA-N 191.618 -1.266 50 10 AAGE CCNC(=O)N/C=C(/C=O)C(N)=O 210711763 URVBCPKCFYVYJQ-HYXAFXHYSA-N 185.183 -1.126 50 10 AAGE NC(=O)NN=C(C(=O)O)C(=O)O 238587977 DKVOCSZBPBSQSN-UHFFFAOYSA-N 175.100 -1.820 50 10 AAGE NNC(=O)CCC[C@H](N)C(=O)O 238656431 UJYGCXRIXYLJGB-BYPYZUCNSA-N 175.188 -1.442 50 10 AAGE CO[C@@H]1C(C#N)=C[C@H](O)[C@H](O)[C@@H]1O 306291254 QXDLLPJMUFXFAE-DKXJUACHSA-N 185.179 -1.452 50 10 AAGE CC(=O)N1CC[C@@H](C(=O)NN)C1 306629432 KAEHYEDMGUWQDV-ZCFIWIBFSA-N 171.200 -1.155 50 10 AAGE CN(C)Cc1cccc(B(O)O)n1 306878380 FDKKPCWACJMVDG-UHFFFAOYSA-N 180.016 -1.177 50 10 AAGE Cc1cc(B(O)O)ccc1NN 306900609 FLGKRJDJYXCOOJ-UHFFFAOYSA-N 165.989 -1.040 50 10 AAGE OCc1nc2cc(B(O)O)ccc2o1 307111625 NQSFMQRIFIKVNU-UHFFFAOYSA-N 192.967 -1.000 50 10 AAGE CN1C=C[C@]2(C(=O)NN)C[C@@H]2C1=O 307336969 FUGIVDMTEKFFRB-XRGYYRRGSA-N 181.195 -1.032 50 10 AAGE CO[C@@H]1CNC[C@@H]1C(=O)NN(C)C 690132428 YWNURDYYCHDRAU-NKWVEPMBSA-N 187.243 -1.186 50 10 AAGE NNC(=O)CN1C[C@@H](O)C[C@H]1CO 699289765 UFPCIJNNSUXGHD-WDSKDSINSA-N 189.215 -2.596 50 10 AAGE Cc1nc(C(=O)NCB(O)O)no1 702017128 IKYGAOUWHVSDFM-UHFFFAOYSA-N 184.948 -1.880 50 10 AAGE O=C(F)N[C@@H]1CNC[C@H]1O 1880063877 JJFMQIHKNFOJST-QWWZWVQMSA-N 148.137 -1.002 50 10 AAGE NS(=O)(=O)NCCCNC(=O)F 1881052484 BDNVLIDGADBELY-UHFFFAOYSA-N 199.207 -1.151 50 10 AAGE COCCn1cc(C#CB(O)O)cn1 1889209045 ILBZYSJNGNKGGP-UHFFFAOYSA-N 193.999 -1.107 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@H]1[C@H]2CO 1902449859 ZZQUFHPUFQONMC-SRQIZXRXSA-N 199.210 -2.185 50 10 AAGE NNC(=O)[C@H]1NCCC[C@H]1O 1923930681 PDACPCZAHAJWQK-UHNVWZDZSA-N 159.189 -1.911 50 10 AAGE Cc1ncnc(NC(=O)C(=O)NN)n1 1930510032 ACNSHWHKDNAXOR-UHFFFAOYSA-N 196.170 -1.892 50 10 AAGE NNC(=O)Cn1ccc(O)cc1=O 1954244425 XMAVKODNWWAIKB-UHFFFAOYSA-N 183.167 -1.456 50 10 AAGE Cn1ccc(=NC(=O)C#CB(O)O)[nH]1 2241468671 SBQBKIOYEBARDQ-UHFFFAOYSA-N 192.971 -2.204 50 10 AAGE O=C(NCC1CNC1)C1(B(O)O)CC1 2241478467 GAEQUMGRZQMJPF-UHFFFAOYSA-N 198.031 -1.671 50 10 AAGE C[C@@H](O)C(C)(C)NC(=O)C#CB(O)O 2241478520 GXAQBUOGIWXAPA-ZCFIWIBFSA-N 199.015 -1.723 50 10 AAGE CCONC(=O)c1occc1B(O)O 2241480145 DSGJFKISSYGUOY-UHFFFAOYSA-N 198.971 -1.359 50 10 AAGE CONC(=O)c1c[nH]nc1B(O)O 2241480327 KHXUZSDJDYZSQZ-UHFFFAOYSA-N 184.948 -2.619 50 10 AAGE O=C(Nc1ncon1)[C@@H]1C[C@@H]1B(O)O 2241481303 QYPBGCBTLXHYPI-DMTCNVIQSA-N 196.959 -1.129 50 10 AAGE Nc1cc(B(O)O)cnc1C=O 206091719 FXXVBVCNHDZPQH-UHFFFAOYSA-N 165.945 -1.844 50 10 AAGE C#CC[C@@H](N)CB(O)O 219632449 ALGGQPYWZFYMJF-RXMQYKEDSA-N 126.952 -1.190 50 10 AAGE NCC(=O)N1CCC[C@@H]1B(O)O 220671664 BZTBBVKEKPNNBE-RXMQYKEDSA-N 171.993 -2.052 50 10 AAGE NNC(=O)N[C@H]1CNC(=O)C1 229354950 COWCMDNGBNPQPB-GSVOUGTGSA-N 158.161 -1.952 50 10 AAGE NCCC(=O)NCC(=O)NN 238551661 ZFXXLUQONQBWBH-UHFFFAOYSA-N 160.177 -2.559 50 10 AAGE NC(=O)NN[C@@H]1N=CN=C1C(N)=O 306228426 FPDDCPHSMLBIIK-BYPYZUCNSA-N 184.159 -2.546 50 10 AAGE Cn1cc(C(=O)NNC(N)=O)nn1 307374613 UHMLRDNFHWEZOS-UHFFFAOYSA-N 184.159 -1.872 50 10 AAGE COC(=O)C(=O)NNC(=O)[C@H](C)O 308412668 MCYIDXYCOVPEGO-VKHMYHEASA-N 190.155 -2.312 50 10 AAGE COC(=O)NNC(=O)NC[C@@H](C)O 393547285 IZBYNEOEDSGNEU-SCSAIBSYSA-N 191.187 -1.063 50 10 AAGE COCCn1ccc(B(O)O)n1 694268702 GLYHQXHJNWVROQ-UHFFFAOYSA-N 169.977 -1.791 50 10 AAGE CN(C)NC(=O)C1(CN)CC(O)C1 1882799662 KUSQNQJUGUQHAF-UHFFFAOYSA-N 187.243 -1.321 50 10 AAGE CC(=O)NNC(=O)c1cc(=N)[nH][nH]1 1883132730 FDMWPOJRTQKJDG-UHFFFAOYSA-N 183.171 -1.397 50 10 AAGE C[C@@H]1[C@H](O)CCN1C(=O)C(=O)NN 1914255369 NGEAYUUOYHYKNZ-RFZPGFLSSA-N 187.199 -2.042 50 10 AAGE O=C(CCn1cnnn1)NCB(O)O 1928819516 QWILXEWCEBPYHB-UHFFFAOYSA-N 198.979 -2.809 50 10 AAGE NNC(=O)CN1C[C@H](O)C(F)(F)C1 1931821362 GDFOYINDHZSEAH-BYPYZUCNSA-N 195.169 -1.712 50 10 AAGE N#C[C@@H](O)[C@@H](N)CN1CCCC1=O 1952793668 MDUKVXFWTKKTGR-NKWVEPMBSA-N 183.211 -1.179 50 10 AAGE CN1CCN(C[C@H](N)[C@@H](O)C#N)CC1 1952796990 XLYLINZBBMUADX-IUCAKERBSA-N 198.270 -1.554 50 10 AAGE CN(C)NC(=O)[C@]12CNC[C@@H]1COC2 1955584349 YWJYBPLYWPLUQJ-APPZFPTMSA-N 199.254 -1.185 50 10 AAGE CC(C)ONC(=O)C#CB(O)O 2241478974 OTSCLNNMXBNLDL-UHFFFAOYSA-N 170.961 -1.542 50 10 AAGE N#CNc1ncc(B(O)O)s1 2241560095 RBTCUJFPAMYQEE-UHFFFAOYSA-N 168.974 -1.284 50 10 AAGE NNC(=O)CNC(=O)c1ccccn1 293876 DWCIOGLPLXMOQI-UHFFFAOYSA-N 194.194 -1.199 50 10 AAGE O=C/C(O)=C(/O)[C@H](O)[C@@H](O)CO 147087260 ADGXMKSOBBXKBS-MDMYCTLOSA-N 178.140 -1.773 50 10 AAGE C[C@]1(NC(=O)C(=O)NN)CCOC1 229487168 HKEXKEQCQUHPBY-ZETCQYMHSA-N 187.199 -1.729 50 10 AAGE COC(=O)NN[C@@H](CO)C(=O)O 238315008 ABTWDZHRJKMHBE-VKHMYHEASA-N 178.144 -1.708 50 10 AAGE [C-]#[N+][C@]1(O)C=C[C@](O)([C@H](C)O)[C@@H]1O 306341684 YDESHCUKJUUXAP-XAMCCFCMSA-N 185.179 -1.363 50 10 AAGE C[C@@H](C(=O)O)C(=O)NN 307032988 QSUZSVISZFSEIC-UWTATZPHSA-N 132.119 -1.303 50 10 AAGE CN1CC(=O)N/C1=C(/C#N)C(N)=O 307982197 DRYHEFVEWWFJRE-QPJJXVBHSA-N 180.167 -1.732 50 10 AAGE COC[C@H](C)CC(=O)NCB(O)O 702021779 GFBPLZAFSNQVOG-ZCFIWIBFSA-N 189.020 -1.213 50 10 AAGE CC(C)OCn1ccc(B(O)O)n1 703769495 LUORBOOFTROBOO-UHFFFAOYSA-N 184.004 -1.055 50 10 AAGE COc1nn(C)cc1B(O)O 1880387964 JSVVXEHFQZZLBV-UHFFFAOYSA-N 155.950 -1.892 50 10 AAGE COC(=O)c1nc(B(O)O)cs1 1880849350 KJMSHYYPADCSOV-UHFFFAOYSA-N 186.985 -1.391 50 10 AAGE CSCCNC(=O)NCB(O)O 1880874245 IODZNXWZGMOXJI-UHFFFAOYSA-N 192.049 -1.339 50 10 AAGE NNC(=O)CCN1C[C@H]2COC[C@@H]21 1882699106 REUKDJVHRNWFEJ-BQBZGAKWSA-N 185.227 -1.303 50 10 AAGE CN(C)NC(=O)C1(N)CC(CO)C1 1883306778 LKRQJERPRSKSPT-UHFFFAOYSA-N 187.243 -1.321 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2C[C@@H](O)[C@H]1C2 1884635099 PNAKZEPMSADYTR-WCTZXXKLSA-N 199.254 -1.180 50 10 AAGE CS(=O)(=O)[C@@H](C(=O)NN)C1CC1 1886834812 SSHBITGVPDOFNX-RXMQYKEDSA-N 192.240 -1.201 50 10 AAGE CN1CCN(CC(=O)NN)C[C@H]1C#N 1914860684 IMELQJRZVGDLTJ-SSDOTTSWSA-N 197.242 -1.884 50 10 AAGE CCON(C)[C@@H](COC)C(=O)NN 1928678247 PNKKOJXQXRCYTE-LURJTMIESA-N 191.231 -1.125 50 10 AAGE NNC(=O)[C@@H]1CCNC[C@H]1F 1953298325 ICRCGRJHNWRRTN-RFZPGFLSSA-N 161.180 -1.076 50 10 AAGE NC(=O)CN(CCCl)CC(N)=O 1953616623 BXQVESXTVFOODZ-UHFFFAOYSA-N 193.634 -1.502 50 10 AAGE CN1CCN(C(=O)C(=O)NN)[C@H]2C[C@@H]21 1956639449 VRJHKCSEVOXKDU-WDSKDSINSA-N 198.226 -2.109 50 10 AAGE NNC(=O)CN1CC[C@H]2C[C@H]2C1=O 2209322269 KWHDTHFTNHIGCI-NTSWFWBYSA-N 183.211 -1.155 50 10 AAGE C[C@H](N)CNc1ncccc1B(O)O 2210068289 PKDKEAFCEBQBQY-LURJTMIESA-N 195.031 -1.480 50 10 AAGE O=C(NO)c1cc(B(O)O)n[nH]1 2241585060 XSGJUVHFZAZZAW-UHFFFAOYSA-N 170.921 -2.792 50 10 AAGE NC(=O)NNC(=O)c1cn[nH]c1 70044687 KGUFGVCBRRYDPK-UHFFFAOYSA-N 169.144 -1.277 50 10 AAGE COc1nccc(N)c1B(O)O 238427073 SMQQBCWHOJXKEQ-UHFFFAOYSA-N 167.961 -1.648 50 10 AAGE COc1cc(B(O)O)c(O)cn1 238445715 SGHGSCTUJVILDO-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE O[C@@H]1[C@H](Cl)[C@@H]2O[C@@H]2[C@H](O)[C@@H]2O[C@H]12 306314675 WFGOXUXPFAZWNB-OWNCIEGHSA-N 192.598 -1.136 50 10 AAGE NNc1ccc(B(O)O)cc1 306891525 GJSXMTPLIUTEQR-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE C[C-]1NC#CN1CC(=O)NN 885247662 LKSCMEZLQUXHIS-UHFFFAOYSA-N 153.165 -1.691 50 10 AAGE OB(O)c1ncnc2ncccc12 1882573942 KDUWXXDYSHIZOT-UHFFFAOYSA-N 174.956 -1.295 50 10 AAGE C[C@]1(C(=O)NN)C[C@H](N)CCO1 1929653707 OCDYNTVNPPTBDG-IYSWYEEDSA-N 173.216 -1.127 50 10 AAGE C[C@H]1[C@@H](NC(=O)C(=O)NN)C1(F)F 1933128713 YTNRORVSVLYPBT-STHAYSLISA-N 193.153 -1.254 50 10 AAGE O=C(C#CB(O)O)N1CC[C@@H](CO)C1 2241467846 BWAPEUXVZUOMMH-SSDOTTSWSA-N 196.999 -2.157 50 10 AAGE O=C(N[C@@H]1CCOC1)[C@@H]1C[C@@H]1B(O)O 2241474374 BUOHAZYFTPZLOQ-QYNIQEEDSA-N 199.015 -1.246 50 10 AAGE CN(O)C(=O)c1ccc(B(O)O)cn1 2241474924 NLYFBTARACDWLS-UHFFFAOYSA-N 195.971 -1.777 50 10 AAGE NNC(=O)C#CB(O)O 2241479302 VUYLCHYAPSXTPT-UHFFFAOYSA-N 127.896 -3.008 50 10 AAGE O=C(C#CB(O)O)NN1CCC1 2241479504 ZIBNUFZTIKGHLY-UHFFFAOYSA-N 167.961 -2.261 50 10 AAGE CNC(=O)NCCC#CB(O)O 2241899947 LGXJUGLHQKLIIV-UHFFFAOYSA-N 169.977 -1.679 50 10 AAGE CNNC(=O)[C@H](C)N 34599056 FIBDBVAAKRUSQR-VKHMYHEASA-N 117.152 -1.416 50 10 AAGE C[C@H](N)C(=O)N(C)N 59378800 OUGPXJZICUDSLI-VKHMYHEASA-N 117.152 -1.334 50 10 AAGE CO[C@@H]1CN[C@H](C(=O)NN(C)C)C1 147239278 DQCBPCPPFPTUBB-BQBZGAKWSA-N 187.243 -1.044 50 10 AAGE Cn1nc(N)c(C(=O)NN)c1N 238542157 WYFCDOJGYXEBKS-UHFFFAOYSA-N 170.176 -1.812 50 10 AAGE NNC(=O)[C@@H]1CC[C@H]1CO 306404988 USMCIMXWDIRHSU-CRCLSJGQSA-N 144.174 -1.005 50 10 AAGE CC(=O)NNC(=O)N[C@H](C)C(N)=O 306599112 HEJPQYWMANOHNA-GSVOUGTGSA-N 188.187 -1.790 50 10 AAGE CN(C)C1CN(C(=O)NN)C1 306666683 VJMQBZITHLJORB-UHFFFAOYSA-N 158.205 -1.185 50 10 AAGE COC[C@@H](C)C(=O)NNC(=O)CO 379378391 AGQYTAYBXMNELE-RXMQYKEDSA-N 190.199 -1.591 50 10 AAGE CCNC(=O)NNC(=O)c1nc[nH]n1 1253357404 HMSHITFUEXNHSS-UHFFFAOYSA-N 198.186 -1.231 50 10 AAGE O=C(NCC=CB(O)O)c1cn[nH]c1 1892923178 CWEGEPRHKVUDRF-UHFFFAOYSA-N 194.987 -1.292 50 10 AAGE CN(N)C(=O)[C@@]1(C)CNC(=O)C1 1953705418 SUALERFNTOYKMZ-SSDOTTSWSA-N 171.200 -1.155 50 10 AAGE O=C(N1CC[C@@H](B(O)O)C1)C1(O)CC1 2208732149 PQXJRTZZYCTESN-ZCFIWIBFSA-N 199.015 -1.413 50 10 AAGE NC(=O)c1ccoc1B(O)O 2241468473 OYGBPSNWRKJTAT-UHFFFAOYSA-N 154.918 -1.942 50 10 AAGE NC[C@H]1C[C@@H]1NC(=O)C1(B(O)O)CC1 2241473044 BVIGHSMEUBAWTA-RITPCOANSA-N 198.031 -1.543 50 10 AAGE CC(CO)(CO)NC(=O)C(=O)NN 5302051 PKRYBBPEHRILPP-UHFFFAOYSA-N 191.187 -3.164 50 10 AAGE NNC(=O)C(=O)NCC1CC1 34977824 PCNWHUGISNCFOH-UHFFFAOYSA-N 157.173 -1.498 50 10 AAGE CC[C@@H](C(=O)NN)N1CC[C@H](O)C1 82468664 SFAVXXWFBHKFMX-BQBZGAKWSA-N 187.243 -1.179 50 10 AAGE CCn1cc(B(O)O)c(C)n1 203580615 DZKXVWMSRNKZMW-UHFFFAOYSA-N 153.978 -1.109 50 10 AAGE Cc1[nH]nc(CO)c1C(=O)NN 238495350 FOWXKXWLUVGKOR-UHFFFAOYSA-N 170.172 -1.186 50 10 AAGE O=C1O[C@H](CO)[C@H](O)[C@H]1Cl 306229551 HCPFLJPXBRSDPJ-JJYYJPOSSA-N 166.560 -1.128 50 10 AAGE O=CC1=CC(=O)[C@@H]2O[C@@H]2[C@H]1O 307564787 QOYPXUBTGNKJBY-LYFYHCNISA-N 154.121 -1.177 50 10 AAGE CCC(=O)NCCC(=O)NN 307567896 RLNHKOMDKNDSJP-UHFFFAOYSA-N 159.189 -1.107 50 10 AAGE CN1N[C@@H](Br)N=C1NN 605678373 WITCREYBGOUKPE-REOHCLBHSA-N 194.036 -1.066 50 10 AAGE NS(=O)(=O)N1CCNC[C@H]1Cl 616639618 WHXJMEWNESWHSM-BYPYZUCNSA-N 199.663 -1.340 50 10 AAGE NNC(=O)CN1CC[C@H](O)[C@H](O)C1 1882908078 VDOMZIHVOVGCEP-NTSWFWBYSA-N 189.215 -2.596 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@@H](O)C[C@H]2C1 1886544660 WMRYMCAZJBXYAT-RNLVFQAGSA-N 199.254 -1.321 50 10 AAGE OB(O)c1ccnc(NC2COC2)c1 2210067604 AZKHBUNMXYKLNG-UHFFFAOYSA-N 193.999 -1.428 50 10 AAGE CCNC(=O)c1c(B(O)O)cnn1C 2241468418 NVMBLZHCUIDVJU-UHFFFAOYSA-N 197.003 -2.150 50 10 AAGE NC(=O)C#CB(O)O 2241468826 VNUOOQUHHLRECC-UHFFFAOYSA-N 112.881 -2.513 50 10 AAGE CC[C@@](C)(O)CNC(=O)C#CB(O)O 2241470679 BHKYJHZODHTPQA-MRVPVSSYSA-N 199.015 -1.721 50 10 AAGE C[C@@H](O)CC(=O)NCC=CB(O)O 2241562092 IALBNOFOWBTAQP-ZCFIWIBFSA-N 187.004 -1.558 50 10 AAGE C[C@H](NC(=O)N(C)N)C(=O)O 39072944 YYIVBPXHCBRIFG-VKHMYHEASA-N 161.161 -1.025 50 10 AAGE NCC(=O)N[C@H](CCl)C(=O)O 196543304 SOGGVBPIKBZBLN-GSVOUGTGSA-N 180.591 -1.247 50 10 AAGE N[C@H](CCSCB(O)O)C(=O)O 213035387 JIADETXLJBAGMM-SCSAIBSYSA-N 193.033 -1.466 50 10 AAGE NNC(=O)C[C@H](NCCO)C(=O)O 238659095 KNATUMAAOOHKHL-BYPYZUCNSA-N 191.187 -2.599 50 10 AAGE O=[N+]([O-])c1ncc(B(O)O)cn1 307058457 FXALMRDVTYTMDV-UHFFFAOYSA-N 168.905 -1.935 50 10 AAGE Cn1nnc(NC(=O)NN)n1 307501777 VEWVMYYOXREXLV-UHFFFAOYSA-N 157.137 -1.795 50 10 AAGE CCOC(=O)NNC(=O)CNC 307996282 WMNJYAOQUAENRA-UHFFFAOYSA-N 175.188 -1.017 50 10 AAGE CC[C@@H](CO)N(C)CC(=O)NN 379024881 UNZNHJBZKVQRMF-LURJTMIESA-N 175.232 -1.321 50 10 AAGE CO[C@@H](C)CN(C)C(=O)C(=O)NN 379347495 HGRMIIZMDHRXRL-YFKPBYRVSA-N 189.215 -1.530 50 10 AAGE CNNC(=O)NCCN[N+](=O)[O-] 687758620 CFONHRAZRYHFHR-UHFFFAOYSA-N 177.164 -1.799 50 10 AAGE ClCS[C@@H]1NN[C@@H]2NCNN21 953055311 VRNJZESRJTYCFO-IUYQGCFVSA-N 195.679 -1.042 50 10 AAGE CN(NC(=O)C1(O)COC1)C1CC1 1142667358 HFTGTSGXLVISTC-UHFFFAOYSA-N 186.211 -1.127 50 10 AAGE NCC=CC(=O)NN 1879940583 GVVINXONIBZEML-UHFFFAOYSA-N 115.136 -1.509 50 10 AAGE NC(=O)NNC(=O)Cn1cnnc1 1928683048 GYTTYJVQXIXANV-UHFFFAOYSA-N 184.159 -2.022 50 10 AAGE C[C@H](C(=O)NN)N1CCO[C@H]2C[C@H]21 1954051128 NHRDEOVWYDQPTG-QYNIQEEDSA-N 185.227 -1.162 50 10 AAGE CCOC1(CO)CN(C(=O)NN)C1 1954120372 YAWIFEYHZWEDPY-UHFFFAOYSA-N 189.215 -1.347 50 10 AAGE NNC(=O)N[C@@H]1CO[C@@H]2COC[C@@H]12 1954357894 RTJMRVGAWLRPTN-KVQBGUIXSA-N 187.199 -1.427 50 10 AAGE Cn1nnc(B(O)O)c1C(=O)NO 2241583898 GFQZNQYLUSHPFL-UHFFFAOYSA-N 185.936 -3.386 50 10 AAGE N/N=C1/C(=O)NN=C1C(=O)NN 306700405 DSSZYKXPBVCXAM-UHFFFAOYSA-N 170.132 -3.223 50 10 AAGE NNC(=O)[C@H](N)C1CC1 307116501 FTAZVDPIXSRWNM-SCSAIBSYSA-N 129.163 -1.286 50 10 AAGE COC(=O)c1nscc1B(O)O 307159997 CYEQNVIIFWEYBV-UHFFFAOYSA-N 186.985 -1.391 50 10 AAGE O=C1CN=C2N[C@H](Cl)NC[C@H]2N1 605700470 ZHDXVJCBZUMXAE-AWFVSMACSA-N 188.618 -1.402 50 10 AAGE NNc1nc(B(O)O)cs1 1690107159 XYZCLZWOAAYIGC-UHFFFAOYSA-N 158.979 -1.892 50 10 AAGE CP(C)(=O)C[C@H](N)C(=O)NN 1886394840 DYDFQDFXIJRXSB-BYPYZUCNSA-N 179.160 -1.074 50 10 AAGE Cc1nc(NC(N)=O)ncc1B(O)O 1888086498 KLDXUIISRLBLRR-UHFFFAOYSA-N 195.975 -2.045 50 10 AAGE CN(CCn1ccnc1)CC(=O)NN 1930065376 YMSRBIDAXZMLDW-UHFFFAOYSA-N 197.242 -1.195 50 10 AAGE N#C[C@@]1(O)CNCCOC1 1931926296 FCEANBJPIMJNPS-ZCFIWIBFSA-N 142.158 -1.139 50 10 AAGE CS(=O)(=O)CC[C@H](N)[C@H](O)C#N 1952815485 NVUKUPSYFFIAPQ-NTSWFWBYSA-N 192.240 -1.367 50 10 AAGE C[C@@]1(CO)C=CCN1CCC(=O)NN 2209890910 QVGQEAONYXRWSV-VIFPVBQESA-N 199.254 -1.011 50 10 AAGE C[C@@H](O)CNc1ncccc1B(O)O 2210061283 SNYBKSPOOOESLJ-ZCFIWIBFSA-N 196.015 -1.446 50 10 AAGE CN(CCN)C(=O)[C@H]1C[C@H]1B(O)O 2241481132 PBAIYZMWHDZBGX-NTSWFWBYSA-N 186.020 -1.734 50 10 AAGE NNC(=O)CN1CCCCC1=O 70162215 UZUIMBZZRAGUEW-UHFFFAOYSA-N 171.200 -1.011 50 10 AAGE CN(C(N)=O)N(C)C(N)=O 79720001 BVDOVMKIBPOJON-UHFFFAOYSA-N 146.150 -1.078 50 10 AAGE NCc1nccc(O)c1B(O)O 238611283 ZCLQGIHNVQGKLX-UHFFFAOYSA-N 167.961 -2.074 50 10 AAGE NNC(=O)N1C[C@@H](O)[C@@H](CO)C1 306596434 VIXUQKSYXJFUIP-RFZPGFLSSA-N 175.188 -2.145 50 10 AAGE COc1c(F)ccnc1B(O)O 307530956 SITBYDJLNWSZBK-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE COC(=O)C(=O)C(C)=NNC(N)=O 383550716 SDGMJYRAFKZRGO-UHFFFAOYSA-N 187.155 -1.227 50 10 AAGE C[C@@H](CN1CC2(COC2)C1)C(=O)NN 697132405 IAJVRVMHGJJSSG-ZETCQYMHSA-N 199.254 -1.055 50 10 AAGE 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NNC(=O)[C@H]1COC[C@H]1N 85374381 SQMWJHQZPZAGAB-IUYQGCFVSA-N 145.162 -2.050 50 10 AAGE COC(=O)/C(C#N)=C1\NCCNC1=O 143799107 WXUHHLQJTXCKLI-WAYWQWQTSA-N 195.178 -1.344 50 10 AAGE C[C@H](B(O)O)N1CC[C@@](C)(N)C1=O 195847414 ATJSDXPLQQPXNL-IYSWYEEDSA-N 186.020 -1.663 50 10 AAGE OB(O)c1nc2c(o1)CCNC2 238658336 RVJYKRIJKWKOLR-UHFFFAOYSA-N 167.961 -2.000 50 10 AAGE N#C[C@@H](O)[C@@H]1NC(=O)CNC1=O 260720963 JATAXIPSPLTZCL-WUJLRWPWSA-N 169.140 -2.515 50 10 AAGE CC(=O)N/N=C1\C(=O)NN=C1N 306921232 PNJIWUCVLPUUPH-UHFFFAOYSA-N 169.144 -2.120 50 10 AAGE CC(=O)NNC(=O)COCCO 379321817 FQXFDCVWJWQKPN-UHFFFAOYSA-N 176.172 -1.837 50 10 AAGE CC(=O)NNC(=O)c1nnn(C)n1 1587582047 NVOZPONDESIVAH-UHFFFAOYSA-N 184.159 -2.009 50 10 AAGE COc1ccc(NC=O)cc1B(O)O 1888562448 VJBUIJPPDHJVJZ-UHFFFAOYSA-N 194.983 -1.057 50 10 AAGE CNC(=O)[C@@H](C)N(C)C(=O)NN 1916838086 LYQJJZNWVPYDJI-SCSAIBSYSA-N 174.204 -1.364 50 10 AAGE CCNC(=O)C1CN(C(=O)NN)C1 1953909825 JIQYMNCKOKXGJV-UHFFFAOYSA-N 186.215 -1.362 50 10 AAGE 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CN1CCN(CC(=O)NN)CC12CC2 1887584798 MPUWHLALTXPVGM-UHFFFAOYSA-N 198.270 -1.244 50 10 AAGE COCc1nn(C)cc1B(O)O 1953495752 JSSAZEDCLXZYDH-UHFFFAOYSA-N 169.977 -1.754 50 10 AAGE C[C@H](NC#N)c1nscc1B(O)O 2241561596 AFTGZXNSKGZRFO-BYPYZUCNSA-N 197.028 -1.045 50 10 AAGE NNC(=O)CC(N)=O 1558565 FGVRDPGRFNBYRP-UHFFFAOYSA-N 117.108 -2.148 50 10 AAGE NC(=S)NNC(=O)Cn1cccn1 196915222 DSYVSCVETVKGPH-UHFFFAOYSA-N 199.239 -1.253 50 10 AAGE CN1C(=O)[C@@H](C(=O)NN)C1(C)C 307376736 VOVZUQDYXRQMOA-SCSAIBSYSA-N 171.200 -1.157 50 10 AAGE CNC(=O)C(=O)NNC(=O)OC 307718558 LOPNHPXTHBURJD-UHFFFAOYSA-N 175.144 -1.880 50 10 AAGE COCC(=O)NN[C@H](C)C(N)=O 308141507 HRAGPDOEARTAHY-SCSAIBSYSA-N 175.188 -1.873 50 10 AAGE CCC1(O)CN(CCC(=O)NN)C1 384104218 FWBMDYVZZNDXCN-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE CN(N)C(=O)[C@@H]1CCCC(=O)N1 575558200 MUNXEIHNLJWYQW-YFKPBYRVSA-N 171.200 -1.013 50 10 AAGE O[C@H]1CO[C@H]([C@@H](O)CCl)[C@@H]1O 616590934 UTWZPOKVDCHNES-UNTFVMJOSA-N 182.603 -1.293 50 10 AAGE CC(C)CS(=O)(=O)NCB(O)O 701940532 STETWQWLCREFBJ-UHFFFAOYSA-N 195.049 -1.426 50 10 AAGE O=C(Cn1ccnc1)NCB(O)O 702031130 UYGLOTDVVLUMMK-UHFFFAOYSA-N 182.976 -1.989 50 10 AAGE CN1[C@H]2CC[C@@H]1CN(CC(=O)NN)C2 723699385 CSTMQJCNFPXJSA-OCAPTIKFSA-N 198.270 -1.245 50 10 AAGE CC(=O)NN[CH]C1=C=C=C(C(=O)O)N1 885212732 MQCNDKFNPPJSGK-UHFFFAOYSA-N 194.170 -1.002 50 10 AAGE CN(C(=O)NN)C1COCCOC1 1882799372 HOLYAMLBIBOQIB-UHFFFAOYSA-N 189.215 -1.083 50 10 AAGE CN(N)C(=O)[C@@H]1CO[C@@H]2COC[C@H]21 1954356348 DZFGHQOWPHVJBX-RRKCRQDMSA-N 186.211 -1.020 50 10 AAGE OB(O)c1ccnc(NN2CCC2)c1 2210060754 NDQQJYMMPRMPPL-UHFFFAOYSA-N 193.015 -1.206 50 10 AAGE CN(CCO)C(=O)C1(B(O)O)CC1 2241479167 SNHOIYLWCWCENX-UHFFFAOYSA-N 187.004 -1.556 50 10 AAGE O=C(C#CB(O)O)N1CC([N+](=O)[O-])C1 2241479411 XMYGEMTUTILPCV-UHFFFAOYSA-N 197.943 -2.511 50 10 AAGE Cc1cc(B(O)O)cc(C(=O)NO)c1 2241583579 AAIMMYCYESDZLY-UHFFFAOYSA-N 194.983 -1.206 50 10 AAGE O=C(C#CB(O)O)NCC=C(F)F 2241589947 XVFZDQYHKPCEFN-UHFFFAOYSA-N 188.926 -1.102 50 10 AAGE C=CC(=O)NNC(N)=O 79274772 MOTDNXYKGMWBHE-UHFFFAOYSA-N 129.119 -1.128 50 10 AAGE Nc1ncc(B(O)O)cc1CO 203592179 CBQQBCJKDLKTTI-UHFFFAOYSA-N 167.961 -2.164 50 10 AAGE Cc1c(C#N)cncc1B(O)O 238523237 GMESYROAFDUMJY-UHFFFAOYSA-N 161.957 -1.059 50 10 AAGE N[C@H]1C[C@@H](B(O)O)CCN1 238648353 KASPECHGUTWSTI-CRCLSJGQSA-N 143.983 -1.502 50 10 AAGE CNC(=O)NNC(=O)c1cnc[nH]1 306957263 STYLQEZVAVPKCT-UHFFFAOYSA-N 183.171 -1.017 50 10 AAGE NNC(=O)N1C[C@@H](O)C[C@@H]1CO 606252156 JCHPKMNTJQYBSL-UHNVWZDZSA-N 175.188 -2.003 50 10 AAGE C[C@@]1(C(=O)NCC#CB(O)O)C[C@@H]1F 1895237586 BILKGDYNHJIMOB-POYBYMJQSA-N 198.990 -1.134 50 10 AAGE NNC(=O)CN1C[C@@H]2C(CO)[C@H]2C1 1929054693 MIAOMWUJWVXRTI-WDSKDSINSA-N 185.227 -1.854 50 10 AAGE NC(=O)Nc1ccc(B(O)O)cn1 1954371300 PFBZMDZKVWKELY-UHFFFAOYSA-N 180.960 -1.748 50 10 AAGE C[C@H](CC(=O)NN)N1CC=C[C@H](O)C1 1956305917 FREKJCOEQKYSRA-SFYZADRCSA-N 199.254 -1.012 50 10 AAGE Cc1cc(B(O)O)c(C(N)=O)s1 2241474403 CHIOWPLLOCPQGC-UHFFFAOYSA-N 185.013 -1.165 50 10 AAGE CNC(=O)c1nc(C)ccc1B(O)O 2241482048 ZVMTWRQVMRDVGB-UHFFFAOYSA-N 193.999 -1.571 50 10 AAGE CC(C)C(O)(C(=O)NN)C(=O)NN 1655782 CUQCEHDWKVHMTP-UHFFFAOYSA-N 190.203 -2.647 50 10 AAGE C=CN(N)C(=O)CC(=O)NN 39136639 VUFZIFATWOZVDP-UHFFFAOYSA-N 158.161 -1.788 50 10 AAGE C[C@@H](O)CNC[C@@H](C)C(=O)NN 58837082 YUUJZTVUSKTORE-PHDIDXHHSA-N 175.232 -1.417 50 10 AAGE C[C@@H](C(=O)NN)c1n[nH]c(N)nc1=O 238413771 QCXOGXDHGKWGCO-UWTATZPHSA-N 198.186 -2.160 50 10 AAGE O=C1OCc2cncc(B(O)O)c21 238657738 UWJDUFWPQFZWGJ-UHFFFAOYSA-N 178.940 -1.568 50 10 AAGE Cc1cn(CC(=O)NN)c(O)n1 575561153 ZWDKDXBBEBGNAA-UHFFFAOYSA-N 170.172 -1.113 50 10 AAGE O=C(NCB(O)O)NCC1CC1 701044848 KWRPEQWMKSJFJA-UHFFFAOYSA-N 171.993 -1.292 50 10 AAGE O=C(CO)NNC(=O)[C@@H]1C[C@H]1F 1654451197 VWAIDUQJTRMYEY-QWWZWVQMSA-N 176.147 -1.516 50 10 AAGE NNC(=O)C1CCN(C2CNC2)CC1 1888377885 ZAFOCYOZAYLWTR-UHFFFAOYSA-N 198.270 -1.340 50 10 AAGE O=C1CN(Cc2ncno2)CC(=O)O1 1932169351 QNYJRHUVKWJFDV-UHFFFAOYSA-N 197.150 -1.045 50 10 AAGE NNC(=O)C[C@]1(O)CCNC1 1953256056 CLTNTSWVXWWMHW-ZCFIWIBFSA-N 159.189 -1.909 50 10 AAGE CS(=O)(=O)NC(=O)C#CB(O)O 2241583730 CIAIIDKAOWTKOW-UHFFFAOYSA-N 190.973 -2.922 50 10 AAGE CN(CNC(=O)N[N+](=O)[O-])[N+](=O)[O-] 34616117 UMVVVLNSHARGII-UHFFFAOYSA-N 193.119 -1.442 50 10 AAGE COc1ccc2ncc(B(O)O)n2n1 238382210 LWBHRGRRUZWEFL-UHFFFAOYSA-N 192.971 -1.582 50 10 AAGE O=C1OCc2c(B(O)O)cncc21 238637094 MBLARMWHROBTQY-UHFFFAOYSA-N 178.940 -1.568 50 10 AAGE O=Cc1nc(CO)ccc1B(O)O 238724989 TYZZDZYQIAQGLN-UHFFFAOYSA-N 180.956 -1.934 50 10 AAGE CS(=O)(=O)NNC(=O)C1CC1 306192343 ZNAZYTMDCQQENN-UHFFFAOYSA-N 178.213 -1.023 50 10 AAGE CNC(=O)NNC(=O)c1nc[nH]n1 306662331 PPNIHGQOVRASBR-UHFFFAOYSA-N 184.159 -1.622 50 10 AAGE O[C@@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@@H](Cl)[C@@H]1O 307230278 BSMLUJHFZGTHOG-IGZLJULPSA-N 198.602 -2.588 50 10 AAGE CCc1cc(=O)n(CC(=O)NN)cn1 307442855 SRLBCSJIPSGNSA-UHFFFAOYSA-N 196.210 -1.204 50 10 AAGE CNC(=O)NNC(=O)C(N)=O 307711126 SCTZIGDRVGMAIQ-UHFFFAOYSA-N 160.133 -2.568 50 10 AAGE C=C(C#N)C[C@H](O)[C@@H](O)[C@H](O)CO 308192555 KMVUDXPMQMKZOL-XLPZGREQSA-N 187.195 -1.469 50 10 AAGE Cc1c(B(O)O)ccc2c1nnn2C 520787720 GMTYCYFWVMODDD-UHFFFAOYSA-N 190.999 -1.043 50 10 AAGE in-vitro O=C(NCB(O)O)c1cn[nH]c1 701939862 WCWFVAAAAYBIFB-UHFFFAOYSA-N 168.949 -1.849 50 10 AAGE COC(C)(C)C(=O)NCB(O)O 702017013 FAFTXBWDYIJUJU-UHFFFAOYSA-N 174.993 -1.460 50 10 AAGE NNC(=O)C(=O)NC[C@H]1[C@H]2OCC[C@H]12 1884457675 ZSHLIUFYBSKORX-PBXRRBTRSA-N 199.210 -1.873 50 10 AAGE Cn1ccnc1C(=O)NNCCO 1929831668 GNMAESWLSHXRQP-UHFFFAOYSA-N 184.199 -1.353 50 10 AAGE C[C@]1(O)CON(C(=O)NN)C1 1930291136 IHPGHRJNUJJDJF-RXMQYKEDSA-N 161.161 -1.432 50 10 AAGE C[C@@]1(O)CON(C(=O)NN)C1 1930291137 IHPGHRJNUJJDJF-YFKPBYRVSA-N 161.161 -1.432 50 10 AAGE Cc1cnc(OCCO)cc1B(O)O 2210066249 STCCWTGKHGCDMW-UHFFFAOYSA-N 196.999 -1.559 50 10 AAGE C[C@@H]1C[C@@H](F)CN1C(=O)C#CB(O)O 2241468193 IVMQRRUWCBOSAE-RNFRBKRXSA-N 198.990 -1.039 50 10 AAGE NCCNC(=O)c1ccc(B(O)O)o1 2241468272 KOSAGTBRUCGHDQ-UHFFFAOYSA-N 197.987 -2.352 50 10 AAGE N[C@H]1C[C@@H](NC(=O)C#CB(O)O)C1 2241479110 RMKPSOXQHLCXEN-OLQVQODUSA-N 181.988 -2.392 50 10 AAGE C[C@H](O)CNC(=O)[C@H]1C[C@@H]1B(O)O 2241481257 SDFDFNTZDYZDSX-ZLUOBGJFSA-N 187.004 -1.654 50 10 AAGE Cc1nn(C)c(C(N)=O)c1B(O)O 2241481721 UZEAWWXWTDCBIF-UHFFFAOYSA-N 182.976 -2.493 50 10 AAGE Cc1nn(C)c(B(O)O)c1C(N)=O 2241496020 OMKWGKOFKGHMPJ-UHFFFAOYSA-N 182.976 -2.493 50 10 AAGE O=C1O[C@H](CO)[C@@H](O)[C@@H]1Cl 238656597 HCPFLJPXBRSDPJ-FLRLBIABSA-N 166.560 -1.128 50 10 AAGE O=C1Cc2c(cncc2B(O)O)N1 238657768 MAOWMDVOQJBOCU-UHFFFAOYSA-N 177.956 -1.744 50 10 AAGE Nc1cc(B(O)O)cc2[nH]ncc12 306240518 KGXLCPBQCKKFQH-UHFFFAOYSA-N 176.972 -1.175 50 10 AAGE NNC(=O)N1CC(O)C1 307635650 VQVNXTUZFMTLEW-UHFFFAOYSA-N 131.135 -1.754 50 10 AAGE NCCNC(=O)/C=C/C(=O)NN 383550806 SRLQTHRYCWJTKO-OWOJBTEDSA-N 172.188 -2.393 50 10 AAGE N#CNCB(O)O 575471009 BMCNVKYPCLUYMM-UHFFFAOYSA-N 99.886 -1.931 50 10 AAGE COC(=O)C1(O)CN(C(=O)NN)C1 714427905 WKXHMPDUFACRGW-UHFFFAOYSA-N 189.171 -2.211 50 10 AAGE CC[N+]1=C=C(B(O)O)NN1 885228825 YNUPXNGFONLSTP-UHFFFAOYSA-N 141.947 -2.393 50 10 AAGE C[C-]1ON=C=C1C(=O)NCB(O)O 885449214 UVSYCHDSRAAJEB-UHFFFAOYSA-N 182.952 -1.792 50 10 AAGE COC1(CN)CC(C(=O)NN)C1 1880788342 DFKCAWLYHYXTNU-UHFFFAOYSA-N 173.216 -1.270 50 10 AAGE NNC(=O)[C@H]1CC[C@H](C(=O)O)O1 1914770198 BZEHDUUUECVWJZ-QWWZWVQMSA-N 174.156 -1.392 50 10 AAGE NNC(=O)C[C@@H]1CNC[C@H]1O 1953343097 XXHDCJVKDMLHKW-RFZPGFLSSA-N 159.189 -2.053 50 10 AAGE OB(O)c1cncnc1N1CCCC1 1956960391 COPXKLHHLOSTEJ-UHFFFAOYSA-N 193.015 -1.243 50 10 AAGE OB(O)c1ccn(CC[C@H]2CCO2)n1 2242560284 MUHKOSFIJHBHJF-ZETCQYMHSA-N 196.015 -1.258 50 10 AAGE NC(=O)CCN(N)C(=O)O 3645769 CMHZWJUKNLEKOR-UHFFFAOYSA-N 147.134 -1.285 50 10 AAGE NNC(=O)CNC(=O)C(F)(F)F 32501070 CDPNXNFEKALHDU-UHFFFAOYSA-N 185.105 -1.345 50 10 AAGE CC(C)CC(=O)N/N=C(/N)C(N)=O 220098173 HELZLQIEXRQTHF-UHFFFAOYSA-N 186.215 -1.094 50 10 AAGE NC(=O)NNC(=O)c1cccc(=O)[nH]1 236185546 ISDVRFNJWWPELQ-UHFFFAOYSA-N 196.166 -1.312 50 10 AAGE C/C=N/NC(=O)C(=O)NC(N)=O 238080965 QNIJQETXYMEFON-FARCUNLSSA-N 172.144 -1.697 50 10 AAGE CCS(=O)(=O)NNC(N)=O 238267808 SNKRUKVJULSXTH-UHFFFAOYSA-N 167.190 -1.491 50 10 AAGE CNNC(=O)OCCO 238307475 CYCUEMZODOTGMR-UHFFFAOYSA-N 134.135 -1.161 50 10 AAGE COC(=O)[C@@]1(C#N)C[C@@H]1B(O)O 238390030 ZBGONEPCFQUWFG-UJURSFKZSA-N 168.945 -1.084 50 10 AAGE C[P@](=O)(O)CC[C@H](N)C(=O)NN 238490893 DEASMHDELVYNGJ-BYPYZUCNSA-N 195.159 -1.406 50 10 AAGE Nc1ccc(B(O)O)cc1N 238573768 UUMKCKUGEFKNTJ-UHFFFAOYSA-N 151.962 -1.469 50 10 AAGE COC[C@@H](ON)C(=O)NN 710522666 QLGDNMDUJBFELG-GSVOUGTGSA-N 149.150 -2.118 50 10 AAGE NNC(=O)CCN1[C@@H]2COC[C@H]1C2 1883761087 NWIHSQRJCUNBSX-KNVOCYPGSA-N 185.227 -1.161 50 10 AAGE C[C@@H](Cn1ncn(C)c1=O)C(=O)NN 1912228678 CAVWKXFJENKFSX-YFKPBYRVSA-N 199.214 -1.792 50 10 AAGE NNC(=O)CN1C[C@H](O)[C@@H](F)C1 1929909641 IHVILGUXZAZWBK-WHFBIAKZSA-N 177.179 -2.009 50 10 AAGE NNC(=O)C1(CN2CC[C@H](O)C2)CC1 1931265936 XXPDUTSEHQWWEP-ZETCQYMHSA-N 199.254 -1.177 50 10 AAGE CN(C)NC(=O)C[C@@H]1CNC[C@H]1O 1954193880 GDGSUGDUVDAYGO-RNFRBKRXSA-N 187.243 -1.450 50 10 AAGE N[C@H]1C[C@@H]1Nc1ccc(B(O)O)cn1 2210060420 KEOBVLMWCOTXIS-BQBZGAKWSA-N 193.015 -1.727 50 10 AAGE C#C[C@@H]1CCCN1C(=O)C#CB(O)O 2241468998 YJNLJMPRSWUDAR-MRVPVSSYSA-N 190.995 -1.374 50 10 AAGE O=C(NCCO)c1cc(B(O)O)n[nH]1 2241474322 ATKBERSBYCYTRF-UHFFFAOYSA-N 198.975 -3.188 50 10 AAGE CC(C)[C@@H](NC(N)=O)C(=O)NN 37387941 UFMDKEBXQDSTBS-SCSAIBSYSA-N 174.204 -1.331 50 10 AAGE Cn1ncc(C(=O)O)c1C(=O)NN 75848733 AHRQAQUICRYAHR-UHFFFAOYSA-N 184.155 -1.278 50 10 AAGE CN1CC[C@@H]([C@@H](N)CC(=O)NN)C1 259017134 IGQOGBXRRFVNGG-RQJHMYQMSA-N 186.259 -1.355 50 10 AAGE C[C@@H]1CCN(CC(=O)NN)C[C@H]1O 299903968 DWXOJVSKQZMROX-RNFRBKRXSA-N 187.243 -1.321 50 10 AAGE CCn1ncnc1B(O)O 307616538 QHRQXCAPICUFNP-UHFFFAOYSA-N 140.939 -2.022 50 10 AAGE CC(=O)N/C=C\B(O)O 307810939 OBNFLEUWNGCBNT-IHWYPQMZSA-N 128.924 -1.352 50 10 AAGE Cn1ncc(/C=C\B(O)O)n1 307859170 FESDBRXJXXQOMY-IHWYPQMZSA-N 152.950 -1.160 50 10 AAGE CCC(=O)NNC(=O)C(=O)OC 379313300 GNRGABPMONPLGW-UHFFFAOYSA-N 174.156 -1.283 50 10 AAGE CO[C@H]1C[C@H]1NC(=O)NN 1880065849 ZSOVYDSPAHLRAN-DMTCNVIQSA-N 145.162 -1.053 50 10 AAGE C[C@H](C(=O)NN)N1CC=CC[C@H]1CO 1884398574 FDCIJTZPCNMAPB-SFYZADRCSA-N 199.254 -1.012 50 10 AAGE COC(=O)c1cnsc1B(O)O 1887478021 FQCNVBOGCQJTOY-UHFFFAOYSA-N 186.985 -1.391 50 10 AAGE C[C@H](CC(=O)NN)N1CC(CO)C1 1929742905 JSNZSXHTCMJGDE-ZCFIWIBFSA-N 187.243 -1.321 50 10 AAGE NNC(=O)N1CC[C@@H]2C(=O)NC[C@@H]2C1 1935276946 UGWOBWBQRMFDII-RITPCOANSA-N 198.226 -1.362 50 10 AAGE C=CCNC(=O)C#CB(O)O 2241479421 XTCCPUZCZCNQEW-UHFFFAOYSA-N 152.946 -1.696 50 10 AAGE NCCNC(=O)[C@H]1C[C@@H]1B(O)O 2241480262 JIMJGIOSCNWCOJ-WHFBIAKZSA-N 171.993 -2.076 50 10 AAGE Cc1cnc(B(O)O)n1C 2297006342 QTLDLQVDNRTJGR-UHFFFAOYSA-N 139.951 -1.592 50 10 AAGE CN(C)C(=O)CNC(=O)C(=O)NN 37225698 YTUQZCIHGWITEL-UHFFFAOYSA-N 188.187 -2.819 50 10 AAGE OB(O)c1cnc([C@@H]2CCOC2)nc1 238653762 KFMVSEHZNLIRCF-ZCFIWIBFSA-N 193.999 -1.340 50 10 AAGE OCc1cnc2c(B(O)O)c[nH]c2c1 238699522 UAZGFOHVZGBKDS-UHFFFAOYSA-N 191.983 -1.265 50 10 AAGE OB(O)c1cccc2c1[C@H](O)O[C@H]2O 306675118 RWLPMOWUUIBSRG-HTQZYQBOSA-N 195.967 -1.622 50 10 AAGE O=C(CO)NNC(=O)C(F)(F)F 307117272 PFBKJFHIBDKQSA-UHFFFAOYSA-N 186.089 -1.312 50 10 AAGE CN(N)C(=O)c1nn[nH]n1 575466674 FANOIXIOOKCBGD-UHFFFAOYSA-N 142.122 -1.855 50 10 AAGE COC(=O)NN=C[C@@H](O)CO 1084051761 NQBVMLLROROKJK-SCSAIBSYSA-N 162.145 -1.319 50 10 AAGE O=C(NCB(O)O)[C@H]1C[C@@H]1F 1880183068 OZSINEFZANXMMD-IMJSIDKUSA-N 160.941 -1.527 50 10 AAGE O=C(CC1COC1)NNCCO 1880562544 FFIZNQYBVFEQHR-UHFFFAOYSA-N 174.200 -1.364 50 10 AAGE CC1(C)[C@@H](O)C[C@@]1(N)C(=O)NN 1881243622 HESJLGHJXFOYDK-MHTLYPKNSA-N 173.216 -1.535 50 10 AAGE NNC(=O)CN1CC[C@@H]2COC[C@@H]21 1883765354 SQVXJPBXRJEXDR-RQJHMYQMSA-N 185.227 -1.303 50 10 AAGE O=C(O)COCC(=O)NNCCO 1929833892 RWGLIXKCDWBCDD-UHFFFAOYSA-N 192.171 -2.299 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@@H](O)[C@H]2C1 1931412395 IQKLLYGZLMMHBI-HCWXCVPCSA-N 199.210 -2.185 50 10 AAGE COC[C@]1(O)CCN(C(=O)NN)C1 1931671224 GUZLTVOBHIKZKV-ZETCQYMHSA-N 189.215 -1.347 50 10 AAGE C[C@]12C[C@H]1CN(C(=O)C(=O)NN)C2 1932260614 AFUNODJZLZSFFZ-YLWLKBPMSA-N 183.211 -1.155 50 10 AAGE CCC(CO)(CO)C(=O)NN 2241233766 DTDKVQHHUXSQFT-UHFFFAOYSA-N 162.189 -1.643 50 10 AAGE CN1CC[C@H]1CNC(=O)C#CB(O)O 2241469005 YMQYURXJJCCQSL-ZETCQYMHSA-N 196.015 -2.178 50 10 AAGE N[C@H]1CC[C@@H]1NC(=O)C1(B(O)O)CC1 2241474098 WLEZQTJGBYSXSA-WDSKDSINSA-N 198.031 -1.401 50 10 AAGE COC(=O)N/N=C/[C@H](O)CO 59382606 NQBVMLLROROKJK-YUPOIEMOSA-N 162.145 -1.319 50 10 AAGE NNC(=O)N1CC[C@@H](O)C1 61713354 IAHLAKYVLFOAHA-SCSAIBSYSA-N 145.162 -1.364 50 10 AAGE N#Cc1nccn1CC(=O)NN 87344521 NEPWKWZISLUNTA-UHFFFAOYSA-N 165.156 -1.255 50 10 AAGE COCCOCCOCC(=O)NN 127914436 PIZKGWQSXXRZRP-UHFFFAOYSA-N 192.215 -1.344 50 10 AAGE O=C[C@@H](O)[C@H](O)[C@@H](Cl)CO 238703809 NIYUURYBBLTWQM-VPENINKCSA-N 168.576 -1.493 50 10 AAGE Cn1[nH]c(C(=O)NN)cc1=O 306409028 LBJSAWZLQGECLJ-UHFFFAOYSA-N 156.145 -1.683 50 10 AAGE CO[C@H](C)C(=O)NNC=O 306475293 QWIMFEPLPOBUMD-SCSAIBSYSA-N 146.146 -1.202 50 10 AAGE CN1CC[C@@H](N(C)CC(=O)NN)C1 307411897 KJJMBZHQFUALOP-SSDOTTSWSA-N 186.259 -1.388 50 10 AAGE CN1NC[C@@H]2N[C@H](Cl)NC(=O)[C@@H]21 605704576 UVPYFCYJSVXQOF-RPDRRWSUSA-N 190.634 -1.585 50 10 AAGE O=C(NCB(O)O)c1ccccn1 702023424 PFMAJMDUCHAQFW-UHFFFAOYSA-N 179.972 -1.177 50 10 AAGE NNC(=O)CN1CCN2CCC1CC2 722805784 CKNJSNBEWYHBGO-UHFFFAOYSA-N 198.270 -1.244 50 10 AAGE CC1=C=C(CNC(=O)C(=O)NN)NO1 885890120 YDPXJGNOMWMRME-UHFFFAOYSA-N 198.182 -1.986 50 10 AAGE NCC(=O)NCC(=O)NCCCl 1866019252 BQTXQACJRSBEHS-UHFFFAOYSA-N 193.634 -1.584 50 10 AAGE C[C@@H](O)CN1CC[C@H](B(O)O)C1 1891538769 OHLXMWPMJYHQML-RQJHMYQMSA-N 173.021 -1.084 50 10 AAGE O=CNc1ncccc1B(O)O 1913615092 FGDBTZYJBBSIRL-UHFFFAOYSA-N 165.945 -1.670 50 10 AAGE NNC(=O)Nc1ncncn1 1930203178 QQDWUGXZPVKKHZ-UHFFFAOYSA-N 154.133 -1.133 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2CCO[C@H]2C1 1956919903 SXXGTNGCYMFBHZ-RITPCOANSA-N 199.210 -1.776 50 10 AAGE O=C(N[C@@H]1CCNC1)[C@@H]1C[C@@H]1B(O)O 2241481591 UESJJDILQWLRKN-QYNIQEEDSA-N 198.031 -1.673 50 10 AAGE N#C[C@@H]1CN(CC(=O)NN)CCO1 86656719 PAYTXUVFQYKCGY-ZCFIWIBFSA-N 184.199 -1.799 50 10 AAGE Nc1ccnc(B(O)O)c1 199486485 NKITZSPVMYSQLD-UHFFFAOYSA-N 137.935 -1.656 50 10 AAGE N[C@@H](C/C=C/B(O)O)C(=O)O 200991109 OUJIGNMQBCCYRL-REJIZHKJSA-N 158.950 -1.643 50 10 AAGE NNC(=O)C[C@@H](N)[C@H](O)[C@H](O)CO 221452253 SONPCMUHTVOGBX-KODRXGBYSA-N 193.203 -3.592 50 10 AAGE COC[C@H](C)C=NNC(=O)C(N)=O 308258393 LBTPNOGZAHENOR-RXMQYKEDSA-N 187.199 -1.144 50 10 AAGE CNC(=O)NCB(O)O 575563744 TWMBQSRZORWULS-UHFFFAOYSA-N 131.928 -2.073 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H]2C[C@H]21 706969274 AKAUWTSPBBRMOE-RFZPGFLSSA-N 169.184 -1.403 50 10 AAGE CN1NN/C(=C2/N=C=C=C=C2C=O)N1 885535395 YVVBUEWGVDABRV-FPLPWBNLSA-N 189.178 -1.267 50 10 AAGE N#CC1=C(N2CC[C@H](O)C2)NC#CN1 885558015 HEBJMNUAGQCYMQ-ZETCQYMHSA-N 190.206 -1.143 50 10 AAGE NNC(=O)CCN1C[C@H]2[C@H](O)C[C@H]2C1 1878211729 IMBOGCKWQHBFOA-XLPZGREQSA-N 199.254 -1.321 50 10 AAGE C=CC1(O)CCN(CC(=O)NN)CC1 1891945133 DRCOCPUEALVBTO-UHFFFAOYSA-N 199.254 -1.011 50 10 AAGE NNC(=O)N1CCO[C@@H](CCO)C1 1954101062 SRXIKOYIIIUKHH-LURJTMIESA-N 189.215 -1.347 50 10 AAGE NNC(=O)CN1C[C@@H]2CC[C@H](C1)C2O 1956499695 BJTDDSBUAHLALX-AVSFMBPQSA-N 199.254 -1.321 50 10 AAGE O=C(C#CB(O)O)Nc1nc[nH]n1 2241468986 YFUWZEXPRVMJPI-UHFFFAOYSA-N 179.932 -2.241 50 10 AAGE C[C@H](CCN)NC(=O)C#CB(O)O 2241478244 AXPSBXBECJNZJL-ZCFIWIBFSA-N 184.004 -2.145 50 10 AAGE O=C(O)CNC(=O)C1(B(O)O)CC1 2241480836 MSCWBKWADZYNSC-UHFFFAOYSA-N 186.960 -1.806 50 10 AAGE CN(C)C(=O)c1cn(C)nc1B(O)O 2241495587 LAMVIMHWRMIENO-UHFFFAOYSA-N 197.003 -2.198 50 10 AAGE CC(=O)N[C@H](C)C(=O)NNC=O 307313974 HRXHZGAITPCJHU-SCSAIBSYSA-N 173.172 -1.712 50 10 AAGE C/C(=N\N)[C@H](C#N)C(=O)NN 307492218 GYVVTNCGABLFNY-IMMCFVPVSA-N 155.161 -1.549 50 10 AAGE OB(O)c1ccn(C[C@H]2CCOC2)n1 694277300 SEKLKORVKZHKFR-SSDOTTSWSA-N 196.015 -1.401 50 10 AAGE CN1NC#C/C1=C1/NC(C#N)=C(N)O1 885535300 MMHLRZKMNLTJCX-SOFGYWHQSA-N 189.178 -1.162 50 10 AAGE NNC(=O)C[N+]1(N)CCCCC1 1614795986 QFFPLRYDUHNCNB-UHFFFAOYSA-O 173.240 -1.149 50 10 AAGE CC1(C)OCCO[C@@H]1[C@H](N)B(O)O 1883672832 MWETZRGQKQJTGG-RITPCOANSA-N 189.020 -1.480 50 10 AAGE NNC(=O)CN1C[C@H]2COC[C@@H](C2)C1 1887834278 FIVLREAGXNBTSV-YUMQZZPRSA-N 199.254 -1.055 50 10 AAGE C[C@@H]1OC2(C(=O)NCB(O)O)CC1C2 1889730590 MUCPCYDFZPXADF-BHZOKHGKSA-N 199.015 -1.318 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2C[C@@]2(CO)C1 1899605584 KXBANBPEDVATIR-ZKWXMUAHSA-N 199.254 -1.321 50 10 AAGE NNC(=O)C(=O)N[C@H]1C2C[C@@H]3C1[C@@H]3C2 1916965104 NCWVGNMEUCWTDG-QEEGBHKWSA-N 195.222 -1.253 50 10 AAGE NNC(=O)C(=O)N1CC[C@]2(O)C[C@@H]2C1 2241321482 CUCOYHYJHBEURZ-XRGYYRRGSA-N 199.210 -2.040 50 10 AAGE CCOC(=O)c1nn(C)cc1B(O)O 2241491991 ACUJJAQDQYRRRK-UHFFFAOYSA-N 197.987 -1.723 50 10 AAGE C[C@H](C(=O)NN)N(CCO)CCO 82469009 LETVARUQSDXJAU-ZCFIWIBFSA-N 191.231 -2.349 50 10 AAGE NNC(=O)[C@@H]1CCC[C@]1(O)NN 104534615 VKNSZBFOQLMJBT-UJURSFKZSA-N 174.204 -2.072 50 10 AAGE OB(O)c1cccc(-n2cccn2)n1 198083255 VGYMOHTZZNKPSS-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE O=C(NO)c1cccc(B(O)O)c1 218453219 FQSSBMPEHOIIMT-UHFFFAOYSA-N 180.956 -1.515 50 10 AAGE CC(=O)N1C(=O)N[C@H]2C(=O)OC(=O)[C@H]21 238055190 OZKKVMOXYNOZIO-DMTCNVIQSA-N 198.134 -1.621 50 10 AAGE Cc1ncc(N)cc1B(O)O 238481710 JZHMDKJSFSBQBG-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE CNCCSCC(=O)NN 306791427 XOILCVCSMREQIA-UHFFFAOYSA-N 163.246 -1.071 50 10 AAGE NNC(=O)[C@@H]1CC(F)(F)CN1 306997659 XAKUYJDYUYUOCB-VKHMYHEASA-N 165.143 -1.027 50 10 AAGE C#CC(=O)NNC(=O)NCCOC 308394441 CLUZRHUSTGCPGA-UHFFFAOYSA-N 185.183 -1.404 50 10 AAGE CC1(C)[C@H](O)CN1C(=O)C(=O)NN 1883986964 KXOLEDWXRJPPLD-SCSAIBSYSA-N 187.199 -2.042 50 10 AAGE NC(=O)NNC(=O)[C@]12C[C@H](CO1)C2 1884152366 WLDCIVFLYLOWMJ-KIRWANIJSA-N 185.183 -1.135 50 10 AAGE C[C@@H]1OCC[C@@H]1NCB(O)O 1923735344 ZRPLSMXCZISHMM-WDSKDSINSA-N 158.994 -1.235 50 10 AAGE CO[C@@H](C)[C@H](C)NC(=O)C(=O)NN 1954534766 ASHLDMYGXBOHDB-WHFBIAKZSA-N 189.215 -1.484 50 10 AAGE NOCCNC(=O)C#CB(O)O 2241468540 QCFLSSQQJRYDQY-UHFFFAOYSA-N 171.949 -2.992 50 10 AAGE CNC(=O)c1c(C)nn(C)c1B(O)O 2241479713 FDNKPIGZHJIRFE-UHFFFAOYSA-N 197.003 -2.232 50 10 AAGE O=C(F)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO 38584783 IJPVCOQVFLNLAP-SQOUGZDYSA-N 198.146 -3.082 50 10 AAGE NNC(=O)[C@H]1C[C@H](O)CN1 69635670 DQPBFVWXINZXKL-IUYQGCFVSA-N 145.162 -2.301 50 10 AAGE C[C@H](O)CCN(C)CC(=O)NN 135780546 NQHKMSMLRPKHHK-LURJTMIESA-N 175.232 -1.321 50 10 AAGE NNC(=O)OC(=O)[C@@H](N)/C=C/CO 145132404 BQWFMTZDXYMBBW-QPHDTYRISA-N 189.171 -2.011 50 10 AAGE NC(=O)CONC(=O)CCl 157231278 UNUVSKKZIIAWMF-UHFFFAOYSA-N 166.564 -1.242 50 10 AAGE CN(CB(O)O)C(=O)[C@@H](N)CO 200994060 XTTGWZVIXNIAGD-BYPYZUCNSA-N 175.981 -3.224 50 10 AAGE Cn1ncnc1B(O)O 306927593 UWPAMJPVWNIQLC-UHFFFAOYSA-N 126.912 -2.505 50 10 AAGE CC(=O)NNC(=O)c1cnn(C)n1 307140645 AZRLUYFQIHWLBK-UHFFFAOYSA-N 183.171 -1.404 50 10 AAGE NNC(=O)[C@H]1CNCC1(F)F 575593973 VIZMARFDMXFGQV-GSVOUGTGSA-N 165.143 -1.169 50 10 AAGE CC1CN(C(=O)C(=O)NN)C1 606246759 GDGLMLZROXUIIM-UHFFFAOYSA-N 157.173 -1.545 50 10 AAGE C[C@@H]1CC[C@@H](C(=O)NCB(O)O)O1 702017090 HDWVVKUUZMYERK-RITPCOANSA-N 187.004 -1.318 50 10 AAGE CC(=O)NCC#CB(O)O 1880100905 WUQGPXWDKKSTJI-UHFFFAOYSA-N 140.935 -1.862 50 10 AAGE CCS(=O)(=O)CC(=O)NNC 1880348258 XKUHXHWBIJTTKQ-UHFFFAOYSA-N 180.229 -1.328 50 10 AAGE C[C@H]1[C@@H](O)CCN1CC(=O)NN 1914257797 VTDBQZUZJPTMBA-WDSKDSINSA-N 173.216 -1.569 50 10 AAGE C[C@@H]1C[C@H]1N(C)C(=O)C(=O)NN 1953722974 PEVOGUZMAFEWRA-RFZPGFLSSA-N 171.200 -1.157 50 10 AAGE NNC(=O)CN1CCCC[C@H](O)C1 1953982351 SUACMTMKGHMCRV-ZETCQYMHSA-N 187.243 -1.177 50 10 AAGE NC[C@]1(CO)NC(=O)OC1=O 2208966691 FIYAKAXKLPIEDT-RXMQYKEDSA-N 160.129 -2.057 50 10 AAGE CN(CCC(N)=O)C(=O)C#CB(O)O 2241468280 KROVMVUFMPVQAC-UHFFFAOYSA-N 197.987 -2.664 50 10 AAGE CN(C(=O)C#CB(O)O)C(C)(C)CO 2241471230 HGDHASOKSPVSBM-UHFFFAOYSA-N 199.015 -1.769 50 10 AAGE NC(=O)c1sncc1B(O)O 2241478862 MLAHRSXOJNCTEK-UHFFFAOYSA-N 171.974 -2.078 50 10 AAGE CCCNC(=O)COCC(=O)NN 58851964 NMPWITYUCZJFCH-UHFFFAOYSA-N 189.215 -1.481 50 10 AAGE C[C@@H](NC(=O)NN)C(=O)NC1CC1 162623218 AMCRWZPZEAINEB-SCSAIBSYSA-N 186.215 -1.174 50 10 AAGE NNC(=O)n1cnc(C(N)=O)c1N 196585938 NJQWADCDQFBNCQ-UHFFFAOYSA-N 184.159 -2.004 50 10 AAGE OCc1cscc1B(O)O 196661621 WPXFJEKEGXKDAS-UHFFFAOYSA-N 157.987 -1.080 50 10 AAGE NNC(=O)C(=O)NCCc1ncon1 231840928 SUYFDXHVHZFIDN-UHFFFAOYSA-N 199.170 -2.282 50 10 AAGE CCOC(=O)CNNC(=O)CN 238289034 DWBSXVKYXBJNGL-UHFFFAOYSA-N 175.188 -1.871 50 10 AAGE COc1nccc(B(O)O)c1C#N 238422279 ZOCQTEKDICJCES-UHFFFAOYSA-N 177.956 -1.358 50 10 AAGE NNC(=O)O[C@H](O)CO 238662896 AALKQNNBGRWCOP-REOHCLBHSA-N 136.107 -2.103 50 10 AAGE NNc1cccc(F)c1B(O)O 306858922 BHEQWFDXCHNGIC-UHFFFAOYSA-N 169.952 -1.209 50 10 AAGE N#CC1=C[C@H](O)[C@H](O)[C@H](O)[C@H]1O 307625374 SQZYGIJVCRCCSR-ZTYPAOSTSA-N 171.152 -2.106 50 10 AAGE CN(CCC(N)=O)C(=O)C(=O)NN 382068243 SNJJWXCLXSWFEQ-UHFFFAOYSA-N 188.187 -2.690 50 10 AAGE CC(=O)NNC(=O)CNC[C@H](C)O 388689998 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C[C@H](CNC(N)=O)B(O)O 238420313 IAYGQXJHFZRMHC-GSVOUGTGSA-N 145.955 -1.482 50 10 AAGE Cc1nn2ncccc2c1B(O)O 238540001 JVHCLZBUZYIUSE-UHFFFAOYSA-N 176.972 -1.282 50 10 AAGE C#CC(=O)NNC(=O)[C@@H]1CCOC1 306449020 XTAQCONXNRVQPK-ZCFIWIBFSA-N 182.179 -1.197 50 10 AAGE C[C@H]1[C@@H](O)CCCN1CC(=O)NN 307053814 WBIXLANJLLXJHI-BQBZGAKWSA-N 187.243 -1.179 50 10 AAGE C/C(=N\NC(=O)NC(=N)N)C(=O)O 307260637 NJHYFFPGQOEEPB-XNWCZRBMSA-N 187.159 -1.360 50 10 AAGE C[C@@H]1CN(C(=O)C(=O)NN)[C@@H]1C 606252568 QMJVKSFUMMDREN-RFZPGFLSSA-N 171.200 -1.157 50 10 AAGE CN(N)C(=O)CN1C#CNN1 885250487 ZKCQXQADXYWPIG-UHFFFAOYSA-N 155.161 -2.438 50 10 AAGE NNC(=O)C(=O)NC[C@@H]1C[C@@H]1F 1881096899 DBJGARQBVUVCNJ-IMJSIDKUSA-N 175.163 -1.550 50 10 AAGE CN1CC[C@H](OCC(=O)NN)C1 1881440263 NLBKBEKKRPSFIP-LURJTMIESA-N 173.216 -1.303 50 10 AAGE C[C@H](Cn1ccc(B(O)O)n1)N(C)C 1884945377 LFVYPOBVGPVGLU-SSDOTTSWSA-N 197.047 -1.487 50 10 AAGE O=C(CCn1ccnc1)NNCCO 1929833245 GPGIRTBOVWOCEO-UHFFFAOYSA-N 198.226 -1.114 50 10 AAGE CCCONC(=O)C#CB(O)O 2241467979 FIZLFPCUOQVVCS-UHFFFAOYSA-N 170.961 -1.540 50 10 AAGE NNC(=O)C(N)(CF)CF 2242422314 IUSCULLCDHFPDG-UHFFFAOYSA-N 153.132 -1.387 50 10 AAGE C[C@H]1[C@H](O)CN1C[C@@H]1C[C@H]1C(=O)NN 2297131912 FQXWYVMJXOIPBH-RULNZFCNSA-N 199.254 -1.323 50 10 AAGE CC(=O)NNC=O 39340149 URADZTVVWMDUTB-UHFFFAOYSA-N 102.093 -1.217 50 10 AAGE C[C@]1(C(=O)NN)C[C@@]1(C)C(=O)NN 59593686 YBFFOYGLVDIPID-KNVOCYPGSA-N 186.215 -1.618 50 10 AAGE NNC(=O)C(=O)NCCOC(N)=O 135271070 BQLBHJKQZMBGID-UHFFFAOYSA-N 190.159 -2.812 50 10 AAGE CO[Si](CNCCN)(OC)OC 196242420 CSNJSTXFSLBBPX-UHFFFAOYSA-N 194.307 -1.048 50 10 AAGE CC[C@@H](C(=O)NN)N1CC(O)C1 306667991 FJHFUGWSJIOXNP-LURJTMIESA-N 173.216 -1.569 50 10 AAGE Cc1c(C=NNC(N)=O)no[n+]1[O-] 687727368 JNEFZHPDXCARKV-UHFFFAOYSA-N 185.143 -1.381 50 10 AAGE NNC(=O)C1(N)CC(O)C1 1880071723 DJSNULHODJMEIT-UHFFFAOYSA-N 145.162 -2.172 50 10 AAGE O=C(NCB(O)O)[C@H]1C[C@H]1F 1880183069 OZSINEFZANXMMD-IUYQGCFVSA-N 160.941 -1.527 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@@H]1F 1880344371 QKGCDSVEWPJHPV-STHAYSLISA-N 161.136 -1.797 50 10 AAGE CN(C[C@]1(O)CCOC1)C(=O)NN 1882690120 JQSPTGIJSKUKDJ-SSDOTTSWSA-N 189.215 -1.347 50 10 AAGE CCOc1ncnc(B(O)O)c1C 1883803108 CJGDMHUIOSOJON-UHFFFAOYSA-N 181.988 -1.136 50 10 AAGE CN(C)[S@](C)(=O)=NCC(=O)NN 1953388862 NSAFMIKPAAIZAD-GFCCVEGCSA-N 194.260 -1.449 50 10 AAGE O=C(NCC#CB(O)O)c1ccno1 2209955491 BHWIAEHUBKDDPQ-UHFFFAOYSA-N 193.955 -1.580 50 10 AAGE C[C@@H]1CCC(=O)N1CC(=O)NN 39409046 AUJSDFHQOMZHBD-RXMQYKEDSA-N 171.200 -1.013 50 10 AAGE NNC(=O)CN1CCOCC1=O 86433415 MEIHLCKRJGUMLJ-UHFFFAOYSA-N 173.172 -2.165 50 10 AAGE COc1cccc([B-](O)(O)O)n1 199593349 WXEGQOPNHYPEKC-UHFFFAOYSA-N 169.953 -1.787 50 10 AAGE COc1cnc(OC)c(B(O)O)c1 238342551 PQUBWMPMRXWPOC-UHFFFAOYSA-N 182.972 -1.221 50 10 AAGE C[C@@H](CO)NC(=O)NNC(N)=S 306530241 JGGMKNZBJKCOQR-VKHMYHEASA-N 192.244 -1.585 50 10 AAGE C[C@@H]1NC(=O)[C@@H](Cl)[C@H](O)N1 306786040 KHVWBDHZOIDPHQ-HZLVTQRSSA-N 164.592 -1.022 50 10 AAGE CC[C@@H](O)C(=O)NNC(=O)CCO 379389422 LMPHOJDFOGAXNF-RXMQYKEDSA-N 190.199 -1.713 50 10 AAGE COC[C@H](C)NC(=O)NNC(N)=O 379410975 HDXCLGCEWSGGQK-BYPYZUCNSA-N 190.203 -1.096 50 10 AAGE NNC(=O)[C@@]12CNC[C@H]1CCO2 575546419 SLGYXYOMGXDYCZ-IYSWYEEDSA-N 171.200 -1.645 50 10 AAGE NC(=O)NNC(=O)CCn1cncn1 700871399 OFPUUHLTZACBJD-UHFFFAOYSA-N 198.186 -1.632 50 10 AAGE N=NNCC1=C=C=C=C(C(=O)NN)N1 885590581 FSKZMNCDCVBNRP-UHFFFAOYSA-N 192.182 -1.208 50 10 AAGE CN1[C@H](C(=O)O)CC[C@@H]1C(=O)NN 1914782778 ZJJORULLAZODPG-UHNVWZDZSA-N 187.199 -1.476 50 10 AAGE Cc1nnc2n1C[C@H](C(=O)NN)C2 1953874813 RYCZCCGTLLEJTE-RXMQYKEDSA-N 181.199 -1.251 50 10 AAGE C[C@H](O)CNc1ncccc1B(O)O 2210061282 SNYBKSPOOOESLJ-LURJTMIESA-N 196.015 -1.446 50 10 AAGE Cc1cc(B(O)O)c(C)cc1B(O)O 196974221 CGCUBHLGWWXABY-UHFFFAOYSA-N 193.804 -2.337 50 10 AAGE Cc1ncc(CC(=O)NN)c(N)n1 238468754 RKPOSEFDKDNOFD-UHFFFAOYSA-N 181.199 -1.100 50 10 AAGE OB(O)[C@H]1COC[C@H]1O 238610492 RJGLKEQNQBWNHW-IUYQGCFVSA-N 131.924 -1.780 50 10 AAGE N#Cc1ncc(B(O)O)cc1[N+](=O)[O-] 238631893 IORZDHPQPUVJDL-UHFFFAOYSA-N 192.927 -1.459 50 10 AAGE C[C@@H]1CCN(CC(=O)NN)[C@H]1CO 299911600 OAKIORFSJXAQBB-RQJHMYQMSA-N 187.243 -1.321 50 10 AAGE Cn1cc(C(=O)C(=O)NN)cn1 306369166 ICSWRJVAWLXAGK-UHFFFAOYSA-N 168.156 -1.407 50 10 AAGE CC(=O)NNC(=O)[C@@H](C)NC(N)=O 306460552 FCBGVWIJWBZBHT-GSVOUGTGSA-N 188.187 -1.790 50 10 AAGE CO[C@@H]1C[C@@H](CO)N(C(=O)NN)C1 306484543 GDHCFYPDKIZNMC-NTSWFWBYSA-N 189.215 -1.349 50 10 AAGE CC1(C)CN(CC(=O)NN)C[C@@H]1O 306890554 ZDVOSXQIBSUEEL-LURJTMIESA-N 187.243 -1.321 50 10 AAGE C[C@@H](C(=O)NN)N(C)CCC(N)=O 382085258 TYEGYTWFSNVJSK-YFKPBYRVSA-N 188.231 -1.828 50 10 AAGE C#CCCC(=O)NNC(=O)CO 388439630 RNVOADCPNLPHNG-UHFFFAOYSA-N 170.168 -1.461 50 10 AAGE CNNC(=O)[C@H]1CCC(=O)NC1 575557539 GGZNBJBKDHQBED-YFKPBYRVSA-N 171.200 -1.237 50 10 AAGE CO[C@@H](C)C(=O)NNC(N)=S 700858599 PRCXWNCDNQHRRN-VKHMYHEASA-N 177.229 -1.114 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2COC[C@@H]2C1 718238113 DCIIVSHPOIDYQU-WDSKDSINSA-N 199.210 -1.919 50 10 AAGE CC[C@H](O)C(=O)NCC=CB(O)O 1888707541 JDDJRCLVSJHVJS-LURJTMIESA-N 187.004 -1.558 50 10 AAGE C[C@]1(B(O)O)CCN(CCO)C1 1891493684 WZXBCZVNYFGBPM-ZETCQYMHSA-N 173.021 -1.083 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@]2(CO)C1 1899623118 UNOYXMNUMRBIJR-SVGQVSJJSA-N 199.210 -2.183 50 10 AAGE CCn1cc(NC(=O)C(=O)NN)cn1 1932775615 QDDFFKLTKRHPKI-UHFFFAOYSA-N 197.198 -1.169 50 10 AAGE NNC(=O)NC[C@H]1CCC(=O)NC1 1954454653 KBIICGSCNTYVTF-YFKPBYRVSA-N 186.215 -1.315 50 10 AAGE O=C(NCCCO)C1(B(O)O)CC1 2241474265 ZQYDMXMYLBYXHJ-UHFFFAOYSA-N 187.004 -1.508 50 10 AAGE C[C@H]1CCN(C(=O)C#CB(O)O)C1 2241476333 QCMZVNQZNHZOQA-ZETCQYMHSA-N 181.000 -1.130 50 10 AAGE CCNNC(=O)[C@@H](N)CO 104654726 PKEDGGNMLOOCOV-BYPYZUCNSA-N 147.178 -2.053 50 10 AAGE NC(=O)CNc1cccc(B(O)O)c1 197070573 WFPFVAXHUIVWCH-UHFFFAOYSA-N 193.999 -1.736 50 10 AAGE COC(=O)c1cnc(C)c(B(O)O)c1 238329196 PJXBTZSXPMLBMJ-UHFFFAOYSA-N 194.983 -1.144 50 10 AAGE CO/C(C=O)=C\[C@H](O)[C@H](O)CO 307903923 LOUBRDMWHMERSC-KFYIEGHSSA-N 176.168 -1.570 50 10 AAGE CN(C)C(=O)Cn1cc(B(O)O)cn1 1885670538 YWGFXOVWBLHDGM-UHFFFAOYSA-N 197.003 -2.349 50 10 AAGE COC[C@]1(C(=O)NN)C=CCN1 1887049718 JJDULBOMCFNORV-ZETCQYMHSA-N 171.200 -1.479 50 10 AAGE COC1CC(NCB(O)O)C1 1923867027 PGESYBBUIGSKDH-UHFFFAOYSA-N 158.994 -1.235 50 10 AAGE CCON(C)[C@H](COC)C(=O)NN 1928678248 PNKKOJXQXRCYTE-ZCFIWIBFSA-N 191.231 -1.125 50 10 AAGE CC(C)Oc1ncncc1B(O)O 1954086871 XVDLKJDPXBFWFC-UHFFFAOYSA-N 181.988 -1.056 50 10 AAGE NNC(=O)C(=O)N1CC=C[C@H](O)C1 1954840386 RNHBYUFDVRVUEK-YFKPBYRVSA-N 185.183 -2.264 50 10 AAGE NNC(=O)N[C@H]1CCCNC1=O 50392648 OZNGJPNHHARPKE-BYPYZUCNSA-N 172.188 -1.562 50 10 AAGE O=C([C@@H]1CCN1)N1CCC[C@H]1B(O)O 169987548 STCIIFSJXHCDHP-BQBZGAKWSA-N 198.031 -1.649 50 10 AAGE NC(=S)NNC(=O)c1cncnc1 229821486 NSGRXUZBLVGPKQ-UHFFFAOYSA-N 197.223 -1.045 50 10 AAGE CCOC(OCC)[C@H](N)C(=O)NN 238313005 BKCDYWCDYJPQQL-RXMQYKEDSA-N 191.231 -1.297 50 10 AAGE CO/C(C=O)=C/[C@@H](O)[C@H](O)CO 238332058 LOUBRDMWHMERSC-RDOFSXSHSA-N 176.168 -1.570 50 10 AAGE NC[C@@H](N)c1ccc(B(O)O)cc1F 238609872 CUMREUGOLWPLBY-MRVPVSSYSA-N 198.006 -1.536 50 10 AAGE NNC(=O)[C@@]1(O)C[C@H](O)C=C1CO 307675208 FKSQYMLFDQCKRP-IYSWYEEDSA-N 188.183 -2.609 50 10 AAGE NNC(=O)[C@]12CNC[C@@H]1C2 575516991 HBPQTVARXZRSFG-UJURSFKZSA-N 141.174 -1.414 50 10 AAGE N=C(NO)c1cccc(B(O)O)c1 686098882 LHMPCLLRWRBYEC-UHFFFAOYSA-N 179.972 -1.329 50 10 AAGE CC(=O)NCC(=O)N(C)N 704635234 LIKAHZIGMYBQKB-UHFFFAOYSA-N 145.162 -1.545 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2CC[C@H]2C1 711124531 DYPCXYNADMKUPO-WDSKDSINSA-N 183.211 -1.155 50 10 AAGE NNC(=O)N(CCO)C1COC1 1915539068 QAFQXJPDGKNOPW-UHFFFAOYSA-N 175.188 -1.737 50 10 AAGE Cc1nc(CNC(=O)C(=O)NN)co1 1928783312 HXPPIJGIBWFDQZ-UHFFFAOYSA-N 198.182 -1.411 50 10 AAGE CSC1CN(C(=O)C(=O)NN)C1 1933239263 IMQZFNAMMOYRFT-UHFFFAOYSA-N 189.240 -1.450 50 10 AAGE C[C@@H]1COCC(=O)N1CC(=O)NN 1954177956 NKLPJAKRABTNMR-RXMQYKEDSA-N 187.199 -1.776 50 10 AAGE C#C[C@H](C)N(C)C(=O)C#CB(O)O 2241467830 BQBGMNSZCUWRRE-ZETCQYMHSA-N 178.984 -1.518 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1[C@@H]2CNC[C@@H]21 2241479103 RJCYAIFTGXVESM-UQWHLADISA-N 193.999 -2.664 50 10 AAGE CCN(CCO)CC(=O)NN 58844477 XFGJPWCMHGNHQX-UHFFFAOYSA-N 161.205 -1.710 50 10 AAGE OB(O)c1cnn([C@@H]2CCCOC2)c1 222670619 MMLBCXFAUVOUFP-MRVPVSSYSA-N 196.015 -1.086 50 10 AAGE CC(C)[C@H](NC(=O)NN)C(N)=O 231059520 ZVZZQVYYEUWCGN-BYPYZUCNSA-N 174.204 -1.331 50 10 AAGE N#CC1=C[C@@H]2O[C@@H]2[C@@H](O)[C@@H]1O 306360304 AASWHARLAPKYTB-VZFHVOOUSA-N 153.137 -1.061 50 10 AAGE N#CCc1ccc(B(O)O)c(NN)c1 306777979 OCKKXIFZHGESEY-UHFFFAOYSA-N 190.999 -1.282 50 10 AAGE NCc1nc2cccc(B(O)O)c2o1 306915681 WHFMCKPYFRXDTG-UHFFFAOYSA-N 191.983 -1.034 50 10 AAGE NNC(=O)CN1CC(n2ccnc2)C1 707386357 SKJFJRABVQFVNI-UHFFFAOYSA-N 195.226 -1.270 50 10 AAGE NNC(=O)[C@H]1C[C@H](N)CCO1 1880408224 SWWWZXGYPKIMHZ-RFZPGFLSSA-N 159.189 -1.517 50 10 AAGE Cn1cc(C(=O)NN)c(CN)n1 1880814068 ZHGNRXPVTHUAEC-UHFFFAOYSA-N 169.188 -1.518 50 10 AAGE CN1CC[C@@H](NC(=O)NN)CC1=O 1882878137 ZWXPVXSBPRNDEA-RXMQYKEDSA-N 186.215 -1.220 50 10 AAGE NNC(=O)N[C@H]1[C@H]2COC[C@H]21 1953340709 IURCRELREXWELK-ZXFHETKHSA-N 157.173 -1.196 50 10 AAGE CO[C@@H]1CC(=O)N(CC(=O)NN)C1 1953952766 FQXXTSGRCKZXSQ-RXMQYKEDSA-N 187.199 -1.776 50 10 AAGE OB(O)c1cnccc1N1CCCO1 1956962549 MDCBAEZKPYMCTP-UHFFFAOYSA-N 193.999 -1.097 50 10 AAGE COCc1nscc1B(O)O 2208961220 SIORLQHHZRQYOC-UHFFFAOYSA-N 173.002 -1.031 50 10 AAGE O=C(N[C@H]1CCOC1)[C@H]1C[C@@H]1B(O)O 2241474373 BUOHAZYFTPZLOQ-ACZMJKKPSA-N 199.015 -1.246 50 10 AAGE CN(C(=O)C1(B(O)O)CC1)C1CNC1 2241481712 UYKJCVZQVPNTSD-UHFFFAOYSA-N 198.031 -1.576 50 10 AAGE C[C@H](O)C(=O)NNC(=O)[C@@H](C)O 15774433 QPTYEEKWFKVUKH-ZXZARUISSA-N 176.172 -2.105 50 10 AAGE NNC(=O)Cn1cccnc1=O 37400283 LOFFBWLXPNDCNE-UHFFFAOYSA-N 168.156 -1.767 50 10 AAGE O=C(O)c1coc(B(O)O)c1 199775857 INFXFJBCUDZTEY-UHFFFAOYSA-N 155.902 -1.342 50 10 AAGE Nc1cc(B(O)O)ccc1[N+](=O)[O-] 203714662 OKPRZEYQMPBMFU-UHFFFAOYSA-N 181.944 -1.143 50 10 AAGE COC(=O)c1ncccc1B(O)O 204199805 HOHHVJXGJVLBRW-UHFFFAOYSA-N 180.956 -1.452 50 10 AAGE Cc1cncc(B(O)O)c1C=O 238538995 ZENILSBBFAHFQW-UHFFFAOYSA-N 164.957 -1.118 50 10 AAGE NC(=O)CC(=O)NNC(=O)C1CC1 308199249 WGYFHMRRFAOZRM-UHFFFAOYSA-N 185.183 -1.581 50 10 AAGE NNC(=O)CN1CC[C@H](O)[C@H](F)C1 885573295 WCLIRERMYVHNTP-RITPCOANSA-N 191.206 -1.619 50 10 AAGE C=CC(=O)NCCC(=O)NNC(C)=O 1136045513 BJIBVVLISJFRDR-UHFFFAOYSA-N 199.210 -1.154 50 10 AAGE NNC(=O)[C@@H](N)Cn1ccnc1 1772716890 DZGCVTSAMAADFC-YFKPBYRVSA-N 169.188 -1.800 50 10 AAGE Cn1cnc(=NC(=O)C(=O)NN)[nH]1 1929088151 KJUYTDLKXLMALP-UHFFFAOYSA-N 184.159 -2.835 50 10 AAGE COC[C@H](NC(=O)CCl)C(N)=O 1932164793 JSULBMQTCIDSMI-BYPYZUCNSA-N 194.618 -1.158 50 10 AAGE CN(C)NC(=O)CCNO 1953197513 GKNKJVCVUXMZED-UHFFFAOYSA-N 147.178 -1.052 50 10 AAGE CO[C@H](C)[C@@H](C)NC(=O)C(=O)NN 1954534764 ASHLDMYGXBOHDB-RFZPGFLSSA-N 189.215 -1.484 50 10 AAGE C[C@H](CN)NC(=O)C#CB(O)O 2241468322 LREJMZFVYMHYMK-RXMQYKEDSA-N 169.977 -2.535 50 10 AAGE N#CNC(=O)C1(B(O)O)CCC1 2241473951 TUODYRMPPXLAIY-UHFFFAOYSA-N 167.961 -1.019 50 10 AAGE C[C@H](O)CNC(=O)[C@H]1C[C@H]1B(O)O 2241481256 SDFDFNTZDYZDSX-HCWXCVPCSA-N 187.004 -1.654 50 10 AAGE N#CC1=C(N)[C@@H](C#N)C(N)=NN1 45823779 YRMVPRWWMJYFJW-GSVOUGTGSA-N 162.156 -1.305 50 10 AAGE CCCNCC(=O)NN 58862183 MWGMDLFZLWEOEE-UHFFFAOYSA-N 131.179 -1.024 50 10 AAGE O=C(OO)[C@H](O)[C@@H](O)C(=O)OO 112996872 AXDFLXFXPBPWKU-JCYAYHJZSA-N 182.084 -2.259 50 10 AAGE N#C[C@H]1C(=O)NN=C1C(=O)NN 198698466 KSDWUMBGKIUPJK-UWTATZPHSA-N 167.128 -2.398 50 10 AAGE CNP1(=O)N(C)[C@H](O)[C@@H](O)N1C 306602766 WJJKYFISDLEYGE-RFZPGFLSSA-N 195.159 -1.172 50 10 AAGE Cc1nnc(CB(O)O)n1C 575598191 UMBQHGYYJKLQQJ-UHFFFAOYSA-N 154.966 -1.322 50 10 AAGE CCC[S@@](=O)NCC#CB(O)O 1881440069 LLWOBOBAYQXUGH-GFCCVEGCSA-N 189.045 -1.335 50 10 AAGE N[C@@]1(B(O)O)CO[C@@]2(CCOC2)C1 1882151832 JOZBGAKLSCAVCD-NKWVEPMBSA-N 187.004 -1.725 50 10 AAGE C[C@H](O)[C@@H]1CCN1[C@H](C)C(=O)NN 1882400163 FALXABBCFSSKHG-VQVTYTSYSA-N 187.243 -1.180 50 10 AAGE NNC(=O)CN1CC(O)(C(F)F)C1 1954059888 NHZYTDUZUOEJIR-UHFFFAOYSA-N 195.169 -1.712 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2C[C@H]1C[C@H]2O 1956910770 GAIWHVJHBDFUCH-OOJXKGFFSA-N 199.254 -1.180 50 10 AAGE O=C(c1occc1B(O)O)N1CCC1 2241468936 XIAUUJNVORUHJL-UHFFFAOYSA-N 194.983 -1.195 50 10 AAGE O=C(NC1CNC1)[C@H]1C[C@@H](B(O)O)C1 2241481531 WBULQNBQSKLMMV-OLQVQODUSA-N 198.031 -1.673 50 10 AAGE NNC(=O)CCN1CCC[C@H](O)C1 82470411 WCFKJBIJOBTAJO-ZETCQYMHSA-N 187.243 -1.177 50 10 AAGE NC(=O)c1ncc(B(O)O)s1 222957681 NPIFDVYZTAMSCF-UHFFFAOYSA-N 171.974 -2.078 50 10 AAGE C[C@H]1COC(=O)/C1=N\NC(=O)CO 307232658 CSOXBEOEKQBFOD-WXTCEUJSSA-N 186.167 -1.356 50 10 AAGE CC(C)C(=O)NCB(O)O 575563150 GFEWAAPRROPIJU-UHFFFAOYSA-N 144.967 -1.229 50 10 AAGE Cc1nnc(NNC(=O)CO)nc1O 1306237259 FDGQJROQQNFOQC-UHFFFAOYSA-N 199.170 -1.679 50 10 AAGE CN(C)NC(=O)[C@H]1COCC[C@H]1N 1881914604 KHAOJIMWPWXZPO-NKWVEPMBSA-N 187.243 -1.057 50 10 AAGE NNC(=O)C(=O)NCCc1ncco1 1888213437 GOQZDCKCKNSWDR-UHFFFAOYSA-N 198.182 -1.677 50 10 AAGE CCN1CCN(C(=O)NN)CC1=O 1954392333 CMRHNJMITCWVCN-UHFFFAOYSA-N 186.215 -1.266 50 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O=C(NOCCO)[C@H]1C[C@H]1B(O)O 2241495052 GIOPOTBBQMPZTB-CRCLSJGQSA-N 188.976 -2.111 50 10 AAGE NNC(=O)CN1CC[C@@H](F)C1=O 2297006792 AVSVVOUZBLWDAD-SCSAIBSYSA-N 175.163 -1.453 50 10 AAGE CN1CC[C@H](C(=O)NN)C1 37758659 WDWQQBSTYTYPBA-YFKPBYRVSA-N 143.190 -1.072 50 10 AAGE C[C@H](CN(CC#N)CC#N)C(=O)NN 58838587 FTRYWXZHKIMDJS-SSDOTTSWSA-N 195.226 -1.038 50 10 AAGE Nc1ccc(B(O)O)c([N+](=O)[O-])c1 204057516 GWANFFQKCNZFII-UHFFFAOYSA-N 181.944 -1.143 50 10 AAGE [C-]#[N+][C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O 222141014 UJALVCFSKOLTHI-VOQCIKJUSA-N 189.167 -2.294 50 10 AAGE C[C@H]1CC[C@@H]1NC(=O)C(=O)NN 306172140 FRARCMHAVVFFSJ-WHFBIAKZSA-N 171.200 -1.109 50 10 AAGE NNC(=O)N[C@@H]1CCNC1=O 575525976 NCDQKLDTVPVJED-GSVOUGTGSA-N 158.161 -1.952 50 10 AAGE OB(O)c1ccn(CC(F)F)n1 694274844 FDGAGAWWVNNAHA-UHFFFAOYSA-N 175.931 -1.172 50 10 AAGE CO[C@H]1CCOC[C@@H]1NC(=O)NN 725008376 ACJKBQISYQIFBG-WDSKDSINSA-N 189.215 -1.037 50 10 AAGE O=C(CO)NNC(=O)[C-]1C#CON1 885467880 CGEZLQNHWJMXJH-UHFFFAOYSA-N 184.131 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C[C@H](O)[C@@H](N)C(=O)NN 104635827 BTWRWICPPHEZFU-STHAYSLISA-N 133.151 -2.316 50 10 AAGE CO[C@H](C)CNC(=O)C(=O)NN 224487707 FTHHZJOUCIALAD-SCSAIBSYSA-N 175.188 -1.873 50 10 AAGE COC(=O)c1cc(B(O)O)co1 238338206 HYNLAJTZZSIICT-UHFFFAOYSA-N 169.929 -1.254 50 10 AAGE O=C(O)Cc1ncc(B(O)O)cc1F 238633483 CMGGYUYDASFRAP-UHFFFAOYSA-N 198.946 -1.472 50 10 AAGE CC(C)(F)C(=O)NCB(O)O 575466202 QXCNFWNWPACEHY-UHFFFAOYSA-N 162.957 -1.137 50 10 AAGE C[C@H]1CCO[C@H]1C(=O)NCB(O)O 702018229 RXSNCUKADTVQNW-NTSWFWBYSA-N 187.004 -1.460 50 10 AAGE CNNC(=O)COCCOC 704665964 SBTSAUXSWHDZQZ-UHFFFAOYSA-N 162.189 -1.100 50 10 AAGE C[C@@H](O)C1CN(C(=O)C(=O)NN)C1 719806152 FXQHNXPSMCAPPB-SCSAIBSYSA-N 187.199 -2.185 50 10 AAGE C[C@H](CCO)N(C)CC(=O)NN 1917042486 DCPJULGQEDUWJL-ZCFIWIBFSA-N 175.232 -1.321 50 10 AAGE O=[N+]([O-])c1cccc(B(O)O)n1 1951325478 DCOSJOBMWLJYDM-UHFFFAOYSA-N 167.917 -1.330 50 10 AAGE COCC[C@@](N)(COC)B(O)O 1953355367 VLPWQFNJDGRWTB-ZCFIWIBFSA-N 177.009 -1.621 50 10 AAGE C[C@H](C(=O)NN)N(C)Cc1ncno1 1955507891 UZNVAKQWNQNIFA-RXMQYKEDSA-N 199.214 -1.120 50 10 AAGE O=C(C#CB(O)O)N1CC2CC(C2)C1 2241478514 GVTZOTMEQBROHN-UHFFFAOYSA-N 193.011 -1.130 50 10 AAGE O=C(C#CB(O)O)N[C@H](CO)C1CC1 2241479042 QJEQOPULFRRQBJ-SSDOTTSWSA-N 196.999 -2.111 50 10 AAGE NNC(=O)N[C@@H]1CCC(=O)NC1=O 84406155 XOLSKHRLPISPDI-GSVOUGTGSA-N 186.171 -2.036 50 10 AAGE CC(=O)O[C@@H](C)C(=O)NN 139884879 DHMPGAKYXLIXLK-VKHMYHEASA-N 146.146 -1.072 50 10 AAGE COc1nc(C=O)ccc1B(O)O 206051739 PHICJMCNEQLKKT-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE CCOC(=O)/C(N)=N/NC(N)=O 238300483 YHKURODOOHKAGM-UHFFFAOYSA-N 174.160 -1.510 50 10 AAGE CC(=O)NNC(=O)C1COC1 306437055 DVJSDTSAIDWOPD-UHFFFAOYSA-N 158.157 -1.200 50 10 AAGE COCCCCn1cc(B(O)O)cn1 694513095 BIXBTCVETAKNNZ-UHFFFAOYSA-N 198.031 -1.011 50 10 AAGE CCCOCC(=O)NCB(O)O 702031109 ULXIYDBBOZVSFN-UHFFFAOYSA-N 174.993 -1.459 50 10 AAGE CNC(=O)NNC(=O)Cn1cncn1 1136378999 RSGITPLLSMJCHE-UHFFFAOYSA-N 198.186 -1.762 50 10 AAGE OB(O)c1nc[nH]c2ncnc1-2 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300740278 AISVPIONDSPAAD-SCSAIBSYSA-N 191.256 -1.156 50 10 AAGE O=CNNC(=O)[C@@H]1CCNC(=O)C1 306451401 WGYSYLHVRJWTRA-RXMQYKEDSA-N 185.183 -1.710 50 10 AAGE CN(N=CC(N)=O)C(N)=O 387873963 LGZWHUIZCCITOR-UHFFFAOYSA-N 144.134 -1.532 50 10 AAGE Cn1cc(NC(=O)NN)nn1 606245882 OYEJFWIZDHGWOQ-UHFFFAOYSA-N 156.149 -1.190 50 10 AAGE C[C@@H]1COC[C@@H]1N(C)CC(=O)NN 688148952 VSWRGSKDKGKMES-RQJHMYQMSA-N 187.243 -1.057 50 10 AAGE CN(C)NC(=O)[C@]1(N)C[C@@H](CO)C1 1883304925 LKRQJERPRSKSPT-WRXNHJIOSA-N 187.243 -1.321 50 10 AAGE NNC(=O)[C@@H]1NC[C@@H]2CC[C@@H]21 1935243594 RLKBTRAWLIFOMY-HCWXCVPCSA-N 155.201 -1.026 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CCCNC1 2241478959 OJNCBPWAKPVBBF-SSDOTTSWSA-N 196.015 -2.130 50 10 AAGE N[C@@H]1CCCN(C(=O)C#CB(O)O)C1 2241479352 WKMDSECZRBRHAS-SSDOTTSWSA-N 196.015 -2.049 50 10 AAGE NC(=O)NC(=O)C1(B(O)O)CC1 2241583616 ATBYGEPQRMLVOI-UHFFFAOYSA-N 171.949 -1.812 50 10 AAGE N#C/C(C(=O)NN)=C(/C#N)C(=O)NN 165073434 YXKUXBDSCNRUNM-ONEGZZNKSA-N 194.154 -2.690 50 10 AAGE C[C@H](N)[C@H](C)C(=O)NN 165471476 POKZIRUVBNMKSK-IMJSIDKUSA-N 131.179 -1.040 50 10 AAGE COC(=O)NN[C@H](CO)C(=O)O 238315056 ABTWDZHRJKMHBE-GSVOUGTGSA-N 178.144 -1.708 50 10 AAGE C[C@H](ON)C(=O)NNC(=O)CN 238463271 DGVYPVOZKKUKDI-VKHMYHEASA-N 176.176 -2.629 50 10 AAGE N#Cc1ccc(B(O)O)c(F)n1 238620746 VWQYYTXBXPNUEN-UHFFFAOYSA-N 165.920 -1.228 50 10 AAGE O[C@@H]1[C@@H](O)[C@H](Cl)[C@H](O)[C@H](O)[C@@H]1O 306649677 BSMLUJHFZGTHOG-BVSGAQNKSA-N 198.602 -2.588 50 10 AAGE Cc1ccc(B(O)O)c(NN)c1 306862335 GFKNDVFPNMHNFM-UHFFFAOYSA-N 165.989 -1.040 50 10 AAGE CO[C@H](C)C(=O)NNC(=O)CCO 308385579 WRBDFWAGLXTQAP-RXMQYKEDSA-N 190.199 -1.449 50 10 AAGE O=C(COC1CCC1)NCB(O)O 716967669 VXBVAGBDLNZEMY-UHFFFAOYSA-N 187.004 -1.316 50 10 AAGE NNC(=O)CN1C2CCC1(CO)CC2 723023604 WLWRHYUZHRYIIZ-UHFFFAOYSA-N 199.254 -1.034 50 10 AAGE CC1=C=C(C(=O)NN)NN1C 885247614 GHQFIOAIGWMPPQ-UHFFFAOYSA-N 154.173 -1.187 50 10 AAGE NNC(=O)N1C[C@H]2C[C@H]1[C@@H]2CO 1881555537 FBHJCNPQKXEYKK-PBXRRBTRSA-N 171.200 -1.118 50 10 AAGE NNC(=O)C(=O)N[C@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 1888548301 NCWVGNMEUCWTDG-ZYNSJIGGSA-N 195.222 -1.253 50 10 AAGE NNC(=O)COCCN1CCC1=O 1928993350 BPDLPBXQPYWBEB-UHFFFAOYSA-N 187.199 -1.775 50 10 AAGE OB(O)c1cnc(S)nc1 2208926717 CIADFLIGIPWERS-UHFFFAOYSA-N 155.975 -1.555 50 10 AAGE N[C@H]1CC[C@@H](NC(=O)C#CB(O)O)C1 2241468632 RKMJMHLGPVXCKE-NKWVEPMBSA-N 196.015 -2.002 50 10 AAGE O=C1CCN1C(=O)[C@H]1C[C@H](B(O)O)C1 2241475080 QCZLIFFMWFWWQF-IZLXSQMJSA-N 196.999 -1.002 50 10 AAGE O=C(NN1CCCC1)[C@H]1C[C@@H]1B(O)O 2241478751 LAWHCGKMSWZMRB-BQBZGAKWSA-N 198.031 -1.024 50 10 AAGE C[C@H](CN)NC(=O)[C@H]1C[C@@H]1B(O)O 2241495339 ITPNKMRNKVVMAG-SRQIZXRXSA-N 186.020 -1.687 50 10 AAGE N#CNc1cccc(B(O)O)n1 2241554286 BFARHJXZYVOZRG-UHFFFAOYSA-N 162.945 -1.346 50 10 AAGE N#C[C@H](N)C(=O)NN 104658369 JSQNTSXBBWMZGQ-REOHCLBHSA-N 114.108 -2.173 50 10 AAGE NNC(=O)CN1CC[C@@H](CO)C1 156888650 SXTHLPIGTFIATN-ZCFIWIBFSA-N 173.216 -1.710 50 10 AAGE CCN(C)c1cnc(B(O)O)cn1 198083674 MIUYOLFKILSMLJ-UHFFFAOYSA-N 181.004 -1.388 50 10 AAGE O=C(O)CO[C@H]1CC(=O)OC1=O 198780341 YWRDHIUJAHYAAO-VKHMYHEASA-N 174.108 -1.070 50 10 AAGE Cc1cc(B(O)O)ncc1C=O 231392862 SDMCDLUAKSUMIO-UHFFFAOYSA-N 164.957 -1.118 50 10 AAGE N[C@H](C(=O)Cl)[C@@H](O)CO 238620358 OJWIHPNJMOVUIK-HRFVKAFMSA-N 153.565 -1.568 50 10 AAGE C[C@@](O)(C#N)Cn1cnnn1 260384270 AVWMHHQEHLKLQD-RXMQYKEDSA-N 153.145 -1.052 50 10 AAGE CC[C@@H](NNC(C)=O)C(N)=O 307667142 GHVDCBUBCXDLCE-RXMQYKEDSA-N 159.189 -1.109 50 10 AAGE CNC(=O)C(=O)NN(C)C(N)=O 307672142 XYPHDVPPTILEPD-UHFFFAOYSA-N 174.160 -2.226 50 10 AAGE C[C-]1C#CN([C@H](C)C(=O)NN)N1 885299271 ZIBSLNUHYKERNN-ZCFIWIBFSA-N 167.192 -1.302 50 10 AAGE CN1CC[C@@H](C(=O)NNCCO)C1 1929833038 CBJSDWNNDZBXDS-SSDOTTSWSA-N 187.243 -1.449 50 10 AAGE NNC(=O)CN1C[C@@H](O)CCC12CC2 2209728548 GXJZZNAUTKGOHJ-ZETCQYMHSA-N 199.254 -1.034 50 10 AAGE NNC(=O)CCCN1CC[C@H](O)C1 82468673 ZPNDEDHJPVQNBH-ZETCQYMHSA-N 187.243 -1.177 50 10 AAGE CN(CC(=O)NN)CC1CC(O)C1 84453462 JURCXNOTDWUCCW-UHFFFAOYSA-N 187.243 -1.321 50 10 AAGE NNC(=O)C1CC(=O)C1 306487298 YXMSUJVLBIEGOB-UHFFFAOYSA-N 128.131 -1.045 50 10 AAGE NNC(=O)CN1[C@H]2CC[C@H]1COC2 695050751 WHPXFWZDSKCKNK-BQBZGAKWSA-N 185.227 -1.161 50 10 AAGE CN(C(=O)NN)[C@@H]1COC[C@H]1O 708051883 SQSHQLCGRKDMAA-RFZPGFLSSA-N 175.188 -1.739 50 10 AAGE CN(NC(=O)CS)S(C)(=O)=O 1888554897 RJDBZBGKPXHSGU-UHFFFAOYSA-N 198.269 -1.161 50 10 AAGE Cn1ccc([C@@](C)(N)B(O)O)n1 1929157635 ZSKBQLUQFWOUFN-ZCFIWIBFSA-N 168.993 -1.394 50 10 AAGE C[C@@]1(C(=O)NN)CNC(=O)C1 1953325294 MVLIYQDYUKYVKK-LURJTMIESA-N 157.173 -1.498 50 10 AAGE CN(N)C(=O)[C@H]1Cc2nncn2C1 1953875798 YNZHZBROTZOZLQ-YFKPBYRVSA-N 181.199 -1.218 50 10 AAGE NNC(=O)C(=O)N1CC2(F)CC1C2 1953876702 YNNYGGFQXILHNR-UHFFFAOYSA-N 187.174 -1.311 50 10 AAGE C[C@H](F)CNC(=O)C#CB(O)O 2241479424 XTVPRLNYALSWMH-YFKPBYRVSA-N 172.952 -1.524 50 10 AAGE NNC(=O)C(=O)N1CCC[C@H]1CO 42435229 UFUVSHFFPIPRMV-YFKPBYRVSA-N 187.199 -2.040 50 10 AAGE CC(=O)NNC(=O)CCN 49804500 IVFNKGZMRFDXDE-UHFFFAOYSA-N 145.162 -1.498 50 10 AAGE O=C(CCl)N[C@@H](O)C(=O)O 104735445 YULYKRNXBRMJQU-VKHMYHEASA-N 167.548 -1.256 50 10 AAGE N#Cc1ccnc(F)c1B(O)O 238613649 XCVPBEWUDBEJQV-UHFFFAOYSA-N 165.920 -1.228 50 10 AAGE COC1CN([C@H](C)C(=O)NN)C1 306305024 RPCGHJZCROKRRP-RXMQYKEDSA-N 173.216 -1.305 50 10 AAGE CO[C@H](CCN)C(=O)NN 306894555 ZFRAPPFWBPDUTK-SCSAIBSYSA-N 147.178 -1.660 50 10 AAGE CN(N)C(=O)Cn1nc(O)ccc1=O 704704980 CJAMQFFNYDVJII-UHFFFAOYSA-N 198.182 -1.719 50 10 AAGE C[C@H](C(=O)NN)[C@H](C)N1C#CNN1 885429565 LOUJWFNUYFWMIW-WDSKDSINSA-N 183.215 -1.756 50 10 AAGE C#CCONc1ccc(B(O)O)cn1 2210059723 CAGRMSXJTYKLAO-UHFFFAOYSA-N 191.983 -1.262 50 10 AAGE OB(O)c1cccnc1N1CC(O)C1 2210061586 WBUFFBZCYQKQMU-UHFFFAOYSA-N 193.999 -2.058 50 10 AAGE COC[C@H](C)CNC(=O)C#CB(O)O 2241472610 UWRUJNDSSSOXQG-SSDOTTSWSA-N 199.015 -1.600 50 10 AAGE CNC(=O)[C@H]1C[C@H](B(O)O)C1 2241496433 SOMMLHCLXVLCPZ-URHBZAFASA-N 156.978 -1.015 50 10 AAGE N#CN=c1nc(B(O)O)[nH]s1 2241556358 WEYJCKRCUABQQS-UHFFFAOYSA-N 169.962 -2.467 50 10 AAGE C[C@@H](O)C(=O)N[C@H]1CCC=C1B(O)O 2241559245 MFJAIVOBNOJNKD-VDTYLAMSSA-N 199.015 -1.416 50 10 AAGE NC[C@@H]1CC[C@H](C(=O)NN)O1 87047513 DXVDVAQASGWTTB-CRCLSJGQSA-N 159.189 -1.517 50 10 AAGE CC(C)S(=O)(=O)NCB(O)O 205324745 GLTJHEXDPCCKJQ-UHFFFAOYSA-N 181.022 -1.674 50 10 AAGE O=C1Cc2cncc(B(O)O)c2N1 238657647 YPJVCKVFPROUMJ-UHFFFAOYSA-N 177.956 -1.744 50 10 AAGE CNC(=O)CSCCC(=O)NN 300841877 QXRZRNSYDZZRNI-UHFFFAOYSA-N 191.256 -1.154 50 10 AAGE CN(C)NC(=O)[C@@H]1CCC(=O)N1 307470621 OOSCVHQCISTVJJ-YFKPBYRVSA-N 171.200 -1.142 50 10 AAGE C[C@H](CNC(=O)NN)S(C)(=O)=O 697618982 SHECYMKJSAXREW-SCSAIBSYSA-N 195.244 -1.408 50 10 AAGE CCOCCC(=O)NCB(O)O 701961273 UOIPDMNWLYCJHE-UHFFFAOYSA-N 174.993 -1.459 50 10 AAGE C[C@@H]1C[C@]1(N)C(=O)NN 1879957734 HPJKOBBPPXYLPC-NQXXGFSBSA-N 129.163 -1.286 50 10 AAGE OB(O)c1ncc2ncsc2n1 1881118312 LWSQMXYAQSZHSA-UHFFFAOYSA-N 180.985 -1.234 50 10 AAGE C[C@]1(O)CCN(C(=O)NN)C[C@@H]1O 1883747508 ZHNQZLBTQBQXFK-FSPLSTOPSA-N 189.215 -1.613 50 10 AAGE NNC(=O)N1C[C@@H](C(N)=O)C2(CC2)C1 1892603353 TVNJJEVOISTIEZ-YFKPBYRVSA-N 198.226 -1.233 50 10 AAGE NC[C@@]1(C(=O)NN)CCCO1 1923250217 AJWQPXHBQSJGBO-ZCFIWIBFSA-N 159.189 -1.516 50 10 AAGE CCCOc1cnc(B(O)O)nc1 1954858311 GXWLODDTCFJPTI-UHFFFAOYSA-N 181.988 -1.055 50 10 AAGE C[C@H](C(N)=O)N(C)C(=O)C#CB(O)O 2241468549 QFXIKWJGNYAZBM-RXMQYKEDSA-N 197.987 -2.666 50 10 AAGE CCn1cc(B(O)O)cc1C(=O)O 2241493170 KHFYIGJTCFRQCN-UHFFFAOYSA-N 182.972 -1.114 50 10 AAGE COc1ccc(B(O)O)o1 200527961 KTJRKJNZUZNMDU-UHFFFAOYSA-N 141.919 -1.032 50 10 AAGE NCCn1cnc(C(=O)NN)c1 231637179 XHIIOBSDGXTNBN-UHFFFAOYSA-N 169.188 -1.555 50 10 AAGE O=Cc1ccc(B(O)O)c(F)n1 238621949 IKJQGXCNNJVGGD-UHFFFAOYSA-N 168.920 -1.287 50 10 AAGE O=[N+]([O-])c1cc(B(O)O)ccn1 238630180 WWIPZUXJNSKRQC-UHFFFAOYSA-N 167.917 -1.330 50 10 AAGE NNC(=O)N[C@H](CCO)C(=O)NN 238661871 LNRFPNJUEYPIOO-GSVOUGTGSA-N 191.191 -3.100 50 10 AAGE Nc1nc2c(B(O)O)cccc2[nH]1 306627661 IWJHPGPCYDDHRQ-UHFFFAOYSA-N 176.972 -1.175 50 10 AAGE O=C(NCB(O)O)[C@@H]1COCCO1 702018133 QEBAMEAIVHVJNX-YFKPBYRVSA-N 188.976 -2.470 50 10 AAGE Nc1nc2c(B(O)O)cccn2n1 1772508714 NBHXVGSRKRHFCP-UHFFFAOYSA-N 177.960 -2.009 50 10 AAGE C[C@H]1C[C@]1(N)C(=O)NN 1879957737 HPJKOBBPPXYLPC-WVZVXSGGSA-N 129.163 -1.286 50 10 AAGE CN1C[C@H](N(C)C(=O)NN)CC1=O 1882878105 ZQEQRPASIOMBGQ-RXMQYKEDSA-N 186.215 -1.268 50 10 AAGE COCCN=c1ccc(B(O)O)c[nH]1 1885668316 MBAWMIMEGQWWBI-UHFFFAOYSA-N 196.015 -1.758 50 10 AAGE C[C@@H](O)CN1CC[C@@H](B(O)O)C1 1891538768 OHLXMWPMJYHQML-RNFRBKRXSA-N 173.021 -1.084 50 10 AAGE NNC(=O)CCCN1CCC1=O 1928993138 ZCUFWQFRHYBGBZ-UHFFFAOYSA-N 171.200 -1.011 50 10 AAGE COc1cc(B(O)O)ncn1 1953238765 DNPSKSBMPPHINI-UHFFFAOYSA-N 153.934 -1.835 50 10 AAGE CC(=O)NNS(=O)(=O)[C@H](C)C#N 1953750395 LEFBBILVUNEJDR-SCSAIBSYSA-N 191.212 -1.131 50 10 AAGE CN(C(=O)C#CB(O)O)C1CC(O)C1 2241468580 QSTCGTDGOSOBRP-UHFFFAOYSA-N 196.999 -2.017 50 10 AAGE C=CCN(CCO)C(=O)C#CB(O)O 2241469029 YXRNWMZPVHNHHL-UHFFFAOYSA-N 196.999 -1.991 50 10 AAGE CON(C)C(=O)c1occc1B(O)O 2241473279 GZVLSSRFJNABJK-UHFFFAOYSA-N 198.971 -1.407 50 10 AAGE C[C@@H]1CC(=O)N1C(=O)[C@H]1C[C@@H]1B(O)O 2241481101 OPAMEPGVUOXKRI-SRQIZXRXSA-N 196.999 -1.003 50 10 AAGE COC(=O)c1ncsc1B(O)O 2241492209 BAAWKQUNPHAGCO-UHFFFAOYSA-N 186.985 -1.391 50 10 AAGE N#CCCNC(=O)[C@@H]1C[C@@H]1B(O)O 2241495322 IQRRJKXRGBZOCA-RITPCOANSA-N 181.988 -1.121 50 10 AAGE OB(O)c1ccn(CF)n1 2242483425 NRMMWHSWSOUTCA-UHFFFAOYSA-N 143.914 -1.510 50 10 AAGE OC[C@@H](O)[C@H](Cl)CO 39074079 FKAYVCGCODVBDC-QWWZWVQMSA-N 140.566 -1.061 50 10 AAGE NNC(=O)C[C@H]1CCC(=O)N1 39136631 VZLUTRWHGLKDKD-SCSAIBSYSA-N 157.173 -1.355 50 10 AAGE CN1C=C(C#N)C(N)=NS1(=O)=O 39276609 RARQWSVWGNOHLE-UHFFFAOYSA-N 186.196 -1.059 50 10 AAGE NNC(=O)N1CCNC(=O)CC1 62101588 FJWAMOFMHJAJFA-UHFFFAOYSA-N 172.188 -1.608 50 10 AAGE NCC(=O)NNCc1ncc[nH]1 238604933 BSWLWEBHIFGNPN-UHFFFAOYSA-N 169.188 -1.511 50 10 AAGE O[Si](O)(O)O[Si](O)(O)O 247316127 KDJOAYSYCXTQGG-UHFFFAOYSA-N 174.213 -4.172 50 10 AAGE fda CC(=O)NNN=CC(=O)NN 307852927 BOXAHFMMRCQUKK-UHFFFAOYSA-N 159.149 -2.397 50 10 AAGE CCn1nnnc1CB(O)O 575598182 RORBLELMTUITRH-UHFFFAOYSA-N 155.954 -1.753 50 10 AAGE CN1NC#C/C1=C1\NC(C#N)=C(N)O1 885535301 MMHLRZKMNLTJCX-VURMDHGXSA-N 189.178 -1.162 50 10 AAGE CN1NC(c2nnnn2C)=C=C1C=O 885590859 ZTVMKPILUNBFFP-UHFFFAOYSA-N 192.182 -1.317 50 10 AAGE CN(C)NC(=O)[C@]1(O)CCNC1 1880975656 NENULZFPPFITFN-ZETCQYMHSA-N 173.216 -1.696 50 10 AAGE NC(=O)[C@@]1(O)CCN(C(=O)F)C1 1881052233 YCIIYASFWUBQBT-ZCFIWIBFSA-N 176.147 -1.002 50 10 AAGE CCNC(=O)c1nn(C)cc1B(O)O 2241468242 JWLAFXZMMBGYPN-UHFFFAOYSA-N 197.003 -2.150 50 10 AAGE O=C(C#CB(O)O)NC[C@H](O)CO 2241468311 LILNAYRPXJORKY-YFKPBYRVSA-N 186.960 -3.529 50 10 AAGE C#CCCNC(=O)C#CB(O)O 2241479139 RZNGFTXDSRKCRI-UHFFFAOYSA-N 164.957 -1.859 50 10 AAGE NNC(=O)[C@@H]1CCCC[C@@]1(O)NN 104553115 YNLURNLSZXYBHR-FSPLSTOPSA-N 188.231 -1.682 50 10 AAGE [C-]#[N+]CC(=O)NN 148212333 ICLCTGDUHVWNDG-UHFFFAOYSA-N 99.093 -1.104 50 10 AAGE C[C@H](O)[C@]1(O)[C@@H](O)C=C(C#N)[C@H]1O 261505873 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1895239621 PEUFCMNFJPDQOC-UHFFFAOYSA-N 193.955 -1.580 50 10 AAGE COC[C@@H](N)CC(=O)NN(C)C 1929901289 KTTKDPMFMMVGAN-LURJTMIESA-N 175.232 -1.057 50 10 AAGE COC1(CO)CN(C(=O)NN)C1 1935357936 FFYLSSSXVUQIFZ-UHFFFAOYSA-N 175.188 -1.737 50 10 AAGE CC(CO)(CO)[C@H](O)C#N 1951502926 UOUWTCGINGKHID-RXMQYKEDSA-N 145.158 -1.138 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2CC[C@@H]1C2 1954500413 SOICEVYNUGHMGN-NTSWFWBYSA-N 183.211 -1.013 50 10 AAGE N#CNC(=O)c1n[nH]cc1B(O)O 2241475475 YJPOHSNZIUNMLI-UHFFFAOYSA-N 179.932 -2.700 50 10 AAGE CCn1cc(B(O)O)c(C(=O)O)n1 2241494356 XGJCJPDDKOROFQ-UHFFFAOYSA-N 183.960 -1.719 50 10 AAGE CC(C)(CO)C(=O)NN 86597500 PIXGXMUAMRXXFL-UHFFFAOYSA-N 132.163 -1.005 50 10 AAGE N#C/C(C(=O)NN)=C(\C#N)C(=O)NN 147863287 YXKUXBDSCNRUNM-ARJAWSKDSA-N 194.154 -2.690 50 10 AAGE C[C@H](CN1CC[C@H](N)C1)C(=O)NN 203229552 IGOWQLAHHDHASQ-RQJHMYQMSA-N 186.259 -1.355 50 10 AAGE C#CC(=O)NNC(=O)[C@@H]1CCCO1 306857711 BJMSAAIMVBFYPO-LURJTMIESA-N 182.179 -1.054 50 10 AAGE CC(=NN)[C@@H](C#N)C(=O)NN 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AAGE C[C@@H](O)C(=O)N[C@@H]1CCC=C1B(O)O 2241559244 MFJAIVOBNOJNKD-IYSWYEEDSA-N 199.015 -1.416 50 10 AAGE Cc1oc(B(O)O)cc1C(=O)NO 2241584477 OINQAERCDBCIGH-UHFFFAOYSA-N 184.944 -1.613 50 10 AAGE O=C(NO)c1cc(B(O)O)ccc1F 2241584751 SMQLQCARYXPTFX-UHFFFAOYSA-N 198.946 -1.376 50 10 AAGE CCn1cn[nH]c1=NC(=O)C(=O)NN 2242029326 JLMGKJYEJPKJJC-UHFFFAOYSA-N 198.186 -2.352 50 10 AAGE O[C@H]1[C@@H](O)[C@@H](CCl)O[C@@H](O)[C@@H]1O 38234920 QMWDIHPSUCUMFU-FPRJBGLDSA-N 198.602 -1.975 50 10 AAGE NNC(=O)[C@H]1Cc2nc[nH]c2CN1 86233459 METTYDIIIXIRJI-RXMQYKEDSA-N 181.199 -1.586 50 10 AAGE CCOC(=O)c1ncc(B(O)O)n1C 199023931 SEKZSBVAAXWUKQ-UHFFFAOYSA-N 197.987 -1.723 50 10 AAGE O=CC1=CNC(=S)N[C@H]1O 238693605 AMPPQQPWMHDRJO-BYPYZUCNSA-N 158.182 -1.135 50 10 AAGE NNC(=O)[C@H]1CCCCn2nnnc21 306317114 DXTNJSQYCUTXDZ-YFKPBYRVSA-N 196.214 -1.070 50 10 AAGE CC[C@](C)(NC(=O)NN)C(N)=O 306887305 QNVKEJBKALTFAP-LURJTMIESA-N 174.204 -1.187 50 10 AAGE NNC(=O)[C@@H]1[C@H]2CN[C@H]1C2 307123378 OJCZBABJGSJMGM-MROZADKFSA-N 141.174 -1.416 50 10 AAGE CN(N)C(=O)c1nnn(C)n1 704708079 WZFDWUSRLUCLEV-UHFFFAOYSA-N 156.149 -1.844 50 10 AAGE C[C@@H](O)C(=O)NCB(O)O 1880031248 RJDJKEGFELPQEH-GSVOUGTGSA-N 146.939 -2.505 50 10 AAGE C[C@@H]1C[C@]1(F)CNC(=O)C(=O)NN 1884215660 GMOOSFXRGNBHHY-FBCQKBJTSA-N 189.190 -1.159 50 10 AAGE O=C(NCC#CB(O)O)c1ncc[nH]1 1895574536 OJJYDUPBZNDQKV-UHFFFAOYSA-N 192.971 -1.845 50 10 AAGE Cc1c(C(=O)NNCCO)cnn1C 1929833629 MTPFLQJYDIYJSU-UHFFFAOYSA-N 198.226 -1.045 50 10 AAGE CN1CC[C@](N)(B(O)O)C1 1953160654 IBEUXSQMWVBDSO-RXMQYKEDSA-N 143.983 -1.969 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C[C@H](CF)C1 2241468486 PFUDKQOOJVFFEJ-LJGSYFOKSA-N 198.990 -1.134 50 10 AAGE CN(C)C(=O)C#CB(O)O 2241468587 QVSCCACEXLPDMW-UHFFFAOYSA-N 140.935 -1.910 50 10 AAGE Cn1[nH]cnc1=NC(=O)C#CB(O)O 2241475597 AWBRCPOBBZRHON-UHFFFAOYSA-N 193.959 -2.809 50 10 AAGE NC(=O)NC(=O)c1cc(B(O)O)co1 2241758503 VIPHYADNBLXLGC-UHFFFAOYSA-N 197.943 -2.232 50 10 AAGE OB(O)CB(O)O 196041342 ZZKAPHPTYABEPL-UHFFFAOYSA-N 103.679 -2.529 50 10 AAGE CCNCC(=O)CNCB(O)O 200993719 LJODQXYUQPFOCU-UHFFFAOYSA-N 174.009 -2.233 50 10 AAGE NNC(=O)C(=O)NCc1ccno1 231916049 ACOZMWCSKLCJTP-UHFFFAOYSA-N 184.155 -1.719 50 10 AAGE CNc1cnccc1B(O)O 238346399 MSKRPONCPOWFFM-UHFFFAOYSA-N 151.962 -1.197 50 10 AAGE OB(O)[C@H]1CNCCO1 238610425 QWBTXAJUCOPYBQ-SCSAIBSYSA-N 130.940 -2.013 50 10 AAGE O=C(CO)[C@H](O)[C@H](O)[C@@H](O)CCl 238688447 GKKJMTUOJYXAJQ-LFRDXLMFSA-N 198.602 -2.131 50 10 AAGE N#CC1=C[C@@H]2O[C@@H]2[C@H](O)[C@@H]1O 306360306 AASWHARLAPKYTB-WNJXEPBRSA-N 153.137 -1.061 50 10 AAGE C/C(=N\NC(N)=O)[C@H]1C(=O)COC1=O 306778342 QMMXLNZYPPTUOJ-QKEWHEQXSA-N 199.166 -1.227 50 10 AAGE NNc1cccc(B(O)O)c1C(=O)O 307431700 XDEGBQKNVVYGMO-UHFFFAOYSA-N 195.971 -1.650 50 10 AAGE NNC(=O)[C@]1(O)C[C@H](O)C=C1CO 307675209 FKSQYMLFDQCKRP-VDTYLAMSSA-N 188.183 -2.609 50 10 AAGE C[C@H]1C[C@@]1(C)NC(=O)C(=O)NN 606252657 SJZSAVIJYZGZIY-MHTLYPKNSA-N 171.200 -1.109 50 10 AAGE CN1NNN=C1[C@@H](O)C1=C=S=C=N1 642820974 CFCQFJOEJFJOLJ-YFKPBYRVSA-N 197.223 -1.448 50 10 AAGE CN(C)CC(=O)NCB(O)O 701936722 BGUPIGUUUHETBH-UHFFFAOYSA-N 159.982 -2.324 50 10 AAGE CNNC(=O)[C@@H](C)NC(N)=O 704664620 IIJGBPSHYHPHRP-GSVOUGTGSA-N 160.177 -1.706 50 10 AAGE C[C@H]1CN(CC(=O)NN)C[C@H]1CO 708123595 GMSPVPCXNNGBPQ-BQBZGAKWSA-N 187.243 -1.464 50 10 AAGE CNS(=O)(=O)NCC=CB(O)O 1881334886 DIFXYEQOYJEXIC-UHFFFAOYSA-N 194.021 -2.392 50 10 AAGE CON(C)C(=O)C(=O)NN 1928668622 REDOUDSICWGTDB-UHFFFAOYSA-N 147.134 -2.004 50 10 AAGE CN(C)NC(=O)[C@H](N)[C@@H]1CCOC1 1929928543 ZRAPHXOTRDTQEC-RNFRBKRXSA-N 187.243 -1.057 50 10 AAGE CC(=O)NNS(=O)(=O)CCO 1953347272 VAEJHQCRGCHRJD-UHFFFAOYSA-N 182.201 -2.051 50 10 AAGE CNNC(=O)c1ncc[nH]c1=O 1953368803 HHTFMEGZIUPQJS-UHFFFAOYSA-N 168.156 -1.366 50 10 AAGE CC1(C)CNC[C@H](C(=O)NN)O1 1953516965 LZUUYEWEXPOIAE-RXMQYKEDSA-N 173.216 -1.257 50 10 AAGE Cn1cc(B(O)O)cc1C(N)=O 2241473518 LUYRHEGEIGQEOH-UHFFFAOYSA-N 167.961 -2.196 50 10 AAGE O=C(N[C@H]1CC[C@@H]1O)C1(B(O)O)CC1 2241473531 MCRFLHWFJSYKBO-WDSKDSINSA-N 199.015 -1.367 50 10 AAGE O=C(NN1CCC1)[C@H]1C[C@@H](B(O)O)C1 2241475457 XZHGVVBBXXHVKI-KNVOCYPGSA-N 198.031 -1.024 50 10 AAGE N[C@@]1(B(O)O)COC2(COC2)C1 2241846051 FJIFTJPKPRELKB-ZCFIWIBFSA-N 172.977 -2.115 50 10 AAGE C#CC1(NC(=O)C#CB(O)O)CCC1 2242091071 CUFYKYZVQCXJBZ-UHFFFAOYSA-N 190.995 -1.326 50 10 AAGE CC(=O)c1cncc(B(O)O)c1N 206091888 HEDZQZFXRSHOAL-UHFFFAOYSA-N 179.972 -1.454 50 10 AAGE O=CC1=C[C@H](O)[C@H](CO)O1 218199489 NWVFGYOPLJREHQ-WDSKDSINSA-N 144.126 -1.179 50 10 AAGE NNC(=O)CC[C@@H]1NC(=O)NC1=O 232676780 FSDRCRHVXULOOZ-VKHMYHEASA-N 186.171 -2.036 50 10 AAGE OB(O)c1cnc2oncc2c1 238656957 JMUBWZHJHYYRPC-UHFFFAOYSA-N 163.929 -1.097 50 10 AAGE NNC(=O)c1cc(B(O)O)ccc1F 306335657 GLDUSEBWZUQBQV-UHFFFAOYSA-N 197.962 -1.891 50 10 AAGE NNC(=O)CN1C[C@H](O)C12CCC2 1883993813 LGYDRNPATKLWIB-LURJTMIESA-N 185.227 -1.425 50 10 AAGE CN1CC[C@@H](C(=O)NN)S1(=O)=O 1923870494 DALIAJFURSKLQI-BYPYZUCNSA-N 193.228 -1.990 50 10 AAGE C#CCC[C@H](N)C(=O)NN 1953183007 HVWSPYNQPHKCNN-YFKPBYRVSA-N 141.174 -1.283 50 10 AAGE O=C(NCB(O)O)c1ccnnc1O 2209981387 CQUWUMPQQRTPOY-UHFFFAOYSA-N 196.959 -2.076 50 10 AAGE N#CNC(=O)c1ccsc1B(O)O 2241468051 GNAONSORSLHJGF-UHFFFAOYSA-N 195.996 -1.361 50 10 AAGE CCN(CCO)C(=O)C#CB(O)O 2241468306 LEVKEUWEWIMCEI-UHFFFAOYSA-N 184.988 -2.157 50 10 AAGE COCC[C@@H](C)NC(=O)C#CB(O)O 2241471974 OKJQVWHSPBCRFM-SSDOTTSWSA-N 199.015 -1.457 50 10 AAGE O=C1CCN1C(=O)C1(B(O)O)CC1 2241473092 CNAWYLJZNKKSGH-UHFFFAOYSA-N 182.972 -1.248 50 10 AAGE C[C@H](O)CC(=O)NCC#CB(O)O 2241574706 ASLLYJCGCZRJOP-LURJTMIESA-N 184.988 -2.111 50 10 AAGE N[C@H](CO)C(=O)NCCCl 104718892 JWWSHRXEQXZYMN-SCSAIBSYSA-N 166.608 -1.339 50 10 AAGE O=C(O)Cc1ccc(B(O)O)c(F)n1 238622252 VKUCPKUDRFTDAG-UHFFFAOYSA-N 198.946 -1.472 50 10 AAGE CONC(=O)NNC(N)=S 307045603 WEDSJFIXELQMCE-UHFFFAOYSA-N 164.190 -1.405 50 10 AAGE NNC(=O)c1ccnc2ncnn12 307555889 UAHWOMWTMQYBOM-UHFFFAOYSA-N 178.155 -1.272 50 10 AAGE CC(=O)NNC(=O)[C@@H]1COCCN1 307572882 FLWLRVYTFIVXFY-LURJTMIESA-N 187.199 -1.858 50 10 AAGE NC(=O)NNC(=O)C1=COCCO1 606258894 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C#CC1CN(CC(=O)NNC(C)=O)C1 1930576201 ZTHDSCMJGYTCIL-UHFFFAOYSA-N 195.222 -1.281 50 10 AAGE C[C@@](N)(C(=O)NN)C(F)F 1932390083 YLIQVVMFOVFWGO-BYPYZUCNSA-N 153.132 -1.041 50 10 AAGE Cn1nc(B(O)O)c(C(F)(F)F)n1 2209173948 AUDNUKQZPORKKQ-UHFFFAOYSA-N 194.909 -1.486 50 10 AAGE C#CC1CC(N)(C(=O)NN)C1 2241445479 ABXGPPCWUWVYBK-UHFFFAOYSA-N 153.185 -1.283 50 10 AAGE O=C(C#CB(O)O)N1C[C@H]2C[C@H]1CO2 2241478542 HJRMDSRQWKHWQO-NKWVEPMBSA-N 194.983 -1.999 50 10 AAGE NNC(=O)CC[C@H](N)C(=O)NN 5828364 MJQOJHICLSTPBF-VKHMYHEASA-N 175.192 -2.926 50 10 AAGE NNC(=O)NCCC(=O)NC1CC1 86276239 FLLWFUKKEHHOHD-UHFFFAOYSA-N 186.215 -1.172 50 10 AAGE CCOC(=O)/C(C#N)=C(\N)NN 104536887 XSOWLASWXKSYJI-SNAWJCMRSA-N 170.172 -1.293 50 10 AAGE NNC(=O)CCN1C(=O)[C@@H]2C[C@H]2C1=O 113289688 VPAODOKRUOHTSV-RFZPGFLSSA-N 197.194 -1.629 50 10 AAGE N#C[C@@H](O)Cn1cnnn1 260409174 BZXMTPHRNDMACD-SCSAIBSYSA-N 139.118 -1.442 50 10 AAGE Cn1ncc(C(=O)NNC(N)=O)n1 306236506 LDGMGVVUIAPNPG-UHFFFAOYSA-N 184.159 -1.872 50 10 AAGE C[C@@H]1CC[C@@H](O)CN1CC(=O)NN 306956244 RFKOEDWONGXUEW-RNFRBKRXSA-N 187.243 -1.179 50 10 AAGE NC(=O)NCc1ccccc1B(O)O 405191829 WZXJXOCIMNCREF-UHFFFAOYSA-N 193.999 -1.465 50 10 AAGE Cc1nnccc1C(=O)NCB(O)O 701940057 RQFYOZKYTKBWFI-UHFFFAOYSA-N 194.987 -1.473 50 10 AAGE NC[C@@H]1CCO[C@@H]1C(=O)NN 715294243 JCDHDJORYFDRFN-WHFBIAKZSA-N 159.189 -1.660 50 10 AAGE NNC(=O)CN1CC[C@H]1C(N)=O 757146244 NBUTZIFZQFAMFJ-BYPYZUCNSA-N 172.188 -2.464 50 10 AAGE N#CC1=C(N2CC[C@@H](N)C2)NC#CN1 885540570 DTSHGGIIOPABTN-SSDOTTSWSA-N 189.222 -1.177 50 10 AAGE NNC(=O)[C@H]1C[C@H]1N 1923406222 YPGNRODCJVIYRF-STHAYSLISA-N 115.136 -1.677 50 10 AAGE CN1[C@H](CN)CC[C@@H]1C(=O)NN 1923855689 ZACOTPXQOXCVRS-NTSWFWBYSA-N 172.232 -1.602 50 10 AAGE CON(C)CC(=O)NN 1928676143 CHRDQQVXNUIPPA-UHFFFAOYSA-N 133.151 -1.531 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H](O)C2(CC2)C1 1930236140 WHQZRXZHTBIGDN-NKWVEPMBSA-N 199.254 -1.179 50 10 AAGE C[C@H](N)CN=c1ccc(B(O)O)c[nH]1 2210060812 NOGVWYOYRDWABW-LURJTMIESA-N 195.031 -2.058 50 10 AAGE N#CCC1CN(C(=O)C#CB(O)O)C1 2241468681 SGCWJKXNFWNBOD-UHFFFAOYSA-N 191.983 -1.626 50 10 AAGE C#CCOCCNC(=O)C#CB(O)O 2241478874 MPIICRIRPNNJCQ-UHFFFAOYSA-N 194.983 -2.232 50 10 AAGE O=C(NC1CNC1)[C@@H]1C[C@@H]1B(O)O 2241494608 ABZNLURNMMGYLF-RITPCOANSA-N 184.004 -2.063 50 10 AAGE NC1CN(C(=O)C2CC(B(O)O)C2)C1 2241495766 MELSYSZKGPCQIB-UHFFFAOYSA-N 198.031 -1.591 50 10 AAGE O=C(O)[C@H]1CCN1C(=O)C#CB(O)O 2241584417 NHWYYOAVXCAERN-RXMQYKEDSA-N 196.955 -2.313 50 10 AAGE O=C(NNCCO)c1cc(=O)cc[nH]1 2241652044 NASNNDOYNQBAKF-UHFFFAOYSA-N 197.194 -1.398 50 10 AAGE C[C@@H](O)C(=O)NCCC#CB(O)O 2241909081 TXZWAUBKLBQYDN-ZCFIWIBFSA-N 184.988 -2.111 50 10 AAGE NCc1cc(Cl)c(B(O)O)cn1 238654221 SEBNNDVMFDNUEA-UHFFFAOYSA-N 186.407 -1.127 50 10 AAGE O=C(CO)N/N=C/c1ncc[nH]1 306310106 IOBKEXUELLJWFF-YCRREMRBSA-N 168.156 -1.148 50 10 AAGE OB(O)c1ccc2nnnn2c1 306445459 STCRSUWSFOPSET-UHFFFAOYSA-N 163.933 -2.196 50 10 AAGE C[C@H](O)CNC(=O)NNC(N)=S 306545085 CPYQFFRSWZHNQH-VKHMYHEASA-N 192.244 -1.585 50 10 AAGE O=C(B(O)O)n1cccn1 307461941 BKCFBJHECJPUMG-UHFFFAOYSA-N 139.907 -1.094 50 10 AAGE C[N+]1=C=C(C(=O)NCCCl)NN1 885533643 IVUPQOYTIKARKK-UHFFFAOYSA-O 189.626 -1.440 50 10 AAGE CN(C[C@H]1C[C@H]1C(=O)NN)C1COC1 1915659349 YRMUPYBBQLGZCK-HTRCEHHLSA-N 199.254 -1.057 50 10 AAGE CC12CC(C1)N(C(=O)C(=O)NN)C2 1932877373 WSSLIOJMWVZYPN-UHFFFAOYSA-N 183.211 -1.013 50 10 AAGE C[C@]1(CO)CCN1CC(=O)NN 1932966615 DXNLABULDGQWBM-SSDOTTSWSA-N 173.216 -1.567 50 10 AAGE OB(O)c1cnn2c1NCC2 1951339877 OCTBRXSKHSNSNT-UHFFFAOYSA-N 152.950 -2.012 50 10 AAGE NNC(=O)[C@@H]1CCNC[C@@H]1F 1953298326 ICRCGRJHNWRRTN-UHNVWZDZSA-N 161.180 -1.076 50 10 AAGE CN1CCN(CC(=O)NN)[C@H]2CC[C@H]21 1956636740 KMAXCLBBEJMASG-SFYZADRCSA-N 198.270 -1.245 50 10 AAGE NNC(=O)N1CCN(C2CC2)C(=O)C1 1956805749 RQXKBBUBTXVMTR-UHFFFAOYSA-N 198.226 -1.124 50 10 AAGE O=C(C#CB(O)O)NCCC1COC1 2241476187 NFQWDYMLFYSLBZ-UHFFFAOYSA-N 196.999 -1.846 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2CC[C@@H]2C1=O 2241505105 ZZRMYXCUWOTHFR-WHFBIAKZSA-N 197.194 -1.629 50 10 AAGE O=C(NCC#CB(O)O)C(F)(F)F 2241556513 YSFQYPNPNXRPMI-UHFFFAOYSA-N 194.905 -1.320 50 10 AAGE CN(CCC(=O)NN)CC1COC1 2241661909 LNWUTVDURLUYBM-UHFFFAOYSA-N 187.243 -1.055 50 10 AAGE CC1(CNC(=O)C(=O)NN)CC1 232784181 PZSCFCQJFUWQMM-UHFFFAOYSA-N 171.200 -1.107 50 10 AAGE O=CNNc1nnc(C(=O)O)c(=O)[nH]1 238712802 HSALJUGAGUAGIL-UHFFFAOYSA-N 199.126 -2.064 50 10 AAGE O=CC1=C[C@H](O)[C@H](O)[C@@H](O)[C@H]1O 238744243 KQQCGAKRCKYICB-AXMZGBSTSA-N 174.152 -2.431 50 10 AAGE NC[C@H](N)c1ccc(B(O)O)cc1F 238805714 CUMREUGOLWPLBY-QMMMGPOBSA-N 198.006 -1.536 50 10 AAGE NNc1ccc(O)c(B(O)O)c1 306712892 ADECEAASNDTAPW-UHFFFAOYSA-N 167.961 -1.642 50 10 AAGE O=C1NC(=O)[C@@H]2N[C@H](Cl)N[C@H]2N1 306922714 WPCSRVACOYKESZ-OIQQXWIDSA-N 190.590 -1.764 50 10 AAGE Cn1nnc([C@H](Cl)C(N)=O)n1 575471919 WEIWGTTZRXTRRZ-UWTATZPHSA-N 175.579 -1.025 50 10 AAGE Cc1nonc1C[N+]1=C=C(C=O)NN1 885610714 HWZPZGBHBMQDHX-UHFFFAOYSA-N 194.174 -1.334 50 10 AAGE O=C(NNCCO)[C@H]1C[C@H]1F 1880183556 RLDDPVBRDFIUTJ-CRCLSJGQSA-N 162.164 -1.043 50 10 AAGE NNC(=O)CN1CC[C@H]1CO 1929740462 IYRYXASMXHOLGE-YFKPBYRVSA-N 159.189 -1.957 50 10 AAGE CCNC(=O)NNCCO 1929841930 NGKCNCKXMGHAGI-UHFFFAOYSA-N 147.178 -1.198 50 10 AAGE NNC(=O)CN1CC(CF)C1 1953232610 BIRYXXXSLUAHLR-UHFFFAOYSA-N 161.180 -1.122 50 10 AAGE C[C@H]([C@@](C)(N)B(O)O)S(C)(=O)=O 1953677422 DMCXRBWAHFSECF-RFZPGFLSSA-N 195.049 -1.851 50 10 AAGE O=c1ncc(B(O)O)cn1CCCF 2210081205 IBCVCYSYFFGRNK-UHFFFAOYSA-N 199.978 -1.717 50 10 AAGE C[C@H](CO)CN(C)C(=O)C#CB(O)O 2241478958 OIKWQYJFNKDBRD-ZETCQYMHSA-N 199.015 -1.911 50 10 AAGE O=C(CO)N[C@@H]1CCC=C1B(O)O 2241561682 BFXXQJTYBWSZAK-ZCFIWIBFSA-N 184.988 -1.804 50 10 AAGE O=C(NO)[C@H]1C[C@H]1B(O)O 2241584291 LXBBLBPIQLSEMI-STHAYSLISA-N 144.923 -1.645 50 10 AAGE O=C(NO)c1coc(B(O)O)c1 2241584334 MKMDUMZWAPYXOF-UHFFFAOYSA-N 170.917 -1.922 50 10 AAGE NNC(=O)[C@@]12CC[C@@](CO)(C1)OC2 2242290547 SWKJGQZPLLLFCE-YUMQZZPRSA-N 186.211 -1.092 50 10 AAGE CN(CC(=O)NN)c1ncccn1 36964379 PNFRCVJPAIHJQS-UHFFFAOYSA-N 181.199 -1.097 50 10 AAGE CCN(CCO)C(=O)C(=O)NN 37900584 SKLAYQXNEGFOGF-UHFFFAOYSA-N 175.188 -2.183 50 10 AAGE NC(=O)CNS(=O)(=O)CCl 82511972 FVQVCGFEWYRNLZ-UHFFFAOYSA-N 186.620 -1.413 50 10 AAGE Cc1nn(CCO)c(B(O)O)c1N 204525781 JMNBGEUYNPUYEQ-UHFFFAOYSA-N 184.992 -2.554 50 10 AAGE Cc1cnc(CNC(=O)C(=O)NN)o1 231672969 XFCHHKDICUYURS-UHFFFAOYSA-N 198.182 -1.411 50 10 AAGE COC(=O)[C@@]1(C#N)C[C@H]1B(O)O 238390057 ZBGONEPCFQUWFG-INEUFUBQSA-N 168.945 -1.084 50 10 AAGE OB(O)c1ccnc2c1OCCCO2 238652225 ZKHBBJVVQXGQKB-UHFFFAOYSA-N 194.983 -1.077 50 10 AAGE CCOC(=O)NNC(=O)CC(N)=O 379404347 RIQCYQDYBYSUBB-UHFFFAOYSA-N 189.171 -1.361 50 10 AAGE C[C@@]1(CO)C[C@@H](O)CN1C(=O)NN 606260987 JCMSJBAEAVLGDJ-VDTYLAMSSA-N 189.215 -1.613 50 10 AAGE Cc1ccnn(CCC(=O)NN)c1=O 1904835014 HVYLRSDCQBNFNH-UHFFFAOYSA-N 196.210 -1.068 50 10 AAGE N#CN[C@H](CB(O)O)C(=O)O 1953259168 QMCINAIYBGSUHS-GSVOUGTGSA-N 157.922 -2.017 50 10 AAGE CC[C@@H](C(=O)NN)N1CC=C[C@@H](O)C1 1956306180 HPLSVHOBZAJUCD-SFYZADRCSA-N 199.254 -1.012 50 10 AAGE CN(CC(=O)NN)[C@H]1C[C@@H](O)C1 2208979760 QDABUTFFBCXQFZ-OLQVQODUSA-N 173.216 -1.569 50 10 AAGE CC(=O)NC(=O)c1coc(B(O)O)c1 2241470667 BAKHSNIXGCVKNA-UHFFFAOYSA-N 196.955 -1.764 50 10 AAGE O=C(C#CB(O)O)N1CC[C@H]2C[C@@H]2C1 2241479026 PXYYQMOYBBSQST-JGVFFNPUSA-N 193.011 -1.130 50 10 AAGE CN(C(=O)[C@H]1C[C@H]1B(O)O)C1COC1 2241481007 NXWMYVVAXTXRGO-NKWVEPMBSA-N 199.015 -1.294 50 10 AAGE Cc1nn(C)c(B(O)O)c1C(=O)O 2241493617 OTRBMUPHXOTCGJ-UHFFFAOYSA-N 183.960 -1.893 50 10 AAGE CONC(=O)[C@H]1C[C@H](B(O)O)C1 2241495708 LSKBFZKHFQFRQC-URHBZAFASA-N 172.977 -1.083 50 10 AAGE CN1CC(=O)N(CC(=O)NN)C1=O 37388303 TVTXNFXLTKRQEC-UHFFFAOYSA-N 186.171 -2.130 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](O)[C@@H](Cl)[C@H]1O 44608306 CRJLKIILIKSPDH-XKTQNOIPSA-N 198.602 -1.975 50 10 AAGE COC(=O)c1occc1B(O)O 203549938 UICUAAMZSHUTPE-UHFFFAOYSA-N 169.929 -1.254 50 10 AAGE NC/C=C\CB(O)O 211592507 NATPPIYWNHXDTC-UPHRSURJSA-N 114.941 -1.026 50 10 AAGE CO[C@@H](CN)C(=O)NN(C)C 227399112 ZVLBWYFDOPVUPZ-YFKPBYRVSA-N 161.205 -1.447 50 10 AAGE NNC(=O)c1nnnn1N 307365405 MAIOKIYGGQJRAE-UHFFFAOYSA-N 143.110 -3.010 50 10 AAGE CC[C@H](O)C(=O)NNC(=O)CCO 379389423 LMPHOJDFOGAXNF-YFKPBYRVSA-N 190.199 -1.713 50 10 AAGE CN(C)NC(=O)[C-]1C(CN)=C=NN1C 885853987 FWJMRNCNVCQXEK-UHFFFAOYSA-N 196.234 -1.474 50 10 AAGE CCOC(=O)c1c(B(O)O)ncn1C 1887429998 CMYVVHNVFAYBNZ-UHFFFAOYSA-N 197.987 -1.723 50 10 AAGE NNC(=O)[C@@H]1CNC[C@@H](O)C1 1934304501 DXLWWILOJAONHF-WHFBIAKZSA-N 159.189 -2.053 50 10 AAGE COC(=O)c1n[nH]cc1B(O)O 2209048336 GLHIBPIRYNTRNS-UHFFFAOYSA-N 169.933 -2.124 50 10 AAGE C[C@H](CN)Nc1ncc(B(O)O)cn1 2210068519 UHAQORGDVURKFD-RXMQYKEDSA-N 196.019 -2.085 50 10 AAGE CO[C@H]1CCN(C(=O)C#CB(O)O)C1 2241468558 QIPDICNDEUJKKM-ZETCQYMHSA-N 196.999 -1.751 50 10 AAGE CCn1cc(C(=O)NC)nc1B(O)O 2241468933 XGDCDTCOGYKZLV-UHFFFAOYSA-N 197.003 -2.058 50 10 AAGE O=C(C#CB(O)O)N1CCCC1 2241469007 YOAGYDYYZMVFPI-UHFFFAOYSA-N 166.973 -1.376 50 10 AAGE CC(C)(CCO)NC(=O)C#CB(O)O 2241471894 MUAMTZWSGXKNPJ-UHFFFAOYSA-N 199.015 -1.721 50 10 AAGE O=C(NOCCO)[C@H]1C[C@@H]1B(O)O 2241495053 GIOPOTBBQMPZTB-WHFBIAKZSA-N 188.976 -2.111 50 10 AAGE CNNC(=O)[C@H]1C[C@@H]1C(N)=O 2241523578 YUEXWHUAGHTNHW-IMJSIDKUSA-N 157.173 -1.642 50 10 AAGE O=C(CO)Nc1cc(B(O)O)ccn1 2241561892 FHQHJYQXPSXXIE-UHFFFAOYSA-N 195.971 -2.308 50 10 AAGE O=C(NO)c1nccnc1B(O)O 2241584137 JVHSIJOOCWKWBJ-UHFFFAOYSA-N 182.932 -2.725 50 10 AAGE C[C@@H](NC(=O)C(=O)NN)C1CC1 35734199 MQPMSZXVIZBYEK-SCSAIBSYSA-N 171.200 -1.109 50 10 AAGE Cc1nnc(B(O)O)s1 202932000 HEWOHWQICNXZOG-UHFFFAOYSA-N 143.964 -1.474 50 10 AAGE CC(=O)N/N=C/c1cc(=O)[nH]c(=O)[nH]1 238145556 ZGULJTWYTQBQOP-FPYGCLRLSA-N 196.166 -1.467 50 10 AAGE N#CC1=C(C(N)=O)CNC(=O)C1 260277289 AJNGLNRMMVOKJF-UHFFFAOYSA-N 165.152 -1.188 50 10 AAGE NNC(=O)CN1CCC[C@@H](O)CC1 306387128 YUODZJYVHWLHNQ-SSDOTTSWSA-N 187.243 -1.177 50 10 AAGE O/N=C/c1ccc(B(O)O)o1 306935172 HZHNCGMNIFLZES-XVNBXDOJSA-N 154.918 -1.233 50 10 AAGE COc1cc(B(O)O)ncc1F 307315810 ZCMHCTNXOXGDSD-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE C/C(CNNC(N)=O)=N\NC(N)=O 379339434 SHDCOHABLJNIQM-YCRREMRBSA-N 188.191 -1.797 50 10 AAGE COC(C)(C)Cn1ccc(B(O)O)n1 694229384 PITLKAGIHUYGFP-UHFFFAOYSA-N 198.031 -1.012 50 10 AAGE O=C(O)C(=O)NNC1=NCCCN1 723030997 SUDXSKMDCMVDAQ-UHFFFAOYSA-N 186.171 -1.959 50 10 AAGE O=C(NCC#CB(O)O)C1CCC1 1883751032 RKZPUHALQCFHDZ-UHFFFAOYSA-N 181.000 -1.082 50 10 AAGE C[C@@H](CN1CC[C@H]1CO)C(=O)NN 1929741194 PTMDWZBWIYQEMM-BQBZGAKWSA-N 187.243 -1.321 50 10 AAGE C#CCOC(=O)NNCCO 1929841871 MEBYRLVRRHTWNR-UHFFFAOYSA-N 158.157 -1.157 50 10 AAGE CN(C)NC(=O)[C@@H](N)C1COC1 1953518275 GHZNVAAWTFYAAX-LURJTMIESA-N 173.216 -1.447 50 10 AAGE Cc1ncc(B(O)O)c(N2CCC2)n1 1956963431 BVWRTCBNYJOBGB-UHFFFAOYSA-N 193.015 -1.325 50 10 AAGE C[C@@H]1CCN(C(=O)C#CB(O)O)C1=O 2241468758 UKZACOQSMNQRKL-ZCFIWIBFSA-N 194.983 -1.603 50 10 AAGE C[C@@H](CC#N)N(C)C(=O)C#CB(O)O 2241475580 AKEVXIZREAKVTN-ZETCQYMHSA-N 193.999 -1.238 50 10 AAGE O=C(NCC#CB(O)O)c1nc[nH]n1 2241561160 ZMBRBALMABRJMR-UHFFFAOYSA-N 193.959 -2.450 50 10 AAGE O=C(NO)c1sccc1B(O)O 2241584263 LNEZZDDBLQKJIJ-UHFFFAOYSA-N 186.985 -1.453 50 10 AAGE NNC(=O)c1ccoc1C(=O)NN 2559459 ISFCMCJQVIAZMR-UHFFFAOYSA-N 184.155 -1.513 50 10 AAGE NNC(=O)Cn1nnc(N)n1 39136577 PKJDYPLZVPNTDH-UHFFFAOYSA-N 157.137 -2.755 50 10 AAGE CNP1(=O)N(C)[C@@H](O)[C@H](O)N1C 149668107 WJJKYFISDLEYGE-WHFBIAKZSA-N 195.159 -1.172 50 10 AAGE CC(=O)c1cccc(B(O)O)n1 222888543 UDFPRNLNRGKSLO-UHFFFAOYSA-N 164.957 -1.036 50 10 AAGE OB(O)c1cnc2c(c1)OCCN2 238655401 NBFBJRZMBRYVJG-UHFFFAOYSA-N 179.972 -1.434 50 10 AAGE O=C(CO)NNCCO 238705827 SWJCVTOXQDBLHU-UHFFFAOYSA-N 134.135 -2.408 50 10 AAGE COC(=O)[C@H](N)CSCB(O)O 238800208 GDPLIWJTYUSNFS-SCSAIBSYSA-N 193.033 -1.768 50 10 AAGE NNC(=O)[C@@H](N)CC(F)F 307446997 XHAHPGXXDDUDQP-REOHCLBHSA-N 153.132 -1.041 50 10 AAGE O=CNNC(=O)C1=COCCO1 307506789 YSGMSMDCBULGAW-UHFFFAOYSA-N 172.140 -1.348 50 10 AAGE Cc1cn(C)nc1NC(=O)C(=O)NN 606271671 YRTMWNSMGJFPFE-UHFFFAOYSA-N 197.198 -1.343 50 10 AAGE CCCOCn1ccc(B(O)O)n1 709763737 WNVKBDXITWDWFX-UHFFFAOYSA-N 184.004 -1.053 50 10 AAGE O=C(F)N[C@@H]1C[C@H](O)[C@@H](O)[C@H]1O 1881051318 LJBUFLRSGWYIIJ-MGCNEYSASA-N 179.147 -1.480 50 10 AAGE C[C@@]1(B(O)O)CCN(CC#CCO)C1 1891539873 UGOQQKNPUOGLTF-SECBINFHSA-N 197.043 -1.079 50 10 AAGE C[C@@H](C(=O)NN)N1CCN(C)[C@@H]2C[C@@H]21 1956635684 CSCVVKQZNSXIEO-RNJXMRFFSA-N 198.270 -1.247 50 10 AAGE C[C@H](CN)Nc1ccc(B(O)O)cn1 2210059772 CXIDLIOFSOAUCR-ZCFIWIBFSA-N 195.031 -1.480 50 10 AAGE CN(C)C(=O)c1cn(C)c(B(O)O)n1 2241468942 XKQPEIPSONQUPZ-UHFFFAOYSA-N 197.003 -2.198 50 10 AAGE O[C@@H]1[C@@H](CCl)O[C@@H](O)[C@H](O)[C@H]1O 29309379 QMWDIHPSUCUMFU-VFUOTHLCSA-N 198.602 -1.975 50 10 AAGE [C-]#[N+][C@]12O[C@H]1[C@@](O)([C@H](C)O)[C@@H]1O[C@@H]12 85554801 GVXPCFBDZAWTNL-NOVZGDRXSA-N 183.163 -1.106 50 10 AAGE Nc1ncc(B(O)O)cc1[N+](=O)[O-] 199943600 GPMNETPXNZTJOM-UHFFFAOYSA-N 182.932 -1.748 50 10 AAGE NC(=O)NNC(=O)[C@@H]1CCC(=O)N1 575562489 CUVOJBBZJZZDFJ-VKHMYHEASA-N 186.171 -2.036 50 10 AAGE CS(=O)(=O)C[C@@H](N)C(=O)NN 1886378441 SDXPBKQWVNXNDT-GSVOUGTGSA-N 181.217 -2.652 50 10 AAGE N#C[C@@H](O)[C@@H](N)CCN1CCOCC1 1953040255 IMJQTNNZHQLMKD-DTWKUNHWSA-N 199.254 -1.080 50 10 AAGE C[C@@H](O)[C@H](N)C(=O)NN(C)C 1953344051 APOPFPMGCYSXQC-UHNVWZDZSA-N 161.205 -1.713 50 10 AAGE CNC(=O)[C@H](C)NC(=O)C#CB(O)O 2241478736 KXFDZWWWHNKMAR-YFKPBYRVSA-N 197.987 -2.748 50 10 AAGE NNC(=O)c1cccc(F)c1B(O)O 2241478953 OFZSMKXFLJCXAZ-UHFFFAOYSA-N 197.962 -1.891 50 10 AAGE Cn1cc(B(O)O)c(C(N)=O)n1 2241479889 BXTDVOKKMOTQFV-UHFFFAOYSA-N 168.949 -2.801 50 10 AAGE NNC(=O)c1cc(B(O)O)sn1 2241480907 PLGCFJOJTHCLNU-UHFFFAOYSA-N 186.989 -2.574 50 10 AAGE N#CNCC#CB(O)O 2241555955 RUKFBUJNUHKXBW-UHFFFAOYSA-N 123.908 -1.928 50 10 AAGE C[C@@H](CC(=O)O)NC(=O)C#CB(O)O 2241585095 YDEBYFLKYZTPAZ-YFKPBYRVSA-N 198.971 -2.019 50 10 AAGE O=C(NO)c1cnsc1B(O)O 2297002878 VXBRVXCYJSGOSF-UHFFFAOYSA-N 187.973 -2.058 50 10 AAGE NC(=O)NC=C(C=O)C=O 104656111 AYHCQKHWIQISMD-UHFFFAOYSA-N 142.114 -1.064 50 10 AAGE COc1ccnc(B(O)O)n1 203795047 YPTJPHPBMLOGPG-UHFFFAOYSA-N 153.934 -1.835 50 10 AAGE COc1ccnc(N)c1B(O)O 238385046 QGJCEOKISGVDEC-UHFFFAOYSA-N 167.961 -1.648 50 10 AAGE NNC(=O)[C@@H]1CO[C@@H](CCO)C1 238554877 JFWGSCGSYHKHOX-WDSKDSINSA-N 174.200 -1.236 50 10 AAGE OB(O)C1COC1 306684642 IJUXOGWEQARFHD-UHFFFAOYSA-N 101.898 -1.140 50 10 AAGE OB(O)c1ccc(-n2nccn2)cc1 306755785 QTSFFAMXXWSKRY-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE NNc1c(C=O)cccc1B(O)O 307019999 ZAVXTUOIKDHFPT-UHFFFAOYSA-N 179.972 -1.536 50 10 AAGE CO[C@@H](CCN)C(=O)NN(C)C 401330214 MZKWWGADVKPSDY-LURJTMIESA-N 175.232 -1.057 50 10 AAGE NNC(=O)C1=C=C(O)N[N]1 642855185 MURQJYZYARIJNC-UHFFFAOYSA-N 141.110 -2.019 50 10 AAGE O=C(NCB(O)O)C1[C@@H]2COC[C@@H]12 702017029 FJVMOPUNVJQHGW-RFZPGFLSSA-N 184.988 -1.993 50 10 AAGE COCC[C@@H](C)C(=O)NCB(O)O 702018628 XCBFBZCFGHJADZ-ZCFIWIBFSA-N 189.020 -1.213 50 10 AAGE C[C@H]1C[C@@H](C(=O)NCB(O)O)CO1 702028836 HPGGONVLOAYLOF-NTSWFWBYSA-N 187.004 -1.460 50 10 AAGE CN(C)NC(=O)c1cc(NN)ncn1 723234853 MXWQFLKXYYGWTB-UHFFFAOYSA-N 196.214 -1.031 50 10 AAGE COc1c(B(O)O)c(C)nn1C 1934736369 IDVHPRVXKZJYLB-UHFFFAOYSA-N 169.977 -1.583 50 10 AAGE NCCONc1ccc(B(O)O)cn1 2210061454 UXLJTDWTMNWURA-UHFFFAOYSA-N 197.003 -1.936 50 10 AAGE O=C(C#CB(O)O)N1CC=C(F)C1 2241479441 YDPZGJMPEVXESP-UHFFFAOYSA-N 182.947 -1.303 50 10 AAGE CC[C@@H](NC(=O)C#CB(O)O)[C@H](C)O 2241479511 ZNUCMCUFYJDPSY-NKWVEPMBSA-N 199.015 -1.723 50 10 AAGE O=C(O)C=CC(=O)NCB(O)O 2242201243 HZHNRTZNSFPFMC-UHFFFAOYSA-N 172.933 -2.245 50 10 AAGE NNC(=O)N1CCO[C@@H](CO)C1 88093013 LYNSHWQQZCIGAO-RXMQYKEDSA-N 175.188 -1.737 50 10 AAGE CC[C@@H](O)C(=O)NN(C)C(N)=O 308001589 ZWZXLFXOVZWZBJ-SCSAIBSYSA-N 175.188 -1.201 50 10 AAGE NC[C@H]1C[C@H]1C(=O)NN 715104671 FMQZVGAWTYRYCY-QWWZWVQMSA-N 129.163 -1.429 50 10 AAGE NNC(=O)CN1C[C@H]2CC[C@H](O2)C1=O 725607271 HIYFCRBTSCPUSH-RITPCOANSA-N 199.210 -1.634 50 10 AAGE COC[C@H]1C[C@H]1C(=O)NCB(O)O 1882998797 YDOVNIYIEMDZKD-PHDIDXHHSA-N 187.004 -1.603 50 10 AAGE C[C@H](O)[C@H]1CN(C(=O)NN)CCO1 1954189022 ILMPGQFRAAVLMC-NTSWFWBYSA-N 189.215 -1.349 50 10 AAGE OCCNc1ncccc1B(O)O 2209385816 BDCMCCFQBOJCJE-UHFFFAOYSA-N 181.988 -1.834 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1COC[C@@H]1O 2241471896 MVFKIVAFWSEKJA-RITPCOANSA-N 198.971 -3.122 50 10 AAGE CN(CC(N)=O)C(=O)NN 37269427 RPGKZFUEPBSYIJ-UHFFFAOYSA-N 146.150 -2.013 50 10 AAGE N#CC1=NOC(N)=C(C#N)[C@H]1N 45823777 HIYLQRULKNJCFQ-RXMQYKEDSA-N 163.140 -1.083 50 10 AAGE NC(=O)N/N=C/[C@@H](O)CO 104080449 RMMPYGPFOXKUJK-CLJVALOKSA-N 147.134 -2.006 50 10 AAGE NC(=O)N[C@@H](CB(O)O)C(=O)O 195029464 RMUZQPHRHCHJFW-REOHCLBHSA-N 175.937 -2.419 50 10 AAGE Cc1nccn(CCC(=O)NN)c1=O 306300905 VNFHLBDACJJYKS-UHFFFAOYSA-N 196.210 -1.068 50 10 AAGE NNC(=O)[C@@H]1CCCCn2nnnc21 306317113 DXTNJSQYCUTXDZ-RXMQYKEDSA-N 196.214 -1.070 50 10 AAGE O[C@H]1[C@@H](CCl)NC[C@@H](O)[C@H]1O 306724233 UJTPCYUIJJZFFA-ARQDHWQXSA-N 181.619 -1.720 50 10 AAGE CC(C)NC(=O)NCB(O)O 575563802 VHQKIUFPFNIOCI-UHFFFAOYSA-N 159.982 -1.294 50 10 AAGE CN(N)C(=O)c1cn(C)nn1 704676550 QPSBAJAGFCFYCU-UHFFFAOYSA-N 155.161 -1.239 50 10 AAGE CN1C(=O)OC[C@@H]1C(=O)NN 876788624 GMSMXZGMRKCMBF-GSVOUGTGSA-N 159.145 -1.573 50 10 AAGE CC=CC(=O)NCB(O)O 1880008785 HYUTVKAYEFVXGV-UHFFFAOYSA-N 142.951 -1.309 50 10 AAGE C[C@@H](C(=O)NN)N1CC=C[C@H]1CO 1881715524 PKMCFVPLABZEHF-BQBZGAKWSA-N 185.227 -1.403 50 10 AAGE C=CCN=c1cc(B(O)O)c(F)c[nH]1 1892557072 LIHOPQFQPQYFHZ-UHFFFAOYSA-N 195.990 -1.080 50 10 AAGE NNC(=O)N1CCC2(CC1)CC(=O)N2 1907220250 ARGYQGNQZYHDLD-UHFFFAOYSA-N 198.226 -1.076 50 10 AAGE O=C(CCCF)NCB(O)O 1923804808 YCUGEVZKQGGRNU-UHFFFAOYSA-N 162.957 -1.136 50 10 AAGE N#C[C@H](O)[C@@H](N)[C@@H]1CCNC(=O)C1 1952898244 XXSJKZQOKJATMA-CHKWXVPMSA-N 183.211 -1.276 50 10 AAGE O=C(C#CB(O)O)NC1(CO)CC1 2241479444 YEAJLUBEFNQODI-UHFFFAOYSA-N 182.972 -2.357 50 10 AAGE O=C(N1CCCN1)C1(B(O)O)CC1 2241480832 MOHKFUIKBMQIIO-UHFFFAOYSA-N 184.004 -1.270 50 10 AAGE NNC(=O)[C@H]1CCN(N)C1=O 5517275 AXVBTMVGNUGLEM-GSVOUGTGSA-N 158.161 -2.302 50 10 AAGE NNC(=O)CN1CCOC[C@H]1CO 123898779 YFPFJWUUQYVGLF-ZCFIWIBFSA-N 189.215 -2.331 50 10 AAGE OB(O)c1nccc(O)c1F 306955331 ADPDSWLXKJRIQX-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE O=C(NCB(O)O)[C@H]1CCCCO1 702028223 DJBUHIKAXDKWGC-ZCFIWIBFSA-N 187.004 -1.316 50 10 AAGE NC[C@H]1[C@@H](C(=O)NN)C1(F)F 715076688 BPIFNSQLKITELD-HRFVKAFMSA-N 165.143 -1.184 50 10 AAGE NNC(=O)CN1C#C[C-](C2CC2)N1 885375596 CIXXCZCEBFXZQD-UHFFFAOYSA-N 179.203 -1.301 50 10 AAGE CC(=O)NNC(=O)Cn1nnc(N)n1 1440720777 FRBKNMIQFLQWMW-UHFFFAOYSA-N 199.174 -2.577 50 10 AAGE O=C(NNCCO)c1cnns1 1929832259 PLMIXRMCFVTNAL-UHFFFAOYSA-N 188.212 -1.235 50 10 AAGE NNC(=O)CN1C[C@H]2OCC[C@@H]2C1 1954075994 YFJQNVVAAVEIGJ-RNFRBKRXSA-N 185.227 -1.303 50 10 AAGE NNC(=O)CN1C[C@H]2OCC[C@H]2C1=O 1956911634 ODICQVFUBHDCEG-PHDIDXHHSA-N 199.210 -1.776 50 10 AAGE CCNC1CN(C(=O)C#CB(O)O)C1 2241478238 AWWORWAXZGBJKV-UHFFFAOYSA-N 196.015 -2.178 50 10 AAGE CS(=O)(=O)NCC(=O)NN 6850105 BOKIIKHXAALGHV-UHFFFAOYSA-N 167.190 -2.475 50 10 AAGE CC[C@H](CO)NC[C@H](C)C(=O)NN 58852183 PVVFGZPBSULDHN-NKWVEPMBSA-N 189.259 -1.027 50 10 AAGE O=C[C@@H]1NC(=O)OC1=O 104709918 NOUSLRPODKOLKT-REOHCLBHSA-N 129.071 -1.180 50 10 AAGE CN(C)NC(=O)Cn1cnc(N)n1 133879885 BECNNXLUTFJUMV-UHFFFAOYSA-N 184.203 -1.547 50 10 AAGE NNC(=O)c1ncno1 139113594 WVHJJMJKDZCXFX-UHFFFAOYSA-N 128.091 -1.327 50 10 AAGE Cn1nnc(-c2cc(B(O)O)on2)n1 716784755 TWAFGSQGOMANPB-UHFFFAOYSA-N 194.947 -2.455 50 10 AAGE O=C(NCC#CB(O)O)[C@@H]1C[C@H]1CF 1877556140 MHGFREFAQBNTEO-NKWVEPMBSA-N 198.990 -1.276 50 10 AAGE C[C@@H]1[C@@H](O)CN1C(=O)NN 1880046591 ALGQDOIMBPDEQS-DMTCNVIQSA-N 145.162 -1.365 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]1CF 1880965531 ZABVYECQUFOZFJ-BYPYZUCNSA-N 175.163 -1.453 50 10 AAGE C[C@H](C(=O)NN)N1CC2(CC(O)C2)C1 1928569832 MWFJAJIAMBEPDX-ZCFIWIBFSA-N 199.254 -1.179 50 10 AAGE O=C(CCn1cncn1)NNCCO 1929834594 DSRWPQDXBMSXKT-UHFFFAOYSA-N 199.214 -1.719 50 10 AAGE NNC(=O)N1CC([C@H](F)CO)C1 1953375044 FEQMPLAIWXBGHL-RXMQYKEDSA-N 177.179 -1.168 50 10 AAGE C[C@H](F)CN=c1ncc(B(O)O)c[nH]1 2210067538 AGRBSWMQDBVPAQ-YFKPBYRVSA-N 198.994 -1.652 50 10 AAGE O=C(C#CB(O)O)N1C[C@H]2C[C@@H]2C1=O 2241478839 MAHRCQFEBSTEDX-RITPCOANSA-N 192.967 -1.993 50 10 AAGE COC(=O)c1nccnc1B(O)O 2241505892 LIWMPGQHJSTMNK-UHFFFAOYSA-N 181.944 -2.057 50 10 AAGE C[C@@H](ON)C(=O)NN 139842483 SLBIDTMQFDOOIP-UWTATZPHSA-N 119.124 -1.745 50 10 AAGE NNC(=O)c1cn2c(nc1=O)CCC2 144400540 BFWIEFMIJQMCCG-UHFFFAOYSA-N 194.194 -1.207 50 10 AAGE O=CNc1cccc(B(O)O)c1 201118495 NBCSHLZUEWFNQN-UHFFFAOYSA-N 164.957 -1.065 50 10 AAGE O=CNc1ccc(B(O)O)cc1 208614485 NGEUUNZJMUSZFZ-UHFFFAOYSA-N 164.957 -1.065 50 10 AAGE CN(C)NC(=O)[C@H](O)C(C)(C)CO 231479089 SHJWKXIBXIGJAP-LURJTMIESA-N 190.243 -1.041 50 10 AAGE COc1cnc(N)c(B(O)O)c1 238339011 UTTVHSOOASFSJP-UHFFFAOYSA-N 167.961 -1.648 50 10 AAGE CN1CC[C@H]([C@H](N)CC(=O)NN)C1 259017128 IGQOGBXRRFVNGG-NKWVEPMBSA-N 186.259 -1.355 50 10 AAGE O=Cc1cccnc1B(O)O 306654677 KAEJKFCLHNKYPZ-UHFFFAOYSA-N 150.930 -1.426 50 10 AAGE COC(=O)N(C)CC(=O)NNC=O 308311076 ROVDJOYYYQWAOX-UHFFFAOYSA-N 189.171 -1.538 50 10 AAGE C[C@@H](C(=O)O)[S@](=O)CC(=O)NN 526848164 LQKFYDYSRRLIOJ-UCWKHXCOSA-N 194.212 -1.802 50 10 AAGE NC(=O)NNC(=O)c1cnc[nH]1 575562457 ZDYWZXIIMQWPPQ-UHFFFAOYSA-N 169.144 -1.277 50 10 AAGE CC(=O)NNC(=O)c1ccc(O)nn1 1540576207 CTMIPFCJYMLCAB-UHFFFAOYSA-N 196.166 -1.037 50 10 AAGE Cc1cc(B(O)O)c(O)nn1 1880296498 FWIJVPKAPXUKTP-UHFFFAOYSA-N 153.934 -1.830 50 10 AAGE NNC(=O)N1CC(CO)(CO)C1 1914999023 ZXVTYSKQXJUERR-UHFFFAOYSA-N 175.188 -2.144 50 10 AAGE CN(NC1=N[C@@H]2C[C@H]2N1)C(N)=O 1923850165 FPSYPJJZDBNKSG-QWWZWVQMSA-N 169.188 -1.398 50 10 AAGE C#CC[C@@H](C)CNC(=O)C#CB(O)O 2241468488 PGAPVWZTJGFQSU-MRVPVSSYSA-N 193.011 -1.223 50 10 AAGE C[C@H](NC(=O)C#CB(O)O)C(N)=O 2241478915 NNSZHLNBMDIOBL-BYPYZUCNSA-N 183.960 -3.008 50 10 AAGE O=C(NO)c1ccncc1B(O)O 2241585050 XPBKPKWKVMVWCY-UHFFFAOYSA-N 181.944 -2.120 50 10 AAGE NNC(=O)Cn1ccnc1[N+](=O)[O-] 13211736 HKYQJLPUAUBOJC-UHFFFAOYSA-N 185.143 -1.219 50 10 AAGE COCC[C@H](N)C(=O)NN 69635651 IZATWBCUUPFFNS-BYPYZUCNSA-N 147.178 -1.660 50 10 AAGE NC(=O)NNc1nc(N)nc(N)n1 114003450 JHEXGENUDVZLKI-UHFFFAOYSA-N 184.163 -1.969 50 10 AAGE OC[C@]1(O)O[C@H](CCl)[C@H](O)[C@H]1O 306717074 HERFDENCNURSOX-MOJAZDJTSA-N 198.602 -1.973 50 10 AAGE NNC(=O)N1CC[C@@H](NC(N)=O)C1 575463719 VNHNLGQLJLSXPL-SCSAIBSYSA-N 187.203 -1.688 50 10 AAGE F[C@H]1N[C@@H]2NCN[C@@H]2[C@@H](Cl)N1 585665079 YUWXBIKQJLXUBV-MGCNEYSASA-N 180.614 -1.158 50 10 AAGE C=CCOC(=O)NCB(O)O 701938580 NCTJCKDHQWMWJE-UHFFFAOYSA-N 158.950 -1.089 50 10 AAGE C[C@H](NC(N)=O)C(=O)N(C)N 704675670 AZCVFPGFGVJRBO-VKHMYHEASA-N 160.177 -1.625 50 10 AAGE Cc1conc1CNC(=O)C(=O)NN 708274288 LITDEUJGIRENAA-UHFFFAOYSA-N 198.182 -1.411 50 10 AAGE NNC(=O)[C@@H]1CC[C@H]1N 1878054281 NGDPOIJXMQMDPC-QWWZWVQMSA-N 129.163 -1.286 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2C[C@H](O)[C@H]1C2 1884635100 PNAKZEPMSADYTR-XUTVFYLZSA-N 199.254 -1.180 50 10 AAGE NNC(=O)CN1C[C@@H]2CC[C@@]2(CO)C1 1896244970 FJOSYJZJXAPCBG-CBAPKCEASA-N 199.254 -1.319 50 10 AAGE COC[C@H](C)Cn1cc(B(O)O)cn1 1896851667 QFZHVUIWOUWGFC-SSDOTTSWSA-N 198.031 -1.155 50 10 AAGE COC(=O)[C@@H](N)CC(=O)NN(C)C 1913918750 NJEGCVNMGOBCEP-YFKPBYRVSA-N 189.215 -1.530 50 10 AAGE NNC(=O)N1CC[C@H](O)[C@@H](O)CC1 2241587179 JTLPUPNMMHNJNU-WDSKDSINSA-N 189.215 -1.613 50 10 AAGE Cc1cc(B(O)O)cnc1C(=O)NO 2241650055 HAYBUXUPIGRHRH-UHFFFAOYSA-N 195.971 -1.811 50 10 AAGE N[C@]1(B(O)O)C[C@H]2CO[C@H]1C2 2241835599 LICIJAFMAASRMG-HCWXCVPCSA-N 156.978 -1.495 50 10 AAGE NNC(=O)[C@]12CCO[C@@H]1CNC2 2242596792 KDZOGGXREMVFFU-VDTYLAMSSA-N 171.200 -1.645 50 10 AAGE C[C@H](NC(=O)NN)C(=O)NC1CC1 162623103 AMCRWZPZEAINEB-BYPYZUCNSA-N 186.215 -1.174 50 10 AAGE C[C@@H](NC(=O)[C@@H]1CCN1)B(O)O 211473252 ZALBOCKDQLQEQV-UHNVWZDZSA-N 171.993 -2.135 50 10 AAGE CCC(=N)NNC(=O)CO 238187113 BIOZTJZLWZJNBO-UHFFFAOYSA-N 145.162 -1.013 50 10 AAGE CC(=O)N[C@@]1(C(=O)NN)CCOC1 306163938 UTAWUFVDEMYQFY-ZETCQYMHSA-N 187.199 -1.729 50 10 AAGE Cc1cccc(B(O)O)c1NN 307055048 SDUMRMAZXPVLBW-UHFFFAOYSA-N 165.989 -1.040 50 10 AAGE C[C@@H](CCC(=O)NN)N1CC(O)C1 384104240 FWDFXAKPAMKPPU-LURJTMIESA-N 187.243 -1.179 50 10 AAGE CN(N)C(=O)Cn1cnnn1 704680439 ALJWRYNGPUCPQK-UHFFFAOYSA-N 156.149 -1.995 50 10 AAGE CN1CCOC[C@@H]1CNC(=O)NN 1329052866 DEGWZYNAEAHQQC-LURJTMIESA-N 188.231 -1.510 50 10 AAGE C[C@@H](N)CNC(=O)C1(B(O)O)CC1 2241474070 VXHZIDXSYCXLEW-RXMQYKEDSA-N 186.020 -1.543 50 10 AAGE CO[C@@H]1CC[C@@H]1NC(=O)C#CB(O)O 2241478424 FAGJCKIPEKKZMT-NKWVEPMBSA-N 196.999 -1.705 50 10 AAGE NC[C@@H]1CCN1C(=O)[C@H]1C[C@@H]1B(O)O 2241494890 FPDQIWHBEQVMDP-ACZMJKKPSA-N 198.031 -1.591 50 10 AAGE C#CCN(OC)C(=O)[C@H]1C[C@H]1B(O)O 2241780123 HJOJDACRVKYXHD-NKWVEPMBSA-N 196.999 -1.128 50 10 AAGE C#CCCC(=O)NCCC#CB(O)O 2241907440 DMJAERQTSBJLRW-UHFFFAOYSA-N 193.011 -1.079 50 10 AAGE C/C(CN)=N\NC(N)=O 17326218 WOCATSRKZVWDLR-XVNBXDOJSA-N 130.151 -1.011 50 10 AAGE CC[C@@H](C(=O)NN)N(C)CC(N)=O 82467303 MKRRGFNRIQDOCF-YFKPBYRVSA-N 188.231 -1.828 50 10 AAGE CNC(=O)/C(C=O)=C\N 104637280 CKVUBDANHVSWQF-RQOWECAXSA-N 128.131 -1.226 50 10 AAGE OB(O)c1ccnc2c1COCC2 206055605 OUFISJNWMRYNFI-UHFFFAOYSA-N 178.984 -1.166 50 10 AAGE CNNC(=O)[C@H](N)[C@H]1CCN(C)C1 259017179 IHCWDTPQHRJYOS-NKWVEPMBSA-N 186.259 -1.484 50 10 AAGE NNC(=O)[C@@H](N)Cc1ccc[nH]1 259041410 SZPJTGPOCXIFMB-LURJTMIESA-N 168.200 -1.126 50 10 AAGE NNC(=O)C(=O)NCC1[C@@H]2COC[C@@H]12 307475701 KTBJPKCKKGWFEP-WDSKDSINSA-N 199.210 -2.015 50 10 AAGE N[C@H]1N[C@H]2NNC[C@@H]2[C@@H](Cl)N1 585662266 QYRCJANPAITLMO-MGCNEYSASA-N 177.639 -1.964 50 10 AAGE CCc1nc(C(=O)NNC(N)=O)n[nH]1 700863935 CZNVNEIVWMCLPP-UHFFFAOYSA-N 198.186 -1.320 50 10 AAGE O=C(O)c1cc(B(O)O)n2c1CCC2 723846792 ZDCLQSZWDHUTJV-UHFFFAOYSA-N 194.983 -1.188 50 10 AAGE CO[C@H]1CC[C@H]1NC(=O)C(=O)NN 724376980 UJBPEFPNYSVPJN-UHNVWZDZSA-N 187.199 -1.730 50 10 AAGE OB(O)c1cnn(C[C@@H]2CCO2)c1 1888592890 ZCBCCGPHTAIMBY-ZETCQYMHSA-N 181.988 -1.648 50 10 AAGE NNC(=O)[C@]1(CO)CCNC1 1953253525 UTFYJACDMOKAAU-ZCFIWIBFSA-N 159.189 -2.052 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1C[C@@H]2C[C@@H]2C1 2241468070 GVUVSKBSZHZFSF-JIGDXULJSA-N 193.011 -1.084 50 10 AAGE C[C@@H]1[C@H](NC(=O)C#CB(O)O)[C@@H]1C 2241468766 UMRXLVYCZNMFCI-UQWHLADISA-N 181.000 -1.228 50 10 AAGE CNC(=O)c1c(B(O)O)c(C)nn1C 2241479155 SIJFQPCPTCKKQD-UHFFFAOYSA-N 197.003 -2.232 50 10 AAGE C[C@@H](CN)NC(=O)C1(B(O)O)CC1 2241481003 NWCAVRIVUIEISE-YFKPBYRVSA-N 186.020 -1.543 50 10 AAGE NNC(=O)NCCC[C@H](N)C(=O)O 39148286 LPUBHSFTABCRSV-BYPYZUCNSA-N 190.203 -1.649 50 10 AAGE NNC(=O)CN1CCCNC(=O)C1 83748016 AVLUUYITVSPCJD-UHFFFAOYSA-N 186.215 -2.202 50 10 AAGE CSC[C@H](N)C(=O)NN 104655628 SWZOHYFSAGJGAX-VKHMYHEASA-N 149.219 -1.333 50 10 AAGE CN(C)NC(=O)C[C@@H]1CNCCO1 147262631 JPSFUIUXMGGPPE-SSDOTTSWSA-N 187.243 -1.042 50 10 AAGE OCc1ccc(B(O)O)cc1CO 204719043 DSBYPEMHADNMAE-UHFFFAOYSA-N 181.984 -1.649 50 10 AAGE CN(C)NC(=O)[C@@H]1CNC(=O)CN1 230904674 VNOCFBUEXUCJDK-YFKPBYRVSA-N 186.215 -2.333 50 10 AAGE NNC(=O)Cc1c(N)[nH][nH]c1=O 238659565 MNJXWHCQMMIVOZ-UHFFFAOYSA-N 171.160 -2.182 50 10 AAGE OB(O)C1=CNN2CCCN=C12 306451754 LZAXRZVGRQGDCD-UHFFFAOYSA-N 166.977 -1.495 50 10 AAGE NNC(=O)CN1CCN2CC[C@H]1C2 306697728 CAYWMZYSUFTVSR-ZETCQYMHSA-N 184.243 -1.634 50 10 AAGE NNc1cc(B(O)O)ccc1[N+](=O)[O-] 306728562 BUBYLBUFVMTOPV-UHFFFAOYSA-N 196.959 -1.440 50 10 AAGE CC(=O)NCC(=O)NNC(N)=O 700869664 RKHWLDXIHHSOEN-UHFFFAOYSA-N 174.160 -2.178 50 10 AAGE C[C@@H](F)CCNC(=O)C(=O)NN 702582392 MHNSUCHWWWJUPQ-SCSAIBSYSA-N 177.179 -1.159 50 10 AAGE Cn1nncc1C=CB(O)O 1880129246 BCYXBUWLKRXYNA-UHFFFAOYSA-N 152.950 -1.160 50 10 AAGE NNC(=O)C(=O)N[C@@H]1[C@@H]2CCO[C@H]21 1881744692 GOBIAPBVRRWQEW-VPENINKCSA-N 185.183 -2.120 50 10 AAGE O=S1(=O)CCC[C@H]1B(O)O 1935062588 SKKSQIRLKHJTRQ-BYPYZUCNSA-N 163.991 -1.424 50 10 AAGE NNC(=O)N1CC([C@@H](F)CO)C1 1953375045 FEQMPLAIWXBGHL-YFKPBYRVSA-N 177.179 -1.168 50 10 AAGE CC(C)([C@@H](N)B(O)O)S(C)(=O)=O 1953375097 FYBWDSJQLPKUJB-SCSAIBSYSA-N 195.049 -1.851 50 10 AAGE CO[C@H]1C[C@@](N)(B(O)O)C[C@H]1OC 1954090528 ZODWABVUJHCXIC-KVSKUHBBSA-N 189.020 -1.480 50 10 AAGE NCCSc1ncc(B(O)O)cn1 2209386289 DMEGLMDUDFYSQY-UHFFFAOYSA-N 199.044 -1.793 50 10 AAGE C#CCCOc1ncc(B(O)O)cn1 2210063480 ASTAELDWZSGZJO-UHFFFAOYSA-N 191.983 -1.442 50 10 AAGE Cc1cnc(OCCN)cc1B(O)O 2210064842 KCMFFEQGHVYKTK-UHFFFAOYSA-N 196.015 -1.593 50 10 AAGE O=C(C#CB(O)O)N1CC(O)C1 2241468841 VRHUBXBPXMCKBT-UHFFFAOYSA-N 168.945 -2.795 50 10 AAGE O=C(NN1CCC1)C1CC(B(O)O)C1 2241475458 XZHGVVBBXXHVKI-UHFFFAOYSA-N 198.031 -1.024 50 10 AAGE CON(C(=O)C#CB(O)O)C1CCC1 2241478437 FFASKIVXRZKHIX-UHFFFAOYSA-N 196.999 -1.056 50 10 AAGE C[C@@H](CCO)CNC(=O)C#CB(O)O 2241478627 JDAAOLOIZFWDHS-ZETCQYMHSA-N 199.015 -1.864 50 10 AAGE Cc1c(B(O)O)csc1C(N)=O 2241480862 OXJSKQQHALJPQZ-UHFFFAOYSA-N 185.013 -1.165 50 10 AAGE O=CNCc1sccc1B(O)O 2241554589 FIIJJLSPSBFCTQ-UHFFFAOYSA-N 185.013 -1.326 50 10 AAGE NC(=O)NC(=O)[C@H]1C[C@H](B(O)O)C1 2241584725 SFCHHTLESKYRFO-JPYJGEKTSA-N 185.976 -1.566 50 10 AAGE CCn1cc(B(O)O)c(OC)n1 2241923941 PAYPNNZZZMFGBU-UHFFFAOYSA-N 169.977 -1.409 50 10 AAGE CSCCCNC(=O)C(=O)NN 69016434 WTGFTQNXWNTRNH-UHFFFAOYSA-N 191.256 -1.154 50 10 AAGE CNC(=O)NNC(C)=O 104084140 UJPNVPORJWYCQN-UHFFFAOYSA-N 131.135 -1.034 50 10 AAGE NNC(=O)[C@H](O)C1CC1 143066773 HSOXOSXOKBEILN-SCSAIBSYSA-N 130.147 -1.253 50 10 AAGE N[C@H](CNC(=O)CCl)C(=O)O 199351111 FOJRYNHRKWPSMC-GSVOUGTGSA-N 180.591 -1.247 50 10 AAGE NNC(=O)C(=O)N1C[C@H](O)[C@@H](O)C1 236213868 SOIPAYJKNUSSGT-IMJSIDKUSA-N 189.171 -3.460 50 10 AAGE CC(C)NNC(=O)[C@H](CO)N(C)C 238197207 RRUVGXSWKQXBJR-ZETCQYMHSA-N 189.259 -1.062 50 10 AAGE CS(=O)(=O)C/C=N/NC(N)=O 238416327 RYTRLKBTVLFOLW-QHHAFSJGSA-N 179.201 -1.315 50 10 AAGE CNC(=O)NNS(=O)(=O)C1CC1 306492783 RQEJCHDTFCIQSS-UHFFFAOYSA-N 193.228 -1.088 50 10 AAGE Cn1nnc(NC(=O)C(=O)NN)n1 306720637 HIGLCJBDYGWHDG-UHFFFAOYSA-N 185.147 -2.862 50 10 AAGE NC(=O)NN=C1C=NN(C(N)=O)C1=O 308276317 NKNALVFYOUJTDA-UHFFFAOYSA-N 198.142 -2.083 50 10 AAGE OOBc1cc[nH]n1 725327174 LSKPFBNVLAPRHS-UHFFFAOYSA-N 111.897 -1.124 50 10 AAGE C[C@H](N)C(=O)NNC(=O)C1=NCC=C1 725570137 MFOWRXUOVCPGDL-YFKPBYRVSA-N 196.210 -1.508 50 10 AAGE OB(O)c1cn(-c2ccccc2)nn1 1885687293 HLUCDXNFEDQYOD-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE OB(O)C=Cc1nnc2n1CCOC2 1911738108 SPXQIYUCNAGLQD-UHFFFAOYSA-N 194.987 -1.167 50 10 AAGE C[C@@H](NC(=O)NNCCO)C(=O)O 1935203721 SYOQDIDTQVRVFG-SCSAIBSYSA-N 191.187 -1.744 50 10 AAGE N#C[C@H](O)[C@H]1COCCN1 1953171696 OQQHMKPUEGIBTH-RITPCOANSA-N 142.158 -1.141 50 10 AAGE NNC(=O)[C@]12C[C@@H](N)[C@@H]1C2 1953189871 UFECFSPTYHDILU-MRKVFDINSA-N 141.174 -1.286 50 10 AAGE N[C@H](B(O)O)[C@H]1C[C@H]2CC[C@H]1O2 1953416717 CUIKLNIGZMORKE-UCROKIRRSA-N 171.005 -1.107 50 10 AAGE CCONC(=O)[C@H]1C[C@@H]1B(O)O 2241479158 SIZKUGSKPYWEJO-WHFBIAKZSA-N 172.977 -1.083 50 10 AAGE C#CCC(=O)NCC#CB(O)O 2241556623 ZCIHYDZONOZAFV-UHFFFAOYSA-N 164.957 -1.859 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2C[C@H](C1)[C@@H]2O 2241815233 PHRMLJVRVJLURZ-RULNZFCNSA-N 199.254 -1.323 50 10 AAGE Cc1cc(NC(=O)C(=O)NN)no1 2147524 KVHVFTYCEASTKX-UHFFFAOYSA-N 184.155 -1.089 50 10 AAGE N=C(NN)C(=O)NN 38609706 JZXXOVDDKQSHDC-UHFFFAOYSA-N 117.112 -2.583 50 10 AAGE CNC(=O)[C@@H](C)NC(=O)NN 42576267 BRCUGZKNYRMBAO-GSVOUGTGSA-N 160.177 -1.706 50 10 AAGE OC[C@]1(O)O[C@H](CCl)[C@@H](O)[C@@H]1O 196397268 HERFDENCNURSOX-ZXXMMSQZSA-N 198.602 -1.973 50 10 AAGE Cc1ncc(B(O)O)cc1O 238571371 WIHHRADMSYCOSE-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE NNC(=O)[C@H]1C[C@H](F)CN1 306286679 DRPZTTBKJDBFGC-IUYQGCFVSA-N 147.153 -1.324 50 10 AAGE CCC(=O)NN[C@H](C)C(N)=O 307607267 BOBCEGQXICMZTF-SCSAIBSYSA-N 159.189 -1.109 50 10 AAGE CN1C[C@H]2COC[C@@]2(C(=O)NN)C1 708200041 CYOWECWOVLLANS-XPUUQOCRSA-N 185.227 -1.446 50 10 AAGE O=C(CO)NNC(=O)NC1CC1 1597633188 IFODXBYVPDUFRI-UHFFFAOYSA-N 173.172 -1.529 50 10 AAGE NC(=O)NNC(=O)CC1COC1 1880567748 NMVWMTMSDPKPMO-UHFFFAOYSA-N 173.172 -1.278 50 10 AAGE CNNC(=O)[C@@H]1CN2CCN1CC2 1934626940 JPNLBWGKURKVHI-ZETCQYMHSA-N 184.243 -1.763 50 10 AAGE CC1(CO)CN(C(=O)C(=O)NN)C1 1935348004 IIUQOAMEGGPLDK-UHFFFAOYSA-N 187.199 -2.183 50 10 AAGE O=C(NNCCO)N1CCC1 1953260138 DYOPSUYRLDETNL-UHFFFAOYSA-N 159.189 -1.101 50 10 AAGE CONC(=O)c1cc(B(O)O)c[nH]1 2241468650 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2241905417 CGRNYXANJZCHDA-SSDOTTSWSA-N 199.015 -1.864 50 10 AAGE Cn1ncc(C(=O)NNC(N)=O)c1N 75600287 IVWDDKWAMKIJBD-UHFFFAOYSA-N 198.186 -1.685 50 10 AAGE CCN[C@H]1COC[C@H]1C(=O)NN 85386959 BRROHYQQWVXAFW-RITPCOANSA-N 173.216 -1.399 50 10 AAGE N[C@]1(C(=O)O)CC[C@@H](B(O)O)C1 195893008 VOHZFKLCWSOFRW-INEUFUBQSA-N 172.977 -1.205 50 10 AAGE OB(O)/C=C/[C@@H]1O[C@H](O)[C@H](O)[C@H]1O 306393356 DQCSKJVOIMGUKO-HGTNKQAQSA-N 189.960 -3.006 50 10 AAGE NNC(=O)CN1CCC1 306414931 YEXLQRZCRWUWSG-UHFFFAOYSA-N 129.163 -1.318 50 10 AAGE CN(C)NC(=O)[C@@H]1COCCO1 306927536 UPOIAJVPVOIIIM-LURJTMIESA-N 174.200 -1.005 50 10 AAGE Cn1cnnc1/C=C/B(O)O 307125416 ZWAJCUVQJLQMFL-NSCUHMNNSA-N 152.950 -1.160 50 10 AAGE N=C(N)Nc1ccc(B(O)O)cc1 307358568 DWZCKAXKYWSOEN-UHFFFAOYSA-N 178.988 -1.328 50 10 AAGE Cc1ccc(N)nc1B(O)O 307526694 IIPKFIDOKQZZDT-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE O=C(CO)NNC(=O)CN1CCC1 308183774 HZCMLOXSHZLCPY-UHFFFAOYSA-N 187.199 -2.168 50 10 AAGE CO[C@H]1CC[C@]1(N)B(O)O 724162077 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CC(=O)NC(=O)c1occc1B(O)O 2241473701 OJMJKTBGYORHEY-UHFFFAOYSA-N 196.955 -1.764 50 10 AAGE OB(O)c1cnn(CF)c1 2242482833 FDAHNUHGEQFTKJ-UHFFFAOYSA-N 143.914 -1.510 50 10 AAGE CC(C)(C(=O)NN)N1CCNCC1 87638926 ORDOSFHPGUWMSB-UHFFFAOYSA-N 186.259 -1.340 50 10 AAGE CN1CC(O)(C(=O)NN)C1 205314261 ZQIZPJUVIBTIAB-UHFFFAOYSA-N 145.162 -2.347 50 10 AAGE OB(O)c1ncnc2[nH]ccc12 211597912 VOSXZXFJSJGKBZ-UHFFFAOYSA-N 162.945 -1.362 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@@H]1O2 227374118 URLCYCYCPADVKM-JKUQZMGJSA-N 199.210 -1.588 50 10 AAGE COC[C@H](O)C(=O)NN 232418019 ZDNDCDPLBKABCO-VKHMYHEASA-N 134.135 -2.016 50 10 AAGE Cc1ncc(O)cc1B(O)O 238484291 OVALBAIXVNKDSQ-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE O[C@H]1[C@H](O)CO[C@H](CCl)[C@@H]1O 306367959 AHPRTTITVYSBFI-ZXXMMSQZSA-N 182.603 -1.293 50 10 AAGE C[C@]1(C(=O)NN)CCCS1(=O)=O 1340891892 BSGDQXOUXIENCS-ZCFIWIBFSA-N 192.240 -1.056 50 10 AAGE Cc1ccc(C#N)c(B(O)O)n1 1880848029 COISOXYUUDSHRZ-UHFFFAOYSA-N 161.957 -1.059 50 10 AAGE CC#CCCC(=O)NCB(O)O 1881645564 VGKDEAUWEYJFQU-UHFFFAOYSA-N 168.989 -1.082 50 10 AAGE NNC(=O)[C@H]1NC[C@@H]2CC[C@H]12 1935222972 RLKBTRAWLIFOMY-ZLUOBGJFSA-N 155.201 -1.026 50 10 AAGE C[C@@]12CNC[C@@]1(C(=O)NN)C2 1953313331 OSGCNVKNSPICAS-RNFRBKRXSA-N 155.201 -1.024 50 10 AAGE CN(C)NC(=O)c1coc(B(O)O)c1 2241481997 YNOAVSSUFKQCNQ-UHFFFAOYSA-N 197.987 -1.834 50 10 AAGE C[C@H](O)C(=O)NCC=CB(O)O 2241554743 GELSUHAEOIQEGB-YFKPBYRVSA-N 172.977 -1.948 50 10 AAGE O=C1O[C@H](CCl)[C@@H](O)[C@H]1O 27756739 CBQUKTYYJALFIT-BXXZVTAOSA-N 166.560 -1.128 50 10 AAGE in-vitro COc1ccc(=O)n(CC(=O)NN)n1 134523228 JKVYILFNCKLGIZ-UHFFFAOYSA-N 198.182 -1.758 50 10 AAGE COC(=O)[C@H]1CN(C)C[C@@H]1B(O)O 203753536 QCSRLJWVHXCNJG-WDSKDSINSA-N 187.004 -1.436 50 10 AAGE C[C@H](NC(N)=O)C(=O)NN(C)C 306518637 BNKWQJJVONUEAX-BYPYZUCNSA-N 174.204 -1.364 50 10 AAGE OB(O)c1csnn1 307758057 NJQJNJAPDFGFIK-UHFFFAOYSA-N 129.937 -1.782 50 10 AAGE Cc1nc(C(=O)NNC(N)=O)no1 606259164 ULMRZHYIBKIAIY-UHFFFAOYSA-N 185.143 -1.309 50 10 AAGE CNNC(=O)[C@@H](COC)OC 704691566 WDMUJYUGLSXGFB-RXMQYKEDSA-N 162.189 -1.102 50 10 AAGE NNC(=O)C[C@H](N)C(F)F 724712616 OWMBCDIKMIOVHW-REOHCLBHSA-N 153.132 -1.041 50 10 AAGE C[C@H](CN1C#[N+]C(=C=N)N1)C(=O)NN 885670883 KUNYZKGNEKYHNP-RXMQYKEDSA-O 195.206 -1.187 50 10 AAGE COCCN(C)NC(=O)[C@@H](C)O 1140544912 IBOXAXPZTIAKNP-ZCFIWIBFSA-N 176.216 -1.023 50 10 AAGE Cn1cc(C=CB(O)O)nn1 1880129469 HKJIJJRFSFOSEK-UHFFFAOYSA-N 152.950 -1.160 50 10 AAGE NNC(=O)CN1C[C@H](F)[C@@H](CO)C1 1881832940 LUSXHMQEIVAGMS-RITPCOANSA-N 191.206 -1.762 50 10 AAGE Cc1ncc(C)c(B(O)O)n1 1924534966 DFFPOAJOLJDBSY-UHFFFAOYSA-N 151.962 -1.227 50 10 AAGE CCN(CC(=O)NN)OC 1928674845 FKVCHRLMLDPAIZ-UHFFFAOYSA-N 147.178 -1.140 50 10 AAGE NNC(=O)NCc1nc(C(N)=O)co1 1955513610 HEQVWSBURUHSFP-UHFFFAOYSA-N 199.170 -1.554 50 10 AAGE OCCOc1ncc(B(O)O)cn1 2209387785 MXDGSWMHWIKGRH-UHFFFAOYSA-N 183.960 -2.473 50 10 AAGE C[C@@H](CO)Nc1cc(B(O)O)ccn1 2210061405 TVTZUNUFUUEGMI-LURJTMIESA-N 196.015 -1.446 50 10 AAGE C=C1CC(NC(=O)C#CB(O)O)C1 2241476078 LENUFBBDNYFQBE-UHFFFAOYSA-N 178.984 -1.163 50 10 AAGE N#CNCc1sccc1B(O)O 2241555293 LBARSWDFAZVMQI-UHFFFAOYSA-N 182.013 -1.001 50 10 AAGE NNC(=O)CN1CCO[C@@H](CO)C1 88097433 KLHDDHZHRQVBCY-ZCFIWIBFSA-N 189.215 -2.331 50 10 AAGE O=C1OC(=O)c2c1[nH]c(=O)[nH]c2=O 100861633 JUVJSBYXNGKOSP-UHFFFAOYSA-N 182.091 -1.626 50 10 AAGE CCNC(=O)N/C=C(\C=O)C(N)=O 140927656 URVBCPKCFYVYJQ-HWKANZROSA-N 185.183 -1.126 50 10 AAGE NNC(=O)C(=O)NCc1ccncn1 236215724 YBKGHFXIICOJJQ-UHFFFAOYSA-N 195.182 -1.917 50 10 AAGE O=C[C@H](O)[C@H](Cl)[C@@H](O)[C@@H](O)CO 238712573 JWYWFHQMFHJVRH-BXKVDMCESA-N 198.602 -2.132 50 10 AAGE NNc1ccc(S)cc1B(O)O 307271570 CEEBKQFYHIQQKU-UHFFFAOYSA-N 184.029 -1.059 50 10 AAGE CC(=O)NNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 307527185 SANBGVJOTCUXSG-RFZPGFLSSA-N 187.155 -1.181 50 10 AAGE C[C@H](O)[C@@H](CO)[C@@H](O)C(=O)NN 379321104 ZTHFBXFHFIHONJ-VPENINKCSA-N 178.188 -2.674 50 10 AAGE OB(O)c1ccn([C@H]2CCCO2)n1 686740624 WMCIRYNCBISQML-SSDOTTSWSA-N 181.988 -1.128 50 10 AAGE NNC(=O)C(=O)NC[C@]12COC[C@@H]1C2 689283608 XBZLIWPVALNZJL-YLWLKBPMSA-N 199.210 -1.871 50 10 AAGE Cc1nocc1C(=O)NCB(O)O 706437973 GKQXJIUANGTGCD-UHFFFAOYSA-N 183.960 -1.275 50 10 AAGE C[C@H](ON)C(=O)NN(C)C 708729228 CQLAVXCTGBEJHU-BYPYZUCNSA-N 147.178 -1.142 50 10 AAGE CC#CCC(=O)NCB(O)O 1880544384 ZTQWCSAAKUGQFI-UHFFFAOYSA-N 154.962 -1.472 50 10 AAGE NNC(=O)CN1C[C@@H]2[C@H](CO)[C@@H]2C1 1882367398 MIAOMWUJWVXRTI-KVSKUHBBSA-N 185.227 -1.854 50 10 AAGE CN(C[C@H]1CCO1)C(=O)C#CB(O)O 1889800010 RDMBZBJLQHNWCM-SSDOTTSWSA-N 196.999 -1.751 50 10 AAGE CC1(C(N)=O)CN(C(=O)NN)C1 1914183149 PQJQZUNFCMDYNY-UHFFFAOYSA-N 172.188 -1.623 50 10 AAGE CN(N)C(=O)[C@H]1CN2CCN1CC2 1934626864 ILSKNAGIJPYZCY-SSDOTTSWSA-N 184.243 -1.682 50 10 AAGE NNC(=O)[C@H]1C[C@@H](N)[C@@H]2C[C@H]12 1953201692 AYUGSVNUXYTPAE-BGPJRJDNSA-N 155.201 -1.040 50 10 AAGE O=C(C#CB(O)O)NC[C@@H]1C[C@@H]1CO 2241467848 BWCASQIEYSYFEY-NKWVEPMBSA-N 196.999 -2.254 50 10 AAGE COc1cc(CN)ccc1B(O)O 2242208135 RWNVXYNXMDBCBP-UHFFFAOYSA-N 181.000 -1.166 50 10 AAGE N#CC[C@H](O)CC(=O)NN 141449739 PJUCPOPYOJBMQK-BYPYZUCNSA-N 143.146 -1.359 50 10 AAGE N[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](N)[C@@H]1Cl 307034203 SMAXJMCZRABISI-CDRYSYESSA-N 196.634 -2.655 50 10 AAGE COc1cccc(N)c1B(O)O 307624364 NCFYOXOXFKGQSL-UHFFFAOYSA-N 166.973 -1.043 50 10 AAGE Cn1[nH]c(=NC(=O)NN)cc1F 1880941812 PMBALWDHYOZDFN-UHFFFAOYSA-N 173.151 -1.024 50 10 AAGE NNC(=O)N[C@H]1CCNC(=O)C1 1881022629 RBCADXNAXGABPX-BYPYZUCNSA-N 172.188 -1.562 50 10 AAGE CN1[C@@H](CN)CC[C@@H]1C(=O)NN 1923855690 ZACOTPXQOXCVRS-PHDIDXHHSA-N 172.232 -1.602 50 10 AAGE Cc1nccc(=NCB(O)O)[nH]1 1923937056 ZJESDJURFNKHDM-UHFFFAOYSA-N 166.977 -1.369 50 10 AAGE N#C[C@@H](O)[C@H](N)CCN1CCOCC1 1953040257 IMJQTNNZHQLMKD-RKDXNWHRSA-N 199.254 -1.080 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2C[C@@H]1[C@H]1C[C@@H]21 1955370184 VJOPVIUPOLJXBY-JRTVQGFMSA-N 195.222 -1.157 50 10 AAGE NC[C@H]1C[C@H](C(=O)NN)C1 2208926188 RCTZUGMJJFIBCH-URHBZAFASA-N 143.190 -1.039 50 10 AAGE C[C@@H](CCC#N)NC(=O)C#CB(O)O 2241469023 YUKBFXXEQVDSRQ-ZETCQYMHSA-N 193.999 -1.190 50 10 AAGE O=C(C#CB(O)O)N1CC(F)C1 2241478588 ILRHPYRKCJJJBF-UHFFFAOYSA-N 170.936 -1.818 50 10 AAGE C[C@H]1[C@@H](O)CN1C(=O)C1(B(O)O)CC1 2241481396 RXHSIPBDUFGYJA-WDSKDSINSA-N 199.015 -1.415 50 10 AAGE NNC(=O)[C@]1(N)C[C@H]2OCCC[C@H]21 2242114125 LICVVKBZEMGRBS-JKMUOGBPSA-N 185.227 -1.127 50 10 AAGE NCc1ccn(CC(=O)NN)c(=O)c1 76729382 KMSPQPBASTYNNA-UHFFFAOYSA-N 196.210 -1.703 50 10 AAGE O=C1C=C(B(O)O)CCO1 231379124 MOJIFGIXBFHOSY-UHFFFAOYSA-N 141.919 -1.128 50 10 AAGE Cn1nnc(CB(O)O)n1 236148061 DWTNRWCHMOGEQT-UHFFFAOYSA-N 141.927 -2.235 50 10 AAGE Cn1cc2ncc(B(O)O)cc2n1 238513523 YSJNLFJQINPUKL-UHFFFAOYSA-N 176.972 -1.352 50 10 AAGE [O-][n+]1cccc(B(O)O)c1 238628923 FSPKVFUILKDKIT-UHFFFAOYSA-N 138.919 -2.000 50 10 AAGE OB(O)c1cnc2cccnn12 238635732 DSDHJKYFGYFZKU-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE CN1CCC([C@@H](N)C(=O)NN)CC1 258939600 CEXONZXNTAKXSI-SSDOTTSWSA-N 186.259 -1.355 50 10 AAGE CC[C@H](C(=O)NN)N1CC(C)(O)C1 306679599 IRPMDBQAJUSSMZ-ZCFIWIBFSA-N 187.243 -1.179 50 10 AAGE C[C@H](N)C=NNC(N)=O 307816302 MGYXXKYBIIAWIT-VKHMYHEASA-N 130.151 -1.012 50 10 AAGE CC(=O)c1cc(B(O)O)no1 698028777 TYTLJJCVUAYGEQ-UHFFFAOYSA-N 154.918 -1.443 50 10 AAGE Cc1cc(NC(=O)C(=O)NN)ncn1 1886793440 BVPKPWPNZJIUFY-UHFFFAOYSA-N 195.182 -1.287 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1N 1953341026 BIGLEQAHRSWBKH-KAZBKCHUSA-N 155.201 -1.040 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1[C@@H]2C[C@@H]1CN2 2241468045 GKGZVKGSILKKTI-CHKWXVPMSA-N 193.999 -2.522 50 10 AAGE C[C@H](NC(=O)C#CB(O)O)[C@@H](C)CO 2241479298 VUMCWUQRVBWWRL-BQBZGAKWSA-N 199.015 -1.865 50 10 AAGE NNC(=O)c1ncc(B(O)O)cn1 2241479554 AOEKBIMAPJUPJC-UHFFFAOYSA-N 181.948 -3.240 50 10 AAGE O=C1NCCc2cnc(B(O)O)cc21 238642278 LVOZPXZMXFSOSF-UHFFFAOYSA-N 191.983 -1.953 50 10 AAGE C[C@H](C(=O)NN)N1CC(C(N)=O)C1 306557250 NRLHYJJSEIHLGJ-SCSAIBSYSA-N 186.215 -2.218 50 10 AAGE CO[C@@H]1OC(C=O)=C[C@@H](O)[C@H]1O 307322257 YISYJKZMQGJXSO-FSDSQADBSA-N 174.152 -1.206 50 10 AAGE N#CC1=C[C@H](O)[C@H](O)[C@@H](O)[C@H]1O 307625372 SQZYGIJVCRCCSR-AXMZGBSTSA-N 171.152 -2.106 50 10 AAGE C[C@H](C(=O)NN)[C@@H](O)[C@H](C)CO 307993347 ZEWKEWWFRNUPAY-SRQIZXRXSA-N 176.216 -1.398 50 10 AAGE CN1N[C@H](Br)N=C1NN 605678376 WITCREYBGOUKPE-UWTATZPHSA-N 194.036 -1.066 50 10 AAGE CNNC(=O)C1=C(Cl)NC#CN1 642824912 IFUHOVWRPWREAN-UHFFFAOYSA-N 186.602 -1.244 50 10 AAGE O=C(NCB(O)O)c1cscn1 701955828 PSGAQVDWCQJBHN-UHFFFAOYSA-N 186.001 -1.115 50 10 AAGE O=C(O)c1ncncc1B(O)O 708353358 JMXDUYPLLDHWIL-UHFFFAOYSA-N 167.917 -2.145 50 10 AAGE NNC(=O)CCN1C[C@H]2COC[C@H]2C1 718147091 BTIJHUGXWBYLCE-OCAPTIKFSA-N 199.254 -1.055 50 10 AAGE NCC[C@@H](O)C(=O)NN 1879963007 KXXUMRFHWDMXHO-GSVOUGTGSA-N 133.151 -2.314 50 10 AAGE Cn1nnnc1C=NNC(N)=O 1881326539 LELNCNLLZWCPRF-UHFFFAOYSA-N 169.148 -1.788 50 10 AAGE Cc1c(B(O)O)cc(N)cc1C(=O)O 1887505506 IUZFCBHKOGKJOY-UHFFFAOYSA-N 194.983 -1.045 50 10 AAGE NNC(=O)C(=O)N1CC2(CC2)CO1 1930161031 HRHMDKWERXMDAN-UHFFFAOYSA-N 185.183 -1.470 50 10 AAGE 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50 10 AAGE C[C@@H](O)CCN(C)CC(=O)NN 135780581 NQHKMSMLRPKHHK-ZCFIWIBFSA-N 175.232 -1.321 50 10 AAGE NC(=O)NNC(=O)c1ncc[nH]1 147277431 QIVVFKKCFVRKFC-UHFFFAOYSA-N 169.144 -1.277 50 10 AAGE NNC(=O)CC(=O)NNCC(=O)O 238655354 PGQYASNTBFZPEX-UHFFFAOYSA-N 190.159 -2.928 50 10 AAGE CN(C)NC(=O)c1nc(=O)[nH][nH]1 306208861 NAYIMNUUSSHRCO-UHFFFAOYSA-N 171.160 -1.696 50 10 AAGE CN1CCO[C@H](C(=O)NN)C1 306321012 JFYAPMQTTYXPMA-YFKPBYRVSA-N 159.189 -1.693 50 10 AAGE CC(C)(SC(N)N)B(O)O 306572936 HEHMQAMRDFSVJC-UHFFFAOYSA-N 164.039 -1.289 50 10 AAGE CN(C)CCC(=O)NNC(N)=S 700853999 ILMXXVBQJVGXJN-UHFFFAOYSA-N 190.272 -1.198 50 10 AAGE O=C1C[C@@H](C(=O)NCB(O)O)CN1 702027979 BFSWLHIYHDZYIA-SCSAIBSYSA-N 185.976 -2.749 50 10 AAGE CNNC(=O)[C@@H](C)NC(C)=O 704663900 DAIVVNCHSCNQFT-SCSAIBSYSA-N 159.189 -1.238 50 10 AAGE CNNC(=O)C[C-]1C#CN(C)N1 885299151 VKUTUXKXFOBQME-UHFFFAOYSA-N 167.192 -1.430 50 10 AAGE CC(=O)NNC(=O)CN1CCCO1 1883400617 YXOQMPFXUZZSFE-UHFFFAOYSA-N 187.199 -1.209 50 10 AAGE NNC(=O)CCN1CC[C@@H](F)C1=O 1889028044 PUVFOIUWNLSZPE-RXMQYKEDSA-N 189.190 -1.063 50 10 AAGE COC[C@@H](C(=O)NN)N1CCCO1 1928676495 JLXZVJZWBBFRAA-LURJTMIESA-N 189.215 -1.371 50 10 AAGE NNC(=O)[C@@H]1CO[C@@H]2CNC[C@@H]2O1 2241299620 FEOSMCVMTZNMHQ-SRQIZXRXSA-N 187.199 -2.268 50 10 AAGE CCCNC(=O)c1cc(B(O)O)n[nH]1 2241474793 LCGILGXWCRLOCJ-UHFFFAOYSA-N 197.003 -1.771 50 10 AAGE C[C@H](CO)[C@H](C)NC(=O)C#CB(O)O 2241479301 VUMCWUQRVBWWRL-RQJHMYQMSA-N 199.015 -1.865 50 10 AAGE O=C(Nn1cnnc1)[C@@H]1C[C@@H]1B(O)O 2241496250 QJPXXVLRSQTXRY-UHNVWZDZSA-N 195.975 -1.789 50 10 AAGE NNC(=O)Cn1ccsc1=O 82471544 NQJJGXFFQUOPBM-UHFFFAOYSA-N 173.197 -1.100 50 10 AAGE CN1C[C@@H](C(=O)NN)CCC1=O 238316233 ZBHBWDWXRZIBTK-YFKPBYRVSA-N 171.200 -1.155 50 10 AAGE NNC(=O)C(=O)NCC1[C@H]2COC[C@H]12 307475687 KTBJPKCKKGWFEP-PHDIDXHHSA-N 199.210 -2.015 50 10 AAGE COc1ccc(B(O)O)c(NN)c1 307672751 XKSCYFSOXRQYJY-UHFFFAOYSA-N 181.988 -1.339 50 10 AAGE CN(C[C@H](O)CCl)C(CO)CO 388416811 FLOBRXJOPFZUPI-SSDOTTSWSA-N 197.662 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IMLNYKUUSXKPNF-RNFRBKRXSA-N 196.015 -2.145 50 10 AAGE O=C(O)c1ccc(B(O)O)nc1 205625325 AXTRXVUTEWKAII-UHFFFAOYSA-N 166.929 -1.540 50 10 AAGE N[C@H](CC/C=C\B(O)O)C(=O)O 220672137 PZHKTUVCRZTDBK-DWFCDSDJSA-N 172.977 -1.253 50 10 AAGE NNC(=O)CN1CC[C@H](C(N)=O)C1 236238354 RPHSMECOTKUDFZ-YFKPBYRVSA-N 186.215 -2.217 50 10 AAGE C[C@H](CC(=O)NN)[C@H](O)C(=O)NN 238451702 CFBDPRCKOURCRL-WUJLRWPWSA-N 190.203 -2.647 50 10 AAGE OB(O)c1ccnc(OC2COC2)c1 238651425 QSZUXOAHPSHCGR-UHFFFAOYSA-N 194.983 -1.461 50 10 AAGE NNC(=O)c1cccc(C(N)=O)n1 306877397 CISSLBRYTMNSMZ-UHFFFAOYSA-N 180.167 -1.216 50 10 AAGE NNC(=O)c1cc(C(N)=O)co1 307197517 VZKLGNIISIGODV-UHFFFAOYSA-N 169.140 -1.018 50 10 AAGE O=[N+]([O-])c1cccc(CO)c1B(O)O 687806633 XAVYSDGVGOPWSY-UHFFFAOYSA-N 196.955 -1.233 50 10 AAGE O=C(NCB(O)O)c1ccc(F)cn1 702017051 GLPCRFWBLYXPTJ-UHFFFAOYSA-N 197.962 -1.038 50 10 AAGE NNC(=O)C(=O)N[C@H]1C[C@H]1C1CC1 717085383 SIWDSIJIFAPSHQ-WDSKDSINSA-N 183.211 -1.109 50 10 AAGE O=C(NCB(O)O)[C@@H]1[C@@H]2CCOC[C@H]21 1930430993 WNNGIVKIRIKLIP-FSDSQADBSA-N 199.015 -1.603 50 10 AAGE CN(CC(=O)NN)Cc1cnnn1C 1934944040 CMFKUYOSPOKRQG-UHFFFAOYSA-N 198.230 -1.763 50 10 AAGE NNC(=O)C(=O)NC1COC1 1953311108 FJRRXIWQDVFUEE-UHFFFAOYSA-N 159.145 -2.509 50 10 AAGE C[C@H](CCC#N)NC(=O)C#CB(O)O 2241469022 YUKBFXXEQVDSRQ-SSDOTTSWSA-N 193.999 -1.190 50 10 AAGE O=C(C#CB(O)O)N1CC[C@@H]1CF 2241478853 MFWAROCVPQRDDC-ZCFIWIBFSA-N 184.963 -1.428 50 10 AAGE CN(C)NC(=O)c1cc(B(O)O)co1 2241748794 MBNBYYQDAADXQM-UHFFFAOYSA-N 197.987 -1.834 50 10 AAGE C[C@H](NC(=O)C1(N)CC1)B(O)O 196191006 QZLXHWXXBMPLHP-BYPYZUCNSA-N 171.993 -2.006 50 10 AAGE COC[C@H](C(=O)NN)N(C)C 232419043 USMMVISVLHHPJH-RXMQYKEDSA-N 161.205 -1.447 50 10 AAGE Nc1ncc(CO)cc1B(O)O 238689202 QIKYYJIHOYEIBO-UHFFFAOYSA-N 167.961 -2.164 50 10 AAGE NC(=S)NNC(=O)c1cnc[nH]1 575533471 MGQKWEMPIUDNBQ-UHFFFAOYSA-N 185.212 -1.112 50 10 AAGE NNC(=O)[C@]12CNC[C@H]1CCO2 575546420 SLGYXYOMGXDYCZ-VDTYLAMSSA-N 171.200 -1.645 50 10 AAGE NNC(=O)[C@@H](ON)C1CC1 708819885 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50 10 AAGE NNC(=O)C1(O)CNC1 1923218568 YMNBENRCMNKKAF-UHFFFAOYSA-N 131.135 -2.689 50 10 AAGE OB(O)c1cccnc1N1CCCN1 2210060633 MAALXPIQUQYNSY-UHFFFAOYSA-N 193.015 -1.524 50 10 AAGE C#C[C@H](C)CNC(=O)C#CB(O)O 2241468247 JYJUDVKXNBTLMM-ZETCQYMHSA-N 178.984 -1.613 50 10 AAGE CNC(=S)NNC(=O)C(N)=O 7058645 FZOKIOXALLEPQP-UHFFFAOYSA-N 176.201 -2.403 50 10 AAGE CNNC(=O)/C=C/C(=O)O 75529374 FZIPRXQQAAUWKN-NSCUHMNNSA-N 144.130 -1.122 50 10 AAGE NNC(=O)[C@@H](O)CO 115341658 ZSKOXNZLFYXWIR-REOHCLBHSA-N 120.108 -2.671 50 10 AAGE COC(=O)[C@@H](O)/C(C)=N/NC(N)=O 143830525 KXUARSOMLKXWNB-DVIQUMPHSA-N 189.171 -1.436 50 10 AAGE O=C(CCNCCO)NNCCO 145646121 TYFXHZRSASLVJD-UHFFFAOYSA-N 191.231 -2.429 50 10 AAGE NNC(=O)[C@H](O)[C@@H](O)CO 222423540 DABFVTGKRSUBNK-STHAYSLISA-N 150.134 -3.310 50 10 AAGE O=CC1=C[C@@H](O)[C@@H](O)[C@@H](CO)O1 238657012 PQVIDRCMCCXBNW-FSDSQADBSA-N 174.152 -1.818 50 10 AAGE C[C@H](CN1CC[C@@H](N)C1)C(=O)NN 307207298 IGOWQLAHHDHASQ-RNFRBKRXSA-N 186.259 -1.355 50 10 AAGE CN1N=C([C@@H](O)C2=C=S=C=N2)NN1 642816066 AISNEMXXNYHAPV-YFKPBYRVSA-N 197.223 -1.448 50 10 AAGE O=C(NCB(O)O)[C@H]1C[C@H]1Cl 1880450718 OKCBTAQRLWQMKL-IUYQGCFVSA-N 177.396 -1.258 50 10 AAGE CC(C)(O)[C@@H]1CCN1CC(=O)NN 1883106461 RMKHONXKGZLSQI-LURJTMIESA-N 187.243 -1.179 50 10 AAGE OB(O)[C@@H]1CCN(Cc2nn[nH]n2)C1 1891560472 SKAVMJWQELGJKY-RXMQYKEDSA-N 197.007 -1.752 50 10 AAGE CO[C@@H]1C[C@@H](O)CN(C(=O)NN)C1 1954843091 DAPSYYYJUBQLRY-PHDIDXHHSA-N 189.215 -1.349 50 10 AAGE N[C@H]1CCC[C@@H]1NC(=O)C#CB(O)O 2241468452 OPPXTGDUADJSKX-BQBZGAKWSA-N 196.015 -2.002 50 10 AAGE O=C(C#CB(O)O)N1[C@H]2COC[C@H]1C2 2241478518 GWSSCPAPMZNGCQ-RNFRBKRXSA-N 194.983 -1.999 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](Cl)[C@@H](O)[C@H]1O 44608301 SNGNCYILSHZBLM-ZSNZIGRDSA-N 198.602 -1.975 50 10 AAGE CC[C@H](N)C(=O)NN 69635689 BRWLRDGREYILAV-VKHMYHEASA-N 117.152 -1.286 50 10 AAGE CCC(=O)NN/C(N)=C\C(=O)OC 138696918 LKVOTZBDQVJWIU-PLNGDYQASA-N 187.199 -1.010 50 10 AAGE CC(C)(CC(N)=O)NC(=O)NN 227084147 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186.215 -1.233 50 10 AAGE N#Cc1ncn(CCC(=O)NN)n1 82471701 CIKXYUGAWNOEMC-UHFFFAOYSA-N 180.171 -1.470 50 10 AAGE NNC(=O)N[C@@H]1CCOC1 87788906 IEEISQCNEHKBJQ-SCSAIBSYSA-N 145.162 -1.052 50 10 AAGE N#C/C(C(N)=O)=C(\N)O 104597686 CTNQRYKLOZNXHZ-IHWYPQMZSA-N 127.103 -1.276 50 10 AAGE N#C[C@@H](N)C(=O)NN 104658373 JSQNTSXBBWMZGQ-UWTATZPHSA-N 114.108 -2.173 50 10 AAGE NNC(=O)CCCN1CC[C@H](N)C1 203222948 QUXJOVNZFLWRJT-ZETCQYMHSA-N 186.259 -1.211 50 10 AAGE NNC(=O)N1C[C@H](O)[C@@H](O)C1 236245632 VACVPGLPIBIBAM-IMJSIDKUSA-N 161.161 -2.393 50 10 AAGE Cn1nnnc1[C@H](O)C#N 261323710 MNMKQZWMPPSTDR-GSVOUGTGSA-N 139.118 -1.233 50 10 AAGE N[C@H](B(O)O)[C@H]1COCCO1 1880462441 HLFIYZZPQANTRZ-UHNVWZDZSA-N 160.966 -2.259 50 10 AAGE CN(C)C(=O)CCN(C)C(=O)NN 1882872544 DDVKKVTXZKBORS-UHFFFAOYSA-N 188.231 -1.020 50 10 AAGE NNC(=O)C(=O)N[C@H]1[C@H]2OCCC[C@@H]21 1884444305 BMBHOAICVPWMRP-PBXRRBTRSA-N 199.210 -1.730 50 10 AAGE NNC(=O)[C@H]1[C@@H]2CC[C@H]1NC2 1953290850 WPIJSPKQJRQYPV-PBXRRBTRSA-N 155.201 -1.026 50 10 AAGE NNC(=O)CN1CC([C@H](F)CO)C1 1953841701 FKTBFTOCCSTBPO-ZCFIWIBFSA-N 191.206 -1.762 50 10 AAGE CN(CC(=O)NN)Cc1ncon1 1954471997 BSSWUMQTVMNKHU-UHFFFAOYSA-N 185.187 -1.509 50 10 AAGE CN(C)Cc1nscc1B(O)O 2209028602 QAOZYJWIDRWBKC-UHFFFAOYSA-N 186.045 -1.116 50 10 AAGE C=C[C@H](CO)NC(=O)C#CB(O)O 2241478760 LBNVFCOCXDLTMY-ZCFIWIBFSA-N 182.972 -2.335 50 10 AAGE NC1CC(NC(=O)C#CB(O)O)C1 2241479111 RMKPSOXQHLCXEN-UHFFFAOYSA-N 181.988 -2.392 50 10 AAGE CC1(NC(=O)[C@H]2C[C@@H]2B(O)O)CNC1 2241494819 DNCRJESUIJJYIU-WDSKDSINSA-N 198.031 -1.673 50 10 AAGE CS(=O)(=O)S(C)(=O)=O 39274309 YOKNTCZOOFBTDG-UHFFFAOYSA-N 158.200 -1.009 50 10 AAGE COc1cncc(B(O)O)c1O 238343899 CAILHANYWBFGCX-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE CN(/N=C/c1nnn(C)n1)C(N)=O 306264028 OAJXRBXKYGAXTD-XVNBXDOJSA-N 183.175 -1.446 50 10 AAGE CC(=O)NNC1=N[C@H](C)CN1 306454034 OVVRAGILHFGFRT-SCSAIBSYSA-N 156.189 -1.025 50 10 AAGE COc1cccc(B(O)O)c1NN 306911301 KNPFJVCLOIOPCZ-UHFFFAOYSA-N 181.988 -1.339 50 10 AAGE OCc1nc2ccc(B(O)O)cc2o1 307533441 OIBLMDINHGEQDT-UHFFFAOYSA-N 192.967 -1.000 50 10 AAGE CC[C@H](NC(=O)C(=O)NN)C(N)=O 382169744 KXIVQJNOZOFGMH-VKHMYHEASA-N 188.187 -2.644 50 10 AAGE NNC(=O)C[S@@](=O)CCO 526883151 UXVMIDGBTNKBFI-JTQLQIEISA-N 166.202 -2.283 50 10 AAGE CO[C@@H]1CC[C@@](N)(B(O)O)C1 1880313695 ASLDYZCDDFORKY-RITPCOANSA-N 158.994 -1.105 50 10 AAGE NNC(=O)CN1CC[C@H]2[C@@H]1C[C@H]2O 1882062731 SYHZDOQUWLCXSJ-LYFYHCNISA-N 185.227 -1.569 50 10 AAGE C[C@H](O)[C@@H]1CCN1[C@@H](C)C(=O)NN 1882400160 FALXABBCFSSKHG-ACZMJKKPSA-N 187.243 -1.180 50 10 AAGE C[C@H]1CCN1c1ncc(B(O)O)cn1 1886973584 RPYTZPWGVQQUEW-LURJTMIESA-N 193.015 -1.245 50 10 AAGE N#C[C@H](O)c1nn[nH]n1 1951401873 JFNFEKOBQQHOPM-REOHCLBHSA-N 125.091 -1.243 50 10 AAGE C[C@@H](C(=O)NN)N1CCO[C@@H]2C[C@@H]21 1954051127 NHRDEOVWYDQPTG-LYFYHCNISA-N 185.227 -1.162 50 10 AAGE NNC(=O)CN1C[C@@H]2CCO[C@H]2C1 1954075992 YFJQNVVAAVEIGJ-BQBZGAKWSA-N 185.227 -1.303 50 10 AAGE CN(CCF)c1ncncc1B(O)O 1956960319 BTPLKENQAZNXAN-UHFFFAOYSA-N 198.994 -1.438 50 10 AAGE O=C(NO)c1cc(B(O)O)cs1 2241584474 OHMDHLGJUJZBOD-UHFFFAOYSA-N 186.985 -1.453 50 10 AAGE CS(=O)(=O)CC[C@H](N)C(=O)NN 6019437 ISCLASQEDJLFAJ-BYPYZUCNSA-N 195.244 -2.262 50 10 AAGE O=C[C@@H](Cl)[C@@H](O)S(=O)(=O)O 141304641 FLHGOUWURQMLKC-GBXIJSLDSA-N 188.588 -1.001 50 10 AAGE CN1C(=O)Cc2cccc(B(O)O)c21 238319757 BJYRCWFXAGMDSW-UHFFFAOYSA-N 190.995 -1.115 50 10 AAGE O[C@@H]1[C@@H](Cl)CO[C@@H](O)[C@@H]1O 307345885 AGEHHWLQJBQEJJ-NRXMZTRTSA-N 168.576 -1.336 50 10 AAGE CCOC(=O)NNC(=O)C(=O)OC 379406412 WGEHHQDIRGKAJV-UHFFFAOYSA-N 190.155 -1.063 50 10 AAGE N#CC1=C(N2CC(O)C2)NC#CN1 885351463 SECXVEHQGNAXEG-UHFFFAOYSA-N 176.179 -1.533 50 10 AAGE N#CC1=C=C=C(N2C[C@H](O)CO2)NN1 885589579 OVNHXMIPQXTXBB-ZETCQYMHSA-N 192.178 -1.295 50 10 AAGE OB(O)c1nc(Cl)n[nH]1 1879985540 YKTLLIFRCCTTIH-UHFFFAOYSA-N 147.330 -1.862 50 10 AAGE NNC(=O)[C@@H]1CCN[C@@H]2C[C@@H]21 1892540549 YSLTYYCOUGRBMH-HSUXUTPPSA-N 155.201 -1.026 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@H](C1)C2O 1957010444 SFINWZBQMIHZDQ-AVSFMBPQSA-N 199.254 -1.321 50 10 AAGE C[C@@H](O)C(=O)N1CC[C@H](B(O)O)C1 2208731251 CNORMAZPEUYDBX-RITPCOANSA-N 187.004 -1.558 50 10 AAGE CN(C)NC(=O)[C@H]1CC[C@@H](O)CN1 2241252297 QELUVJQCYQQJBL-RNFRBKRXSA-N 187.243 -1.308 50 10 AAGE NC(=O)c1ncncc1B(O)O 2241475419 XKAPSGBJDBEYGP-UHFFFAOYSA-N 166.933 -2.745 50 10 AAGE NNC(=O)CCn1cc(C(N)=O)cn1 84691059 ABSDWZHYAMHVKS-UHFFFAOYSA-N 197.198 -1.638 50 10 AAGE C[C@@H](NC(=O)C1CC1)C(=O)NN 306634615 WLCXWURWTDGUAW-SCSAIBSYSA-N 171.200 -1.109 50 10 AAGE C[C@H]1C[C@@H](O)CN1CC(=O)NN 306741259 DDYZHSVGIQQPRC-NTSWFWBYSA-N 173.216 -1.569 50 10 AAGE Cc1cc(B(O)O)cc(=O)n1C 307629898 NLCZWKKYLXNVJK-UHFFFAOYSA-N 166.973 -1.626 50 10 AAGE N#CCn1cc(B(O)O)cn1 709729965 ZBIXHCLBIFMODW-UHFFFAOYSA-N 150.934 -1.914 50 10 AAGE CNC(=O)NNC(=O)c1cnn(C)n1 1630973143 XPCMQONFAZGUKO-UHFFFAOYSA-N 198.186 -1.611 50 10 AAGE O=C(F)N[C@H]1C(=O)NC[C@@H]1C(=O)O 1882784566 UOQQARGQJUYACK-STHAYSLISA-N 190.130 -1.135 50 10 AAGE NNC(=O)c1cc(B(O)O)n[nH]1 1951328337 BTTGLBGKOXZCBE-UHFFFAOYSA-N 169.937 -3.307 50 10 AAGE C[C@@H]1CN(C(=O)C#CB(O)O)CCO1 2241478381 DDTQKZWHYAGIDS-SSDOTTSWSA-N 196.999 -1.751 50 10 AAGE C#CCONC(=O)[C@@H]1C[C@@H]1B(O)O 2241480219 IWPJVFHMYZTIKE-RITPCOANSA-N 182.972 -1.470 50 10 AAGE Nc1ncccc1C(=O)NCB(O)O 2241890418 HYJDYWUDHXZGMG-UHFFFAOYSA-N 194.987 -1.594 50 10 AAGE Cc1n[nH]c(=NC(=O)C(=O)NN)n1C 2242121172 WUXPBNWKPXXOQL-UHFFFAOYSA-N 198.186 -2.526 50 10 AAGE NNC(=O)Cn1ccc(=O)[nH]c1=O 37388905 JNLBXORJKSELDK-UHFFFAOYSA-N 184.155 -2.474 50 10 AAGE CCN[C@H](CC(=O)NN)C(=O)NN 238279829 QBLAYLRXOBDZAO-SCSAIBSYSA-N 189.219 -2.666 50 10 AAGE C[N+]1=C=C(C2=C=C(CCl)[N]N2)NN1 885218108 UVEWBMJXXKIRLN-UHFFFAOYSA-N 197.629 -1.067 50 10 AAGE NNC(=O)N1CC2(CNC(=O)N2)C1 1882005273 AZXSZQUOTCXFBH-UHFFFAOYSA-N 185.187 -2.063 50 10 AAGE CCOCCC(=O)NCC#CB(O)O 1895239362 MRAICNBZVXQPKK-UHFFFAOYSA-N 199.015 -1.455 50 10 AAGE O=C(C#CB(O)O)N1CCC(F)CC1 2241468307 LFWGFMCZHRNYLA-UHFFFAOYSA-N 198.990 -1.038 50 10 AAGE NC(=O)NC(=O)c1cc(B(O)O)c[nH]1 2241585099 YGMWILPKSHCJOJ-UHFFFAOYSA-N 196.959 -2.497 50 10 AAGE NNC(=O)N1CCC[C@@H]1CC(N)=O 2241732906 LSVIHRTWTQYQSF-RXMQYKEDSA-N 186.215 -1.091 50 10 AAGE COc1ccc(=NC(=O)NN)[nH]n1 2242420127 CFTPSNGWYOPBIJ-UHFFFAOYSA-N 183.171 -1.098 50 10 AAGE OB(O)c1ccn2nccc2n1 2242471703 IVSJSGQECOBQDY-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE Cn1cc(C(=O)NNC(N)=S)cn1 83591047 DUVBXJCNPPLXDR-UHFFFAOYSA-N 199.239 -1.102 50 10 AAGE Nc1cccc(B(O)O)c1[N+](=O)[O-] 197138710 SFWJHAHYJGOIAP-UHFFFAOYSA-N 181.944 -1.143 50 10 AAGE C[C@H](CCO)C(=O)NN 210296668 BJAAZNHXQVWXMR-SCSAIBSYSA-N 132.163 -1.005 50 10 AAGE CNC(=O)c1ccc(B(O)O)s1 238339469 QWWLBRRXUGXZHL-UHFFFAOYSA-N 185.013 -1.213 50 10 AAGE CNc1nccc(B(O)O)n1 307096056 DGJOZHXJZUOIFR-UHFFFAOYSA-N 152.950 -1.802 50 10 AAGE N#Cc1cccc(NN)c1B(O)O 307661001 VACWSFFHTLHDCF-UHFFFAOYSA-N 176.972 -1.476 50 10 AAGE COCCC(=O)NNC(N)=O 700888125 RTXYICBREKXCII-UHFFFAOYSA-N 161.161 -1.278 50 10 AAGE O=C(NCB(O)O)c1nn[nH]n1 706529935 KRTJSFPNSLWOKD-UHFFFAOYSA-N 170.925 -3.059 50 10 AAGE NNC(=O)[C@@H]1CN2CC3CC2(CO1)C3 708104086 DXYHJMATMDUGMP-CRMOQAEOSA-N 197.238 -1.161 50 10 AAGE C[C@@]1(CO)CCCN1CC(=O)NN 723000569 PRVAWAKPQQCTHG-QMMMGPOBSA-N 187.243 -1.177 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H]1C1CC1 885427990 WCJUKFIYMZFZPT-ZCFIWIBFSA-N 183.211 -1.013 50 10 AAGE NNC(=O)[C@@H]1C=C[C@H]1C(=O)O 1880145102 CWYQDBYKJLIQED-QWWZWVQMSA-N 156.141 -1.137 50 10 AAGE CN(C)CCOCCC(=O)NN 1880639286 IFGAGZHYWQOXSD-UHFFFAOYSA-N 175.232 -1.055 50 10 AAGE CC[C@H](C(=O)NN)N1C[C@H](O)[C@H]1C 1882448778 ZNQUPCJHIDLGTO-QYNIQEEDSA-N 187.243 -1.180 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@H](O)[C@H]1C2 1884634877 OCJZMOHFTZITBH-PBXRRBTRSA-N 199.210 -2.042 50 10 AAGE C#CC(=O)Nc1ncccc1B(O)O 1913663269 JSWLZIGJUCVGSQ-UHFFFAOYSA-N 189.967 -1.667 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@H]1[C@H]1C[C@H]21 1955373189 NLQWWKIUZXFQJN-JWXFUTCRSA-N 195.222 -1.157 50 10 AAGE N#CNC(=O)c1ccoc1B(O)O 2241467952 DZUDBNIGUQYDHY-UHFFFAOYSA-N 179.928 -1.830 50 10 AAGE C[C@H](CCO)N(C)C(=O)C#CB(O)O 2241468873 WEDYBLXAIWBGFF-SSDOTTSWSA-N 199.015 -1.769 50 10 AAGE CC1(NC(=O)[C@H]2C[C@@H]2B(O)O)COC1 2241496973 YCTUBPVNKGQRHK-WDSKDSINSA-N 199.015 -1.246 50 10 AAGE NNC(=O)c1cnc[nH]c1=O 39136527 GKIAQFQBUDFAIR-UHFFFAOYSA-N 154.129 -1.627 50 10 AAGE OC[C@@H]1O[C@@H](O)[C@H](O)[C@@H](Cl)[C@@H]1O 65739228 CRJLKIILIKSPDH-HGVZOGFYSA-N 198.602 -1.975 50 10 AAGE in-vitro C/C(NN)=C1/C(=O)OC(=O)N(C)C1=O 210228223 IXBCRRKDUOZONX-ARJAWSKDSA-N 199.166 -1.141 50 10 AAGE NNC(=O)c1c(N)[nH]c2[nH][nH]c(=O)c12 238557727 CZMKELXTZDLHDS-UHFFFAOYSA-N 196.170 -1.630 50 10 AAGE COC1(C)CN(CC(=O)NN)C1 307604041 VCRYEJNTULTXDE-UHFFFAOYSA-N 173.216 -1.303 50 10 AAGE CC(=NNC(N)=O)[C@@](C)(N)CO 396781008 WQVAKYYVYQOMPV-LURJTMIESA-N 174.204 -1.260 50 10 AAGE CN1CC[C@@H](C(=O)NNC(N)=O)C1 706045239 RFFYIHZLOHPYHT-RXMQYKEDSA-N 186.215 -1.362 50 10 AAGE C[C@H](O)C1CN(C(=O)C(=O)NN)C1 719806151 FXQHNXPSMCAPPB-BYPYZUCNSA-N 187.199 -2.185 50 10 AAGE N#CC1=C(N2C[C@H](O)CO2)NC#CN1 885589558 LJFWGZXMQOVLEG-LURJTMIESA-N 192.178 -1.602 50 10 AAGE COC(=O)c1cncn1CC(=O)NN 1886724013 VWMMXPOYVXQYMA-UHFFFAOYSA-N 198.182 -1.340 50 10 AAGE CNNC(=O)[C@@H]1COCCN1C 1934629311 ZVZCRQUCMOOVQR-LURJTMIESA-N 173.216 -1.432 50 10 AAGE O=C(F)N1C[C@H](O)[C@H](O)[C@@H](CO)C1 2242199507 WARIGNBPJMRWLO-NGJCXOISSA-N 193.174 -1.278 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@H](O)[C@H]1C2 2297051971 LVLQEAPXGTZEKB-XVMARJQXSA-N 185.227 -1.569 50 10 AAGE CC(=O)NNC(=O)CCO 144808702 VLTBODOAXZXILZ-UHFFFAOYSA-N 146.146 -1.464 50 10 AAGE OB(O)c1cnc2ncccn12 200995314 YCAGNIQDPLSAPZ-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE C[C@H](CC(=O)NN)N1CC[C@H](N)C1 203229531 ZVGVMQPVMLRUIU-RQJHMYQMSA-N 186.259 -1.212 50 10 AAGE NNC(=O)C[C@H](N)[C@H](O)[C@H](O)CO 221452194 SONPCMUHTVOGBX-RPDRRWSUSA-N 193.203 -3.592 50 10 AAGE N[C@]12C[C@H](C(=O)O)C[C@H]1C(=O)OC2=O 306413999 UINIVQDXAXSOQB-PDJPSNROSA-N 199.162 -1.122 50 10 AAGE O=C1NCN[C@@H](O)[C@H]1Cl 306512180 PADFGQLYLYOUPH-GBXIJSLDSA-N 150.565 -1.411 50 10 AAGE NNc1ccc(S)c(B(O)O)c1 307388144 NQIMUHOBIGLURV-UHFFFAOYSA-N 184.029 -1.059 50 10 AAGE CC1CN(CC(=O)NN)C1 606243198 IGFIOGCKKDUIIY-UHFFFAOYSA-N 143.190 -1.072 50 10 AAGE NNC(=O)CN1CC(n2cccn2)C1 707399168 KIQGKXBWJZTNLZ-UHFFFAOYSA-N 195.226 -1.270 50 10 AAGE N[C@]1(B(O)O)CCCNC(=O)C1 1953493799 TWGYCAXEAZERFW-ZCFIWIBFSA-N 171.993 -2.004 50 10 AAGE Cc1n[nH]c(=NC(=O)NN)n1C 2242120493 KPDZFVCCOUZUOU-UHFFFAOYSA-N 170.176 -1.459 50 10 AAGE NNC(=O)C1(C(=O)NN)CCC1 4546928 HNZRYTZMPUHBHU-UHFFFAOYSA-N 172.188 -1.864 50 10 AAGE NC(=O)NNC(=O)CS 104560465 GVFKQAXDVODNRL-UHFFFAOYSA-N 149.175 -1.384 50 10 AAGE COC(=O)C(=O)NN(C)C 156813265 KGTJVDCWVHVHIZ-UHFFFAOYSA-N 146.146 -1.248 50 10 AAGE OCc1ncccc1B(O)O 200268750 AQZVIHYDPLDOEG-UHFFFAOYSA-N 152.946 -1.746 50 10 AAGE CC(C)(N)/C(CO)=N\NC(N)=O 238137341 OKJNCPGFWRAFSK-WTKPLQERSA-N 174.204 -1.260 50 10 AAGE NNC(=O)[C@@H](O)CCO 238554371 BPWOPQJLYWXIHI-VKHMYHEASA-N 134.135 -2.280 50 10 AAGE CO[C@H]1COCC[C@H]1NC(=O)NN 306758411 USRHMEPYNWUTFP-RITPCOANSA-N 189.215 -1.037 50 10 AAGE NCc1nc2cc(B(O)O)ccc2o1 306920930 OHDNUDQUXRAWQR-UHFFFAOYSA-N 191.983 -1.034 50 10 AAGE CC(=O)NN[C@@H](C)C(N)=O 307527454 SEBRITDSMPVMAF-VKHMYHEASA-N 145.162 -1.499 50 10 AAGE COCCONC(=O)NNC(N)=O 308332049 JEDJRYUQDHJBRK-UHFFFAOYSA-N 192.175 -1.553 50 10 AAGE CN(CCO)/C(N)=C(\C#N)[N+](=O)[O-] 687728872 MLDWJAUTMIREON-AATRIKPKSA-N 186.171 -1.161 50 10 AAGE NNC(=O)c1cnn2c1CNCC2 953077384 AENXQEQPRXLKQQ-UHFFFAOYSA-N 181.199 -1.410 50 10 AAGE CN1CCC(B(O)O)=CC1=O 1857789820 QHPBCPKVANKYPO-UHFFFAOYSA-N 154.962 -1.213 50 10 AAGE CCN(CC(=O)NN)S(C)(=O)=O 1913817561 IFVGZHWZVRVQCM-UHFFFAOYSA-N 195.244 -1.742 50 10 AAGE C[C@@H](NC(=O)C#CB(O)O)C1CC1 2241468866 WAAJEGPXBZCKOZ-ZCFIWIBFSA-N 181.000 -1.084 50 10 AAGE CC(=O)NNC(=O)CN1CC(N)C1 83636392 PTTSHIBXSXZFKY-UHFFFAOYSA-N 186.215 -2.203 50 10 AAGE CN(C)NC(=O)c1n[nH]c(N)n1 147253339 DGUJBKBFHRZNEO-UHFFFAOYSA-N 170.176 -1.407 50 10 AAGE COC(=O)[C@H]1CN(C)C[C@H]1B(O)O 203753526 QCSRLJWVHXCNJG-NTSWFWBYSA-N 187.004 -1.436 50 10 AAGE CN(N)C(=O)c1nc[nH]n1 575562177 WCFGNHAPQCOCGW-UHFFFAOYSA-N 141.134 -1.250 50 10 AAGE O[C@H]1[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1Cl 616586975 BSMLUJHFZGTHOG-SLWYWOEDSA-N 198.602 -2.588 50 10 AAGE CN1C[C@H]2CN(CC(=O)NN)C[C@@H]2C1 706308709 JHRFETVJKJDLON-YUMQZZPRSA-N 198.270 -1.530 50 10 AAGE C[C@@H]1OCC(=NNC(=O)C(N)=O)[C@H]1C 844565202 POTIJORZSKWHDA-WHFBIAKZSA-N 199.210 -1.001 50 10 AAGE O=C(NCC#CB(O)O)[C@H]1C[C@@H]1F 1883739773 YEAZUIWCMRBBDN-WDSKDSINSA-N 184.963 -1.524 50 10 AAGE NCc1cc(N)cc(B(O)O)c1 1887506305 ZKNUDHWUSVUJPT-UHFFFAOYSA-N 165.989 -1.593 50 10 AAGE NC[C@@H](C(=O)NN)[C@@H]1CCOC1 1930479474 FHIHOYYSMHXTIS-PHDIDXHHSA-N 173.216 -1.412 50 10 AAGE NNC(=O)[C@@H]1CO[C@H]2COC[C@H]12 1953462392 ISGIFOWIXJXDBR-PBXRRBTRSA-N 172.184 -1.362 50 10 AAGE OCCSc1ccc(B(O)O)cn1 2209386248 DBKZRWZKGHPMEI-UHFFFAOYSA-N 199.040 -1.154 50 10 AAGE O=C(C#CB(O)O)NC1(CO)COC1 2241478617 IZWZAWQKYVRZKP-UHFFFAOYSA-N 198.971 -3.121 50 10 AAGE OC[C@H]1O[C@H](O)[C@@H](Cl)[C@@H](O)[C@@H]1O 4475135 SNGNCYILSHZBLM-RXRWUWDJSA-N 198.602 -1.975 50 10 AAGE CC(=O)NN(CCO)C(C)=O 39212898 WEUXSQWFOUXCRP-UHFFFAOYSA-N 160.173 -1.122 50 10 AAGE CN/N=C1\NC(=O)C(C#N)=C1NNC 75595765 STVRESFAHZFDPW-UHFFFAOYSA-N 194.198 -1.849 50 10 AAGE Cn1c(C(=O)NN)cccc1=O 196490766 IFIWTEVIXOZEBW-UHFFFAOYSA-N 167.168 -1.011 50 10 AAGE O=CC1=C[C@@H](O)[C@@H](CO)O1 218199252 NWVFGYOPLJREHQ-PHDIDXHHSA-N 144.126 -1.179 50 10 AAGE C[C@H](Cl)C(=O)NC[C@@H](O)C(N)=O 228653005 GWMBPYYPMUVSSW-IUYQGCFVSA-N 194.618 -1.424 50 10 AAGE COc1ncc(B(O)O)cc1C=O 238397722 DMZRCGOFPKSKEK-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE Cc1cc(C(N)=O)ccc1B(O)O 238523564 XEJSTOBTZOEMSH-UHFFFAOYSA-N 178.984 -1.226 50 10 AAGE N#Cc1ncc(CN)cc1B(O)O 238692232 CFFQGKMCRMEWJI-UHFFFAOYSA-N 176.972 -1.908 50 10 AAGE CO[C@@H]1C[C@H](CO)N(C(=O)NN)C1 306484544 GDHCFYPDKIZNMC-PHDIDXHHSA-N 189.215 -1.349 50 10 AAGE CC(C)C[C@@H]1NC(=O)CN[B-]1(O)O 306608344 VVSLFCWCYOSACZ-LURJTMIESA-N 187.028 -1.417 50 10 AAGE COc1ccccc1[B-](O)(O)O 307577214 LRDZOZUUDWVFMH-UHFFFAOYSA-N 168.965 -1.182 50 10 AAGE N#C/C(=C\N)C(=O)NNC=O 514280146 FYYLCDIXIZAUBX-DAFODLJHSA-N 154.129 -1.870 50 10 AAGE COCC1=C=S=C(C(=O)NN)N1 885505442 QFTNWJMLZOKUGX-UHFFFAOYSA-N 187.224 -1.626 50 10 AAGE C[C-]1NC#CN(CCC(=O)NN)C1=O 885802758 IADUQLWKPUKDTN-UHFFFAOYSA-N 195.202 -1.732 50 10 AAGE COC1(C(=O)NCC#CB(O)O)CC1 1895075151 IKZWAFONOGYLJH-UHFFFAOYSA-N 196.999 -1.703 50 10 AAGE CN(C)NC(=O)[C@@]1(CO)CCCN1 1953954321 UJYGPZZMIXUDJM-QMMMGPOBSA-N 187.243 -1.306 50 10 AAGE C[C@@H](CN)Nc1cc(B(O)O)ccn1 2210061269 SKGUDJGPYHETIM-LURJTMIESA-N 195.031 -1.480 50 10 AAGE COC(=O)c1cc(B(O)O)cc(F)n1 206085531 AOXXNJZXXFHZKF-UHFFFAOYSA-N 198.946 -1.313 50 10 AAGE Cc1cc(C#N)cnc1B(O)O 238483511 VMKZUMQCUYDXQQ-UHFFFAOYSA-N 161.957 -1.059 50 10 AAGE O=Cc1ccncc1B(O)O 238637734 HNKXXYSKAYCXKM-UHFFFAOYSA-N 150.930 -1.426 50 10 AAGE COc1cc(NN)ccc1B(O)O 307063734 QFYJOZKYXCRLTH-UHFFFAOYSA-N 181.988 -1.339 50 10 AAGE NNc1cc(B(O)O)ccc1O 307437927 SJTHSNFPJWYQPQ-UHFFFAOYSA-N 167.961 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AAGE Cn1ccnc1CB(O)O 211924946 ZQJCEDVLZCUKSH-UHFFFAOYSA-N 139.951 -1.025 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2C[C@H]1CO2 307161143 WTTPXHUFFJRWSZ-DSYKOEDSSA-N 185.227 -1.162 50 10 AAGE CN(CC[S@@](C)=O)C(=O)NN 307656080 PMMVRMISRSBHQP-LLVKDONJSA-N 179.245 -1.120 50 10 AAGE CC(C)C(=O)NNC(=O)CC(N)=O 308227092 FGDNUYGDBUBQQD-UHFFFAOYSA-N 187.199 -1.335 50 10 AAGE O=CNN=C[C@H](O)[C@@H](O)[C@@H](O)CO 308231923 TYLXBMBILSJXNP-HCWXCVPCSA-N 192.171 -3.207 50 10 AAGE C[S@@](=O)CC(=O)NN 526872660 YIEOTIMRPCMIKT-MRVPVSSYSA-N 136.176 -1.645 50 10 AAGE CN1C[C@H]2COC[C@]2(C(=O)NN)C1 708200034 CYOWECWOVLLANS-POYBYMJQSA-N 185.227 -1.446 50 10 AAGE CN(NC(=O)CNO)S(C)(=O)=O 1888604956 BCTUFHSVMGNUQW-UHFFFAOYSA-N 197.216 -2.112 50 10 AAGE NNC(=O)CN1C[C@H](C2CC2)[C@@H](O)C1 1929071601 QKLSWGSHVCFEEZ-SFYZADRCSA-N 199.254 -1.321 50 10 AAGE CO[C@H]1CNCC[C@H]1C(=O)NN 1932346428 APKFZAJZEVOBQV-RITPCOANSA-N 173.216 -1.399 50 10 AAGE C[C@H]1CNCCN1C(=O)NN 1953267566 IIJJJCHKLLZOOS-YFKPBYRVSA-N 158.205 -1.137 50 10 AAGE C[C@H]1COC[C@@H](C(=O)NN(C)C)N1 1953942877 UHZKFDWMNJBNTQ-BQBZGAKWSA-N 187.243 -1.044 50 10 AAGE NC(=O)[C@@H](O)CNC(=O)C#CB(O)O 2241475924 IEZAFYXEMYBLNJ-BYPYZUCNSA-N 199.959 -4.036 50 10 AAGE O=C(NO)c1sncc1B(O)O 2241584015 HYEVNRSRTSLAAF-UHFFFAOYSA-N 187.973 -2.058 50 10 AAGE C[C@H](CF)N(C)C(=O)C#CB(O)O 2241733193 SUCFBAJPURFQBJ-ZCFIWIBFSA-N 186.979 -1.182 50 10 AAGE CN(CCO)C(=O)NN 37899726 AVJQIZIASXPQBM-UHFFFAOYSA-N 133.151 -1.506 50 10 AAGE OB(O)C1=CCNC1 200987379 VHOVLXMLZLNXEO-UHFFFAOYSA-N 112.925 -1.472 50 10 AAGE CO[C@]1(C(=O)NN)CCNC1 575549654 LILHAEWFBDICPW-ZCFIWIBFSA-N 159.189 -1.645 50 10 AAGE COCCOC1CN(C(=O)NN)C1 707347224 QANGGJJVFOQSMA-UHFFFAOYSA-N 189.215 -1.083 50 10 AAGE N#CC1=CCN(C[C@@H](N)C(N)=O)CC1 1917098520 UDKYKLZXWPWZIC-MRVPVSSYSA-N 194.238 -1.045 50 10 AAGE C[C@H](O)[C@@H](N)[C@@H](O)C#N 1952796164 VBCDNPYVVBRROZ-VAYJURFESA-N 130.147 -1.421 50 10 AAGE CN(CC(=O)NN)C[C@@H]1[C@@H]2COC[C@@H]21 1957269336 JPYDKCBSGGLADQ-RNLVFQAGSA-N 199.254 -1.200 50 10 AAGE NC(=O)NNC(=O)c1ccno1 2209079455 GQHLXSOTHKCALH-UHFFFAOYSA-N 170.128 -1.012 50 10 AAGE O=C(O)C=CCNC(=O)C#CB(O)O 2241583782 DFEYFQZLLZRGMZ-UHFFFAOYSA-N 196.955 -2.241 50 10 AAGE NNC(=O)CNc1cn[nH]c(=O)n1 3072168 ILDCUVVEILXKAG-UHFFFAOYSA-N 184.159 -2.433 50 10 AAGE C[C@@H](NNC(N)=O)C(=O)O 38887925 BCWAVSSLHRDPOL-UWTATZPHSA-N 147.134 -1.368 50 10 AAGE CC[C@@H](CO)NC(=O)C(=O)NN 58847081 KBHAMNBWJWEZHR-BYPYZUCNSA-N 175.188 -2.137 50 10 AAGE CCCN[C@H]1COC[C@@H]1C(=O)NN 85390123 CTBRBXBOOKYMHE-BQBZGAKWSA-N 187.243 -1.009 50 10 AAGE CCn1ncc(N)c1B(O)O 204479382 ZLBWUBMPAHGUEP-UHFFFAOYSA-N 154.966 -1.835 50 10 AAGE Cn1c(NNC(N)=O)cc(=O)[nH]c1=O 238538786 RGPSOHABUXUILW-UHFFFAOYSA-N 199.170 -1.931 50 10 AAGE O[C@H]1CO[C@H](CCl)[C@@H](O)[C@@H]1O 238705910 AHPRTTITVYSBFI-SLPGGIOYSA-N 182.603 -1.293 50 10 AAGE COC(=O)Nc1ccnc(B(O)O)c1 405188036 QCOFHMKBUXFMIL-UHFFFAOYSA-N 195.971 -1.060 50 10 AAGE N#C/C(=C(/N)NCCO)[N+](=O)[O-] 687808170 JFJQDOJPYLCZSY-SNAWJCMRSA-N 172.144 -1.504 50 10 AAGE OC[C@@H]1O[C@H](O)[C@@H](O)[C@H](Cl)[C@H]1O 1085210835 CRJLKIILIKSPDH-GNFDWLABSA-N 198.602 -1.975 50 10 AAGE COC[C@H]1C[C@@H]1C(=O)NNC(N)=O 1882998560 WLYUQEWTKGRJLI-UHNVWZDZSA-N 187.199 -1.032 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@]12CCOC2 1895344368 RISPBAFPRDHDQZ-XRGYYRRGSA-N 199.210 -1.729 50 10 AAGE NNC(=O)C(=O)N=c1ccnc(O)[nH]1 1933173630 WPFWOYFUIMOIIH-UHFFFAOYSA-N 197.154 -2.468 50 10 AAGE NNC(=O)[C@@H]1CC(C(=O)O)=NO1 1953470611 ASUONICJSUELLQ-VKHMYHEASA-N 173.128 -1.794 50 10 AAGE CN(C)NC(=O)[C@@H]1CCOC[C@@H]1N 1954417954 VNKFLVOIWGFNRH-RQJHMYQMSA-N 187.243 -1.057 50 10 AAGE C[C@H](C(=O)NN)N(C)Cc1ncon1 1955516904 WDAWXXIWGZIXDM-RXMQYKEDSA-N 199.214 -1.120 50 10 AAGE Cc1cnc2c(B(O)O)cnn2c1 2209400430 VVHZTKDCIUQHGB-UHFFFAOYSA-N 176.972 -1.282 50 10 AAGE C[C@@H](CO)Nc1ncccc1B(O)O 2210060978 OXLQNKXBPQWEIA-LURJTMIESA-N 196.015 -1.446 50 10 AAGE Cc1cc(C(=O)N(C)O)oc1B(O)O 2241479860 GAYVQTLFJLYBDH-UHFFFAOYSA-N 198.971 -1.271 50 10 AAGE NNC(=O)[C@H]1CCOCCN1 2241664685 UDEOKIYNTOYZSX-RXMQYKEDSA-N 159.189 -1.645 50 10 AAGE OCC#CCN1CCC(B(O)O)CC1 2241742231 XEOJJSSXEGMKMR-UHFFFAOYSA-N 197.043 -1.079 50 10 AAGE NNC(=O)CN1CC[C@@H]1[C@H](O)CO 2241811049 LIQABIIXZYTYDL-PHDIDXHHSA-N 189.215 -2.596 50 10 AAGE C/C(NN)=C(/C(=O)NN)[N+](=O)[O-] 205817520 COCIMMBMYGTOAQ-NSCUHMNNSA-N 175.148 -2.052 50 10 AAGE NNC(=O)c1nnc(N)s1 207709623 UFTNZMWGIOLOKY-UHFFFAOYSA-N 159.174 -1.276 50 10 AAGE COCCc1cc(B(O)O)ccn1 221603779 RDSPNMMYAHWTOF-UHFFFAOYSA-N 181.000 -1.050 50 10 AAGE C[C@@H](Cl)C(=O)NC[C@H](O)C(N)=O 228653015 GWMBPYYPMUVSSW-DMTCNVIQSA-N 194.618 -1.424 50 10 AAGE CN(C)NC(=O)c1ncnnc1N 238337491 NGDOOKCAPBDIGH-UHFFFAOYSA-N 182.187 -1.340 50 10 AAGE O=CC1=C[C@H](O)[C@H](O)CO1 238674531 SOWXNHCSGHGSDY-NTSWFWBYSA-N 144.126 -1.179 50 10 AAGE CONC(=O)NNC(C)=O 306219618 GPWOINCPSMDSDW-UHFFFAOYSA-N 147.134 -1.102 50 10 AAGE O=C(CO)NNC1=NCCOC1 306665465 YFLQQPCLVNFHPU-UHFFFAOYSA-N 173.172 -1.972 50 10 AAGE Cc1nc(B(O)O)ccc1O 307075543 CHAGEXLAPNKKIX-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE NCCNNC(=O)[C@H]1COCCN1 308553925 YPEFOHOFEXHUOI-ZCFIWIBFSA-N 188.231 -2.446 50 10 AAGE Cc1ncoc1C(=O)NCB(O)O 706531521 YXYFDYUUYPSQHH-UHFFFAOYSA-N 183.960 -1.275 50 10 AAGE CO[C@@H]1CCNC[C@@H]1C(=O)NN 1880974564 WHRNHCAZOSDABN-NTSWFWBYSA-N 173.216 -1.399 50 10 AAGE O=C(F)N=c1nc(B(O)O)[nH]s1 1881032816 FLIQZVDYLWFINH-UHFFFAOYSA-N 190.952 -1.859 50 10 AAGE C[C@H]1[C@H](O)CN1[C@H](C)CC(=O)NN 1882447055 OFILUOLWWHFEOP-DSYKOEDSSA-N 187.243 -1.180 50 10 AAGE CO[C@@H]1C[C@@H]1C(=O)NCC=CB(O)O 1892925473 UZURDDUKCMPZNC-NKWVEPMBSA-N 199.015 -1.294 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2C[C@@]2(CO)C1 1899605580 KXBANBPEDVATIR-BHNWBGBOSA-N 199.254 -1.321 50 10 AAGE O=C(NNCCO)[C@H]1CC=CCO1 1931606248 GINUZVDZUVTMQE-SSDOTTSWSA-N 186.211 -1.055 50 10 AAGE C[C@]1(F)CCN(C(=O)C(=O)NN)C1 1932098710 ABAXWGVBDWFLAN-ZETCQYMHSA-N 189.190 -1.063 50 10 AAGE O=C(Nc1nn[nH]n1)C1(B(O)O)CC1 2241473832 QYBYHUXERZZLJI-UHFFFAOYSA-N 196.963 -1.855 50 10 AAGE CCN(CCOC)C(=O)C(=O)NN 42496440 DUTHIWGZQAFMHY-UHFFFAOYSA-N 189.215 -1.529 50 10 AAGE C[C@H](O)CNC(=O)CCC(=O)NN 58840483 PHGCZYQRMWPUSU-YFKPBYRVSA-N 189.215 -1.747 50 10 AAGE C[C@@H](O)C(=O)NC(=O)N(C)N 168029631 AEJLNWQHWLYDJN-GSVOUGTGSA-N 161.161 -1.591 50 10 AAGE NNC(=O)c1cnn(CCO)c1N 238562548 PTKBFDUMPRKRRC-UHFFFAOYSA-N 185.187 -1.939 50 10 AAGE N#Cc1cc(C(=O)O)c(B(O)O)cn1 238632090 XNHSLLLUEVLQIR-UHFFFAOYSA-N 191.939 -1.669 50 10 AAGE NC(=S)NNC(=O)NCCCO 308078228 HBKFNAIIDYDBEH-UHFFFAOYSA-N 192.244 -1.584 50 10 AAGE C[C@H]1[C@@H](O)CN1C[C@@H](C)C(=O)NN 1882448678 YZEHJCSVWMJUIB-VQVTYTSYSA-N 187.243 -1.323 50 10 AAGE NNC(=O)C(=O)NC[C@@H]1[C@H]2CCO[C@@H]12 1884457672 ZSHLIUFYBSKORX-HSUXUTPPSA-N 199.210 -1.873 50 10 AAGE NNC(=O)[C@H](N)C[C@@H]1CCCO1 1926582511 IKWCQLMSAIAWHD-NTSWFWBYSA-N 173.216 -1.127 50 10 AAGE NNC(=O)C(=O)NC[C@@H]1[C@@H]2COC[C@@H]21 1957265577 KTBJPKCKKGWFEP-FPFOFBBKSA-N 199.210 -2.015 50 10 AAGE N[C@@]1(B(O)O)C[C@H]2CC[C@H]1O2 2208968029 OUCAMNUHKKMXPX-PBXRRBTRSA-N 156.978 -1.353 50 10 AAGE C#CCCCCNC(=O)C#CB(O)O 2241479282 VOVXJXYAWXZCOQ-UHFFFAOYSA-N 193.011 -1.079 50 10 AAGE O=C(NC1(CO)CC1)[C@H]1C[C@H]1B(O)O 2241479772 FKGNUOBNGVYAFU-NTSWFWBYSA-N 199.015 -1.510 50 10 AAGE CN(C)NC(=O)c1nc(CN)no1 2241730167 CMVAXWBPWZCQGI-UHFFFAOYSA-N 185.187 -1.265 50 10 AAGE CC(C)[C@@H](O)C(=O)NN 82464771 VXPCKFRTFWHVDK-SCSAIBSYSA-N 132.163 -1.007 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2CC[C@@H]1C2 104898971 JXODXXDEFRNOHJ-PHDIDXHHSA-N 183.211 -1.013 50 10 AAGE NC(N)=NCCC[C@@H](N)B(O)O 195809959 ACTXPNAHMKBUTO-SCSAIBSYSA-N 174.013 -2.621 50 10 AAGE COC[C@H](OC)C(=O)NN 232417470 BFZNKYBVNDZWNW-BYPYZUCNSA-N 148.162 -1.362 50 10 AAGE COc1ncc(CO)cc1B(O)O 238411842 OHODGYLSNBJLRA-UHFFFAOYSA-N 182.972 -1.738 50 10 AAGE N#CC1=C(N)NC(N)=C(C#N)N1 238626878 IFTDBWJYOBVIGE-UHFFFAOYSA-N 162.156 -1.518 50 10 AAGE C[C@@]1(CO)CCN(CC(=O)NN)C1 307046884 YZYGHKIUMADKPY-MRVPVSSYSA-N 187.243 -1.319 50 10 AAGE CN(N=Cc1nnn(C)n1)C(N)=O 379402885 OAJXRBXKYGAXTD-UHFFFAOYSA-N 183.175 -1.446 50 10 AAGE CN(C)C(=O)NNC(=O)CO 1631398581 KFMNCEACEUYLRU-UHFFFAOYSA-N 161.161 -1.719 50 10 AAGE C[C@@H]1C[C@@]1(F)CNC(=O)C(=O)NN 1878093574 GMOOSFXRGNBHHY-CLZZGJSISA-N 189.190 -1.159 50 10 AAGE C[C@]1(O)C[C@H]2C[C@H]1N(CC(=O)NN)C2 1888539654 XKNXMDKCWCXVSC-BHNWBGBOSA-N 199.254 -1.179 50 10 AAGE NCCOc1cc(B(O)O)c(F)cn1 1892564160 CXLKQXXZNHXJBH-UHFFFAOYSA-N 199.978 -1.762 50 10 AAGE COC[C@H](N)C(=O)NNC(C)C 1923872236 RBIAQTGBPUIPKE-LURJTMIESA-N 175.232 -1.011 50 10 AAGE NNC(=O)CNO 1953128970 WATXGBPTNAMKNO-UHFFFAOYSA-N 105.097 -2.045 50 10 AAGE CNC(=O)c1cc(B(O)O)c[nH]1 2241467756 ANCLAGJARCCGMO-UHFFFAOYSA-N 167.961 -1.946 50 10 AAGE O=C(C#CB(O)O)N1CC=C[C@@H]1CO 2241467966 FFHVXUGOZOOKIO-SSDOTTSWSA-N 194.983 -2.239 50 10 AAGE C[C@@H]1C[C@@H]1NC(=O)C#CB(O)O 2241468066 GUEXUTHXGZVMOT-RITPCOANSA-N 166.973 -1.474 50 10 AAGE C#CC1(F)CN(C(=O)C#CB(O)O)C1 2241468573 QPGRGXRJEOZQPI-UHFFFAOYSA-N 194.958 -1.815 50 10 AAGE C#C[C@@H]1CCN1C(=O)C#CB(O)O 2241468859 VVIBMBFCGNEBEY-SSDOTTSWSA-N 176.968 -1.764 50 10 AAGE CC(C)NC(=O)c1c[nH]nc1B(O)O 2241478580 IGHLTOGSZBCSOV-UHFFFAOYSA-N 197.003 -1.772 50 10 AAGE COC(=O)NC[C@@H](C)NC(=O)NN 2241778850 OORCNXPTRQBIGB-SCSAIBSYSA-N 190.203 -1.096 50 10 AAGE C[C@H](CN1CCNCC1)C(=O)NN 82469787 DUCPAMSORJJAPV-SSDOTTSWSA-N 186.259 -1.482 50 10 AAGE COc1cc(C(=O)O)cc(B(O)O)n1 206051787 QFNPNVQGGJEECY-UHFFFAOYSA-N 196.955 -1.532 50 10 AAGE O=Cc1ccnc(B(O)O)c1 306463330 LJUSWYBRXRGFLE-UHFFFAOYSA-N 150.930 -1.426 50 10 AAGE COC1CN(C(=O)C(=O)NN)C1 307532185 YQFREHKIMZRGQU-UHFFFAOYSA-N 173.172 -2.167 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@@H]2C1=O 715701796 MMXXDTMWYOHRES-UHNVWZDZSA-N 169.184 -1.545 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H]1CO2 718285410 AVNOOQXKNAONDI-WHFBIAKZSA-N 185.183 -2.024 50 10 AAGE NNC(=O)CN1CC=C[C@@H](O)C1 1953647014 DBOBGXNQHZQHRY-ZCFIWIBFSA-N 171.200 -1.791 50 10 AAGE CO[C@H]1C[C@@H](O)CN(C(=O)NN)C1 1954843092 DAPSYYYJUBQLRY-RITPCOANSA-N 189.215 -1.349 50 10 AAGE O=C(Nc1ncon1)[C@H]1C[C@@H]1B(O)O 2241481305 QYPBGCBTLXHYPI-IMJSIDKUSA-N 196.959 -1.129 50 10 AAGE C[C@@H](N)C(=O)N(C)N 59378801 OUGPXJZICUDSLI-GSVOUGTGSA-N 117.152 -1.334 50 10 AAGE C[C@H](C[S@](C)=O)NC(=O)NN 229034927 AGVYQVGURXBSAC-IBDLBZOISA-N 179.245 -1.074 50 10 AAGE Cc1nc(O)ncc1B(O)O 238561342 HTJUNTUGDRNCPL-UHFFFAOYSA-N 153.934 -1.830 50 10 AAGE C=NNC(=O)C(=O)NC(N)=O 238580258 MITHKVRENFYQHN-UHFFFAOYSA-N 158.117 -2.087 50 10 AAGE C[C@@H](CN(C)[C@H](C)CO)C(=O)NN 252804999 FAJVONIHTAXMGD-NKWVEPMBSA-N 189.259 -1.075 50 10 AAGE NNC(=O)c1c[nH]nc1C(=O)NN 306178736 UESSKYWLCYVPRZ-UHFFFAOYSA-N 184.159 -2.383 50 10 AAGE NC(=O)N/N=C/[C@H](O)C(=O)O 307326661 NEWZAHLNBOVJRJ-ZESVYOSMSA-N 161.117 -1.914 50 10 AAGE C[C@H](O)C(=O)NNC(=O)CCO 308177571 ZXXJWUWJJOSVIR-BYPYZUCNSA-N 176.172 -2.103 50 10 AAGE O=CNNC(=O)CCn1ccnn1 308388944 WTEMNQRTWSDFGY-UHFFFAOYSA-N 183.171 -1.555 50 10 AAGE NNC(=O)C(=O)N1CCC[C@@H](F)C1 606261080 YBSADQIFXLRHPI-RXMQYKEDSA-N 189.190 -1.063 50 10 AAGE COC(=O)Cc1ccncc1B(O)O 1885664675 QBZXCDFPABSUEQ-UHFFFAOYSA-N 194.983 -1.523 50 10 AAGE C[C@H]1[C@@H](O)CCN1CCC(=O)NN 1914255897 OZIBYCNQJAIPOP-BQBZGAKWSA-N 187.243 -1.179 50 10 AAGE C#CCC(=O)NC1(B(O)O)CC1 1923803016 VFZGFEHIBKTLNC-UHFFFAOYSA-N 166.973 -1.330 50 10 AAGE NNC(=O)C1(B(O)O)CCC1 2241474170 XVTGNFUGGPRJPJ-UHFFFAOYSA-N 157.966 -1.627 50 10 AAGE CN(C)C(=O)c1c(B(O)O)cnn1C 2241480037 DAUULGKTFLYIFG-UHFFFAOYSA-N 197.003 -2.198 50 10 AAGE NC(=O)N(CCO)[N+](=O)[O-] 104633792 OQYAVPGJXUPUEJ-UHFFFAOYSA-N 149.106 -1.449 50 10 AAGE CC(=O)NC[C@H](O)CC(=O)NN 140536232 BJDOQCCNDCFDJD-RXMQYKEDSA-N 175.188 -2.137 50 10 AAGE C[C@H](CC(=O)NN)C(=O)NN 201840435 FHHKCFYYCSYEKX-GSVOUGTGSA-N 160.177 -2.008 50 10 AAGE [N-]=[N+]=N[C@@H](CC(=O)NN)C(=O)NN 238659052 GDYVDGPAQOESTG-REOHCLBHSA-N 187.163 -1.965 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@](C)(O)C1 300028366 FIXUBZLSZLYTPZ-XPUUQOCRSA-N 187.243 -1.179 50 10 AAGE CC(C)(CN1CC(O)C1)C(=O)NN 306682277 QSYVPRQZDYPMOP-UHFFFAOYSA-N 187.243 -1.321 50 10 AAGE N#CCc1ccc(B(O)O)cc1NN 307356661 ZKWPJHIOZIOXRI-UHFFFAOYSA-N 190.999 -1.282 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H]2C[C@@H]2C1 699257683 ATYTULIVMYLVEY-PHDIDXHHSA-N 183.211 -1.155 50 10 AAGE Cc1nnc(NNC(=O)[C@@H](C)O)n1C 1329065883 AVWUCMGAMKDQKR-SCSAIBSYSA-N 199.214 -1.053 50 10 AAGE NNC(=O)[C@@H]1CNC[C@@H]1F 1880008925 KENQDTWPPHLGJM-DMTCNVIQSA-N 147.153 -1.466 50 10 AAGE COC(=O)C[C@@H](N)C(=O)NN 1887619297 XYOJCGVEQCECTL-GSVOUGTGSA-N 161.161 -2.133 50 10 AAGE NNC(=O)NC1COC1 1953146854 JYELPFDSGJAMOZ-UHFFFAOYSA-N 131.135 -1.442 50 10 AAGE C[C@H](C(=O)NN)N1CC(F)(CO)C1 1954084103 ADPVAYJSGZWQCK-RXMQYKEDSA-N 191.206 -1.619 50 10 AAGE N#CNCc1cnc(B(O)O)s1 2241555938 RNQJWBZLSQJRPZ-UHFFFAOYSA-N 183.001 -1.606 50 10 AAGE Cn1cc(C#CB(O)O)cn1 2297007307 LYQMDVYXZKIYKT-UHFFFAOYSA-N 149.946 -1.216 50 10 AAGE CCCC(C(=O)NN)C(=O)NN 26892155 JPYIPVWCUPWGQH-UHFFFAOYSA-N 174.204 -1.618 50 10 AAGE CC1(C)C[C@H]1NC(=O)C(=O)NN 45140631 RXKBFGMTIGKFFS-SCSAIBSYSA-N 171.200 -1.109 50 10 AAGE NNC(=O)CN1CCN(C2CC2)CC1 82470862 KPDLQRNAUUCDAD-UHFFFAOYSA-N 198.270 -1.244 50 10 AAGE NNC(=O)[C@@H]1CCC[C@@]1(O)NN 104534603 VKNSZBFOQLMJBT-NJGYIYPDSA-N 174.204 -2.072 50 10 AAGE CN1CC[C@H](C[C@@H](N)C(=O)NN)C1 258975549 IRLFOQNQOAPYKG-RNFRBKRXSA-N 186.259 -1.355 50 10 AAGE CS(=O)(=O)CC=NNC(N)=O 307803985 RYTRLKBTVLFOLW-UHFFFAOYSA-N 179.201 -1.315 50 10 AAGE CNNC(=O)c1nc[nH]n1 575547407 BAZBJAHVOJPSPX-UHFFFAOYSA-N 141.134 -1.331 50 10 AAGE CC(=O)NCCC(=O)NNC(N)=O 700880432 WJJQLEMTAVUSKW-UHFFFAOYSA-N 188.187 -1.788 50 10 AAGE CN1C[C@H](C(=O)NN)NC1=O 852874618 SKIYNIVQPBENGL-GSVOUGTGSA-N 158.161 -2.000 50 10 AAGE NNC(=O)N1CC[C@@H](O)[C@H](O)C1 1881080003 DSJSNVJBFBVISR-RFZPGFLSSA-N 175.188 -2.003 50 10 AAGE COC(C)(C)C(=O)NCC#CB(O)O 1895240091 VUMDZMRXKATZJG-UHFFFAOYSA-N 199.015 -1.457 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@H]1[C@@H]2CO 1902449858 ZZQUFHPUFQONMC-PBXRRBTRSA-N 199.210 -2.185 50 10 AAGE Cn1cc([C@H](N)C(=O)NN)nn1 1953375121 GESWSADKGSEPPR-BYPYZUCNSA-N 170.176 -2.195 50 10 AAGE COC1(C(N)=O)CN(C(=O)NN)C1 1954529207 LSZBLJJEFDQUTD-UHFFFAOYSA-N 188.187 -2.244 50 10 AAGE NNC(=O)CCN1CC=C[C@H](O)C1 1954842898 YVDUHOPMOGYCBW-ZETCQYMHSA-N 185.227 -1.401 50 10 AAGE O=C(CCl)N(CO)CO 60044529 SXVFGEJOKLTATI-UHFFFAOYSA-N 153.565 -1.047 50 10 AAGE CN(C)CC[S@@](=O)CC(=O)NN 526892375 MXQVBQRJJRNCFM-GFCCVEGCSA-N 193.272 -1.713 50 10 AAGE C=CCOCCn1ccc(B(O)O)n1 694309267 PUUCWZVZKUCBOA-UHFFFAOYSA-N 196.015 -1.235 50 10 AAGE CC(=O)NNC(=O)[C@@H]1CCNC1=O 1440724853 YTXOGGRBGOIJDX-RXMQYKEDSA-N 185.183 -1.710 50 10 AAGE CN(C)NC(=O)C1(N)CC(O)C1 1881244476 RMLVVKCACBQXFL-UHFFFAOYSA-N 173.216 -1.569 50 10 AAGE CCCn1cccc(B(O)O)c1=O 1882114732 DYCYENMFSPJULQ-UHFFFAOYSA-N 181.000 -1.062 50 10 AAGE C[C@H](CN1CC(CO)C1)C(=O)NN 1929743362 PEEBFTFCVQWTQP-ZCFIWIBFSA-N 187.243 -1.464 50 10 AAGE NNC(=O)[C@H]1CC(C(=O)O)=NO1 1953470610 ASUONICJSUELLQ-GSVOUGTGSA-N 173.128 -1.794 50 10 AAGE COC[C@@H](CF)NC(=O)C(=O)NN 1954130656 TZOWLMRIQJSFPF-SCSAIBSYSA-N 193.178 -1.923 50 10 AAGE CCN(OC)c1ncc(B(O)O)cn1 1956960626 DAJXKPYYCFDDKU-UHFFFAOYSA-N 197.003 -1.456 50 10 AAGE OB(O)c1cnc(NC2CNC2)nc1 2210060274 HWAZSDFULCVNEW-UHFFFAOYSA-N 194.003 -2.460 50 10 AAGE CN(C)NC(=O)C1(B(O)O)CC1 2241472981 AVRKCVUMFQVRDI-UHFFFAOYSA-N 171.993 -1.414 50 10 AAGE CO[C@@H](C)[C@H](C)NC(=O)C#CB(O)O 2241476308 PJJRDKWOOQFPMM-BQBZGAKWSA-N 199.015 -1.459 50 10 AAGE N[C@H]1C[C@@H]1NC(=O)C1CC(B(O)O)C1 2241481686 XKVAKBBMOAWJSY-FTDRKVFOSA-N 198.031 -1.545 50 10 AAGE C=C(C)C(=O)NCC#CB(O)O 2241561004 XYWKSSOYLTXQDQ-UHFFFAOYSA-N 166.973 -1.306 50 10 AAGE Cn1ccc(=O)n(CC(=O)NN)c1=O 82614907 IJTFCDHOUHBDGG-UHFFFAOYSA-N 198.182 -2.463 50 10 AAGE C[C@@H](CN)CC(=O)NN 87987275 JLTXNJBEHZFOPD-SCSAIBSYSA-N 131.179 -1.039 50 10 AAGE NC(N)=Nc1cccc(B(O)O)c1 196489534 LUPAACXLIDTMOT-UHFFFAOYSA-N 178.988 -1.729 50 10 AAGE NC1=NC(=O)[C@H](Cl)C(=O)N1 214858941 VPBAIEZSNGLOHW-UHFFFAOYSA-N 161.548 -1.435 50 10 AAGE NC(=O)C(=O)NN=C1CCCOC1 379375473 PSLQODHGHGGPIB-UHFFFAOYSA-N 185.183 -1.246 50 10 AAGE CC(=NN)[C@H](C#N)C(=O)NN 396769339 GYVVTNCGABLFNY-BYPYZUCNSA-N 155.161 -1.549 50 10 AAGE NC[C@H]1CCO[C@@H]1C(=O)NN 715316207 JCDHDJORYFDRFN-UHNVWZDZSA-N 159.189 -1.660 50 10 AAGE C#CC[C@@H](C)C(=O)NCB(O)O 1881336525 VCIGSANMDFAQOX-ZCFIWIBFSA-N 168.989 -1.226 50 10 AAGE C[C@H](CN1CC=C[C@@H]1CO)C(=O)NN 1884401042 WPBGEWGPFVVXSD-HTQZYQBOSA-N 199.254 -1.155 50 10 AAGE CCO[C@H]1CN[C@H](C(=O)NN)C1 1923557381 VBYNEPXBWFWRPM-RITPCOANSA-N 173.216 -1.257 50 10 AAGE NNC(=O)[C@@]1(O)CCCNC1 1923842728 PIGPRDGVJLUBAU-ZCFIWIBFSA-N 159.189 -1.909 50 10 AAGE N#C[C@H](O)[C@H](N)CCn1cnnn1 1952976873 UMTAQDXQFLPCBO-RITPCOANSA-N 182.187 -1.725 50 10 AAGE Cc1cnc(NO)cc1B(O)O 2209094716 WUZVWFUEVNPWCQ-UHFFFAOYSA-N 167.961 -1.129 50 10 AAGE NOCCNC(=O)C1(B(O)O)CC1 2241473943 SWPKBUAMRRUBJC-UHFFFAOYSA-N 187.992 -2.000 50 10 AAGE N[C@H]1CC[C@H]1NC(=O)C1(B(O)O)CC1 2241474095 WLEZQTJGBYSXSA-NTSWFWBYSA-N 198.031 -1.401 50 10 AAGE O=C(C#CB(O)O)N1CC[C@@H]2C[C@H]2C1 2241479027 PXYYQMOYBBSQST-SFYZADRCSA-N 193.011 -1.130 50 10 AAGE O=C(NO)[C@H]1C[C@H](B(O)O)C1 2241584088 JFVRLXRYIQWSRU-JPYJGEKTSA-N 158.950 -1.255 50 10 AAGE C=CCNC(=O)c1cocc1B(O)O 2241748626 KYLXNBDOPUFIBF-UHFFFAOYSA-N 194.983 -1.125 50 10 AAGE Cc1cc(CNC(=O)C(=O)NN)on1 45014850 PBVATMZGLCBWAK-UHFFFAOYSA-N 198.182 -1.411 50 10 AAGE NNC(=O)CCN1CC[C@H](O)C1 82471126 ZFWMARQQYQVTLO-LURJTMIESA-N 173.216 -1.567 50 10 AAGE C[C@@]1(O)NC(=O)OC1=O 100223053 NKKGGKDVSHPUMY-BYPYZUCNSA-N 131.087 -1.039 50 10 AAGE CC(=O)O[C@@H]1C(C=O)=CC(=O)[C@H]1O 105595570 BAHPNTWLZYOEAX-HTQZYQBOSA-N 184.147 -1.013 50 10 AAGE NNC(=O)[C@H]1CSCCN1 116320510 KKXFIMLDHBXEIN-SCSAIBSYSA-N 161.230 -1.319 50 10 AAGE CN(C)[C@H](CN)B(O)O 238295971 YGBXTVFIJXZJTE-SCSAIBSYSA-N 131.972 -2.113 50 10 AAGE NCc1ncc(N)cc1B(O)O 238607829 CYQOEXBCGHSMPR-UHFFFAOYSA-N 166.977 -2.198 50 10 AAGE [C-]#[N+]C1=C[C@H](O)[C@](O)([C@@H](C)O)[C@H]1O 306234460 DIACYUPTLLZTEL-YDKYIBAVSA-N 185.179 -1.363 50 10 AAGE NNC(=O)N1C[C@H](O)[C@@H](CO)C1 306596435 VIXUQKSYXJFUIP-UHNVWZDZSA-N 175.188 -2.145 50 10 AAGE CN(N)C(=O)Cn1ccc(O)nc1=O 704706750 OVAZGDTXFGAGQZ-UHFFFAOYSA-N 198.182 -1.719 50 10 AAGE CNNC(=O)[C@@H](C)S(C)(=O)=O 707580293 QLVKRPAUCAUCIT-SCSAIBSYSA-N 180.229 -1.330 50 10 AAGE NC(=O)CC(=O)NNc1cccnn1 1342280741 VZLRXQIRMXUJKE-UHFFFAOYSA-N 195.182 -1.205 50 10 AAGE CN1C[C@@H]2C[C@H](C1)N2CCC(=O)NN 1887162747 IDOWKKFHVOHBLQ-OCAPTIKFSA-N 198.270 -1.245 50 10 AAGE C[C@@]1(B(O)O)CCN(C(=O)CO)C1 1891517267 MSHQEUYPLHMERA-SSDOTTSWSA-N 187.004 -1.556 50 10 AAGE OB(O)c1cccnc1N1CCCO1 1956968205 IPZWMYCVXDJJIG-UHFFFAOYSA-N 193.999 -1.097 50 10 AAGE N[C@@H]1C[C@H]1NC(=O)C#CB(O)O 2241468012 FWGHUNZBLAYMIX-RFZPGFLSSA-N 167.961 -2.782 50 10 AAGE O=C(C#CB(O)O)N1CCC[C@@H](F)C1 2241468852 VURXCSCPEXIART-SSDOTTSWSA-N 198.990 -1.038 50 10 AAGE NNC(=O)c1cc(F)ccc1B(O)O 2241473290 HNKYYTTYEYFNEF-UHFFFAOYSA-N 197.962 -1.891 50 10 AAGE O=C(C#CB(O)O)N[C@H]1CNC[C@H]1O 2241478316 CBDAPXZQCCHLMJ-NTSWFWBYSA-N 197.987 -3.549 50 10 AAGE CC(=O)NNCCO 165495806 SJGPVMWAWFCTQG-UHFFFAOYSA-N 118.136 -1.381 50 10 AAGE OB(O)c1cn2ccnc2cn1 170013803 PXWZXOAMPGXMTP-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE CNCC(=O)N1CCC[C@H]1B(O)O 201810169 HSFFCWPJIKXPNU-LURJTMIESA-N 186.020 -1.791 50 10 AAGE OB(O)/C=C\B(O)O 205355729 IPIQSMYKNQWSLO-UPHRSURJSA-N 115.690 -2.433 50 10 AAGE NCc1ccnc(Cl)c1B(O)O 238690215 VAQRPOFXRCYHCA-UHFFFAOYSA-N 186.407 -1.127 50 10 AAGE C=CC=NNC(=O)C(N)=O 254293137 GJXOZRPFWBSBTB-UHFFFAOYSA-N 141.130 -1.240 50 10 AAGE NNC(=O)C[C@H]1CC[C@@H]1C(=O)NN 306777094 MTBZOPOBEJNPET-UHNVWZDZSA-N 186.215 -1.618 50 10 AAGE CN(CC[S@](C)=O)CC(=O)NN 399869762 BFLXAUNVXPDSJW-LBPRGKRZSA-N 193.272 -1.713 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@H]1CO2 718285398 AQVQQQCVFUMNMX-BQBZGAKWSA-N 185.227 -1.161 50 10 AAGE C[C@H]1CO[C@H](C(=O)NCB(O)O)C1 718526347 LMBQHEZKCAQSTH-RITPCOANSA-N 187.004 -1.460 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1CN1CCOCC1 725608132 VDNGPFBCYOJLJP-HTQZYQBOSA-N 199.254 -1.055 50 10 AAGE NNC(=O)N1C[C@H]2[C@H](O)C[C@H]2C1 1878212057 KQDQPAHJLYZOEK-KVQBGUIXSA-N 171.200 -1.118 50 10 AAGE CC(C)(C)[C@H](O)[C@H](N)C(=O)NN 1881225521 WNQDEQBPDIRKIK-CRCLSJGQSA-N 175.232 -1.289 50 10 AAGE NNC(=O)CN1CCC=C[C@@H]1CO 1882404015 SNKZGFVCCVEPFG-SSDOTTSWSA-N 185.227 -1.401 50 10 AAGE N#CC1(O)CCN(C[C@@H](O)CN)CC1 1928975656 CGPXWSBHZHZFCH-QMMMGPOBSA-N 199.254 -1.344 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2CO[C@@H](C2)C1 1932133532 GJMDBTBTZCGODU-WDSKDSINSA-N 199.210 -1.776 50 10 AAGE NNC(=O)[C@@]1(N)CCS(=O)(=O)C1 1953710206 SJJKEKUQIUKVMH-RXMQYKEDSA-N 193.228 -2.508 50 10 AAGE NNC(=O)N1CC(=O)N[C@H]2CC[C@H]21 1953947977 ZKEQGGVIRXVUOG-CRCLSJGQSA-N 184.199 -1.468 50 10 AAGE NNC(=O)CCn1ccc(O)cc1=O 1957329062 HCLZTPSSLBTGEX-UHFFFAOYSA-N 197.194 -1.066 50 10 AAGE CC1(C)COCN1C(=O)C#CB(O)O 2241467878 CLLQIUMLYOVRQS-UHFFFAOYSA-N 196.999 -1.403 50 10 AAGE CCCN(O)C(=O)C#CB(O)O 2241468991 YHHDSFJTBWARND-UHFFFAOYSA-N 170.961 -1.370 50 10 AAGE CCN(O)C(=O)c1cc(B(O)O)co1 2241752121 MMPMPXJTGNUHRS-UHFFFAOYSA-N 198.971 -1.189 50 10 AAGE CCN[C@@H]1COC[C@@H]1C(=O)NN 85386952 BRROHYQQWVXAFW-NTSWFWBYSA-N 173.216 -1.399 50 10 AAGE CC(B(O)O)B(O)O 217843388 JUNLVDQWMXYQRK-UHFFFAOYSA-N 117.706 -2.139 50 10 AAGE OB(O)c1nnco1 306991637 VNAPXCNDVNCFSM-UHFFFAOYSA-N 113.869 -2.251 50 10 AAGE in-vitro NC(=O)NNC(=O)Cc1cc[nH]n1 700865257 GBBGQGDZUKGHAN-UHFFFAOYSA-N 183.171 -1.348 50 10 AAGE N#CC[C@H](O)CN1CC[C@H](B(O)O)C1 1891493853 YIEJNVBIVYHBNL-YUMQZZPRSA-N 198.031 -1.190 50 10 AAGE O=C(NCC#CB(O)O)NC1CCC1 1895074666 CHJWJONWLRMJBV-UHFFFAOYSA-N 196.015 -1.147 50 10 AAGE COC[C@@H](C)Cn1ccc(B(O)O)n1 1896849760 ARJGLMIAEYUJHL-ZETCQYMHSA-N 198.031 -1.155 50 10 AAGE C=CCOc1ncncc1B(O)O 1954086418 RTGXJWBLHRSBOE-UHFFFAOYSA-N 179.972 -1.279 50 10 AAGE C[C@H]1C[C@@H]1Oc1ncncc1B(O)O 1956971311 WNFRTKNPDDOFKC-FSPLSTOPSA-N 193.999 -1.056 50 10 AAGE Cc1nnc(O)n(CC(=O)NN)c1=O 1957346482 PRNCDSVQPXAAHT-UHFFFAOYSA-N 199.170 -2.358 50 10 AAGE C[C@H](CN)CNC(=O)C#CB(O)O 2241478267 BFIBJSHXSSCFRW-ZCFIWIBFSA-N 184.004 -2.287 50 10 AAGE NNC(=O)CN1[C@H]2CC[C@H](C2)[C@@H]1CO 2297086851 CPUVLLRHMVTGNQ-CSMHCCOUSA-N 199.254 -1.179 50 10 AAGE NNC(=O)CC1CNC1 81767120 QPNSNVBCMHCYID-UHFFFAOYSA-N 129.163 -1.414 50 10 AAGE Nc1nc(B(O)O)cs1 200989314 KHMBBYUCMKCSSH-UHFFFAOYSA-N 143.964 -1.595 50 10 AAGE CN(O)C(=O)NN 202043286 MNXWNYJJLUDBIR-UHFFFAOYSA-N 105.097 -1.109 50 10 AAGE NNC(=O)c1nn[nH]c1C(=O)O 238563806 CKVUTCAJCCJLNQ-UHFFFAOYSA-N 171.116 -1.894 50 10 AAGE CNC(=O)[C@@H]1CCN(C(=O)NN)C1 307409894 GARXYOXXDVICKV-RXMQYKEDSA-N 186.215 -1.362 50 10 AAGE O=C1NCN[C@@H]2CN[C@@H](Cl)N[C@H]12 307523692 QKTVILKANVMHGO-ALEPSDHESA-N 190.634 -1.884 50 10 AAGE N#CC1(O)CCN(C(=O)CN)CC1 575460512 CBNJIXPVYSIDNI-UHFFFAOYSA-N 183.211 -1.178 50 10 AAGE NNC(=O)N[C@@]12COC[C@H]1C2 717977800 UWVWCSPYMDQJAW-XINAWCOVSA-N 157.173 -1.052 50 10 AAGE COCC1=C=C(C(=O)N(C)N)NO1 885470836 LMPDWRWIJIIOMX-UHFFFAOYSA-N 185.183 -1.134 50 10 AAGE NNC(=O)CN1CC=C[C@H]1CO 1880554769 JCGYYMRHLXVEEP-LURJTMIESA-N 171.200 -1.791 50 10 AAGE NNC(=O)C(=O)N[C@@H]1[C@@H]2CCCO[C@@H]21 1884444296 BMBHOAICVPWMRP-JKUQZMGJSA-N 199.210 -1.730 50 10 AAGE CCc1conc1C(=O)NCB(O)O 1892391096 KNLKOZNCXYJZRG-UHFFFAOYSA-N 197.987 -1.021 50 10 AAGE NNC(=O)CN1CC(F)(F)C1 1917282311 UGSPYWMJHNXOOT-UHFFFAOYSA-N 165.143 -1.073 50 10 AAGE O=C(NNCCO)[C@@H]1CC=CCO1 1931606249 GINUZVDZUVTMQE-ZETCQYMHSA-N 186.211 -1.055 50 10 AAGE NNC(=O)CCCN1CC=C[C@H](O)C1 1956307397 QALRPMIKVSBCRK-QMMMGPOBSA-N 199.254 -1.011 50 10 AAGE O=C(C#CB(O)O)N1CCCC1=O 2241468720 SZRIKHVNMDNTKF-UHFFFAOYSA-N 180.956 -1.849 50 10 AAGE NNC(=O)c1ccc(B(O)O)cn1 2241475275 UXNFNTHKERFMTA-UHFFFAOYSA-N 180.960 -2.635 50 10 AAGE CN(O)C(=O)C#CB(O)O 2241478470 GBABUMVAEBEWEM-UHFFFAOYSA-N 142.907 -2.151 50 10 AAGE CC(=O)NNC(=O)CSCCO 35117034 PHDVFJCQNAHZJZ-UHFFFAOYSA-N 192.240 -1.121 50 10 AAGE NNC(=O)CCNC(N)=O 104082785 ADGQTIWSIWCEJC-UHFFFAOYSA-N 146.150 -1.965 50 10 AAGE NNc1ccc(B(O)O)c(CO)c1 306718958 JHMFBARQFZYKBQ-UHFFFAOYSA-N 181.988 -1.856 50 10 AAGE N#C[C@H](O)C[C@@H](O)[C@H](O)CO 307650027 HBUAPQSBFUMCOW-HSUXUTPPSA-N 161.157 -2.025 50 10 AAGE CO[C@@H](C)[C@H](N)C(=O)NN 885234283 FOZYZGQIVZHPSG-IMJSIDKUSA-N 147.178 -1.662 50 10 AAGE C[C@@H](C(=O)NN)N1[C@H]2C[C@@H]1CN(C)C2 1887175822 RQHDWXXFNZYUHW-BIIVOSGPSA-N 198.270 -1.247 50 10 AAGE CN(NC(=O)CON)S(C)(=O)=O 1888562569 XDPGRUOOIICBOW-UHFFFAOYSA-N 197.216 -2.201 50 10 AAGE CO[C@@H]1COC[C@@H]1NC(=O)NN 1951340156 IGRRUBROMHHFKK-CRCLSJGQSA-N 175.188 -1.427 50 10 AAGE O=C(C#CB(O)O)NCC1(O)CC1 2241467811 BIGHYFYQALHNQB-UHFFFAOYSA-N 182.972 -2.357 50 10 AAGE CN(CCN)C(=O)C#CB(O)O 2241468099 HHPODYOJQPDLIQ-UHFFFAOYSA-N 169.977 -2.581 50 10 AAGE C[C@@H]1[C@H](O)CN1C(=O)[C@H]1C[C@H]1B(O)O 2241480756 KYWJIEYXQGJVHQ-XZBKPIIZSA-N 199.015 -1.559 50 10 AAGE CC(=O)NNC(=O)[C@H](C)N 49804501 QFFGWNPMUUIDCC-VKHMYHEASA-N 145.162 -1.499 50 10 AAGE CN1CCN(CC(=O)NN)CC1=O 82775107 RYZKZAVQSFUJFJ-UHFFFAOYSA-N 186.215 -2.250 50 10 AAGE O=C(CO)[C@@H](O)[C@H](O)[C@H](O)CCl 100352920 GKKJMTUOJYXAJQ-UYFOZJQFSA-N 198.602 -2.131 50 10 AAGE COC[C@@H](OC)C(=O)NN 232417468 BFZNKYBVNDZWNW-SCSAIBSYSA-N 148.162 -1.362 50 10 AAGE N#CCc1cc(B(O)O)ccc1NN 306880359 KQCCQPOPPLQCEL-UHFFFAOYSA-N 190.999 -1.282 50 10 AAGE N[C@H]1[C@H](O)[C@@H](N)[C@@H](O)[C@H](Cl)[C@@H]1O 307039157 IQRWSOIXUCSHGB-WPRNADSXSA-N 196.634 -2.655 50 10 AAGE Cn1ccnc1NC(=O)C(=O)NN 307075416 NVIXGNGPNGZYSF-UHFFFAOYSA-N 183.171 -1.652 50 10 AAGE O=C(NCB(O)O)c1ccc(F)nc1 701949117 HBAQJJLGQIHSLC-UHFFFAOYSA-N 197.962 -1.038 50 10 AAGE N#CCSCC(=O)NCB(O)O 701965467 NWWWYLDOAGLBSJ-UHFFFAOYSA-N 188.017 -1.629 50 10 AAGE O=C(NCB(O)O)c1cnn[nH]1 702017265 KKYSSNMGIQSIHP-UHFFFAOYSA-N 169.937 -2.454 50 10 AAGE COC[C@@H](OC)C(=O)N(C)N 704635955 STMHIKFZJKYLAW-RXMQYKEDSA-N 162.189 -1.020 50 10 AAGE NNC(=O)N[C@H]1CNOC1 1336992107 BDPPXGCUKFUONB-VKHMYHEASA-N 146.150 -1.937 50 10 AAGE CN(C)CC1(O)CN(C(=O)NN)C1 1892488606 LFLFXBFIXNYEOL-UHFFFAOYSA-N 188.231 -1.822 50 10 AAGE NNC(=O)CCN1C[C@@H](O)[C@H](F)C1 1929910235 LQCUWRBFRRGQFV-PHDIDXHHSA-N 191.206 -1.619 50 10 AAGE NNC(=O)C[C@H]1CCN1 1953147041 NZSHTQVXDXWXRW-SCSAIBSYSA-N 129.163 -1.272 50 10 AAGE NNC(=O)[C@@]12C[C@H](N)[C@@H]1C2 1953189870 UFECFSPTYHDILU-FKZODXBYSA-N 141.174 -1.286 50 10 AAGE O=C(C#CB(O)O)NC[C@@H]1CCCO1 2241468476 PAOJVFQPNHMMKL-ZETCQYMHSA-N 196.999 -1.703 50 10 AAGE COC[C@@H](C)NC(=O)C#CB(O)O 2241468830 VOVXPHOXUUPWRZ-ZCFIWIBFSA-N 184.988 -1.847 50 10 AAGE CO[C@H]1C[C@H]1NC(=O)C#CB(O)O 2241471393 JBQZVJKXROOFAI-RITPCOANSA-N 182.972 -2.095 50 10 AAGE NNC(=O)c1ccc(F)cc1B(O)O 2241473096 CPZWTFDKKORUIU-UHFFFAOYSA-N 197.962 -1.891 50 10 AAGE Cn1ncc(B(O)O)c1C(N)=O 2241473297 HPTJCIHMTOYRPB-UHFFFAOYSA-N 168.949 -2.801 50 10 AAGE N[C@@H]1C[C@@H]1NC(=O)[C@H]1C[C@@H](B(O)O)C1 2241475424 XKVAKBBMOAWJSY-UCROKIRRSA-N 198.031 -1.545 50 10 AAGE O=C(C#CB(O)O)NCC(F)(F)F 2241478372 DAUFXATVYPELBX-UHFFFAOYSA-N 194.905 -1.320 50 10 AAGE O=C(C#CB(O)O)NC1C[C@@H]2C[C@H]2C1 2241478515 GVUVSKBSZHZFSF-BQBZGAKWSA-N 193.011 -1.084 50 10 AAGE O=C(C#CB(O)O)NC[C@@H]1CC12CC2 2241478821 LWLJIXVAZSCBFD-ZETCQYMHSA-N 193.011 -1.082 50 10 AAGE NC[C@@H]1C[C@@H]1NC(=O)[C@H]1C[C@H]1B(O)O 2241496289 QZJXFNBXRUMNIP-YTLHQDLWSA-N 198.031 -1.687 50 10 AAGE C[C@@H]1CNC[C@@H]1C(=O)NN 69635720 NNFYDICAWJLAEU-UHNVWZDZSA-N 143.190 -1.168 50 10 AAGE NNC(=O)N1C[C@H](O)[C@H](O)C1 236245711 VACVPGLPIBIBAM-ZXZARUISSA-N 161.161 -2.393 50 10 AAGE Cn1ncc(C(=O)NN)n1 306337328 WHBKZPHFIDPCMJ-UHFFFAOYSA-N 141.134 -1.581 50 10 AAGE NNC(=O)C(=O)N1CC(O)(C2CC2)C1 307078910 QROBMKUZWJJNML-UHFFFAOYSA-N 199.210 -2.040 50 10 AAGE O=C(O)/C=C/B(O)O 307178309 KBOLJYKTFJNSPL-OWOJBTEDSA-N 115.881 -1.361 50 10 AAGE CN(C)CCNC(=S)NNC=O 379325041 AOZVBUZKIWRNAQ-UHFFFAOYSA-N 190.272 -1.327 50 10 AAGE O[C@@H]1[C@H](Cl)[C@@H](O)[C@H](O)[C@H](O)[C@@H]1O 616586962 BSMLUJHFZGTHOG-GTTIYYRPSA-N 198.602 -2.588 50 10 AAGE NNC(=O)[C@H]1CNCC12CC2 715916371 UMRLQZGCUZEYHC-RXMQYKEDSA-N 155.201 -1.024 50 10 AAGE CO[C@H]1CCNC[C@@H]1C(=O)NN 1880974567 WHRNHCAZOSDABN-WDSKDSINSA-N 173.216 -1.399 50 10 AAGE Cc1c[nH]nc1CNCB(O)O 1923928786 QYGJJAVUPRLQBN-UHFFFAOYSA-N 168.993 -1.180 50 10 AAGE NC(=O)NNC(=O)[C@@H]1[C@H]2CCOC[C@@H]21 1930432825 JTKACLGAMGZCHW-HCWXCVPCSA-N 199.210 -1.032 50 10 AAGE NNC(=O)C(=O)N[C@@H]1[C@H]2CCOC[C@@H]21 1930467103 PNVVOIPOYSGTKB-HCWXCVPCSA-N 199.210 -1.873 50 10 AAGE NNC(=O)C(=O)N1CC[C@@]2(CCO2)C1 1932811655 FYVURYWCMDEJGE-MRVPVSSYSA-N 199.210 -1.632 50 10 AAGE COC(OC)[C@@H](N)[C@H](O)C#N 1952862957 QOMCDAWWOABLCV-UHNVWZDZSA-N 160.173 -1.183 50 10 AAGE NNC(=O)C(=O)N1CC(CCF)C1 1954421646 IHBCGLALBDGDEE-UHFFFAOYSA-N 189.190 -1.206 50 10 AAGE C[C@H](C(=O)NN)N1CC=C[C@H](O)C1 1954840438 DYAMZSGAOIJCSG-RQJHMYQMSA-N 185.227 -1.403 50 10 AAGE C#C[C@H](C)Oc1ncc(B(O)O)cn1 2210060160 GXZRHNFACNGOIB-LURJTMIESA-N 191.983 -1.443 50 10 AAGE OB(O)c1ccc(NC2COC2)nc1 2210067529 ABTGIUVTAKJHBJ-UHFFFAOYSA-N 193.999 -1.428 50 10 AAGE C[C@H](CN)Nc1cc(B(O)O)ccn1 2210068456 SKGUDJGPYHETIM-ZCFIWIBFSA-N 195.031 -1.480 50 10 AAGE CC#CCCNC(=O)C#CB(O)O 2241476540 VAEHJGSBASZIBY-UHFFFAOYSA-N 178.984 -1.469 50 10 AAGE N[C@@H]1CCN(C(=O)C2(B(O)O)CC2)C1 2241479982 CMIQCNJCLRRNLE-ZCFIWIBFSA-N 198.031 -1.447 50 10 AAGE N[C@@]1(B(O)O)C[C@H]2CO[C@H]1C2 2241835600 LICIJAFMAASRMG-ZLUOBGJFSA-N 156.978 -1.495 50 10 AAGE C[C@@H](NC(=O)C(=O)NN)C(N)=O 35797062 ULMYPVXZDJHATO-UWTATZPHSA-N 174.160 -3.034 50 10 AAGE CC[Si](O)(O)O[Si](O)(O)CC 198878301 GDRIBHQAKJEVOP-UHFFFAOYSA-N 198.323 -1.110 50 10 AAGE COC(=O)c1ccc(O)c(B(O)O)c1 203677900 VRDWPZWBZVUPEB-UHFFFAOYSA-N 195.967 -1.141 50 10 AAGE Nc1cc(Cl)c(B(O)O)cn1 238666688 RSNWIVDFLNKEAC-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE NNC(=O)C(=O)NC1C[C@H]2C[C@@H]2C1 306612060 MIMGFWFCZOTQGO-RFZPGFLSSA-N 183.211 -1.109 50 10 AAGE N#C[C@H](CCCC(=O)NN)C(=O)NN 319041252 HZIRXPPVXRGQSO-YFKPBYRVSA-N 199.214 -1.724 50 10 AAGE NC(=O)NNC(=O)c1c[nH]c(=O)cn1 606271698 ZXQZXEXKZLVECL-UHFFFAOYSA-N 197.154 -1.917 50 10 AAGE CN1C[C@@H]2CC[C@H](C1)N2CC(=O)NN 687258562 IWABIEZUXZDIDM-OCAPTIKFSA-N 198.270 -1.245 50 10 AAGE CC[C@H](C(=O)NN)N1CC=C[C@H]1CO 1884400142 PAAGDUMVACEXGX-JGVFFNPUSA-N 199.254 -1.012 50 10 AAGE CCOc1ncncc1B(O)O 1951332197 LZKDFOTYAOSOFA-UHFFFAOYSA-N 167.961 -1.445 50 10 AAGE NNC(=O)[C@H]1Cc2nncn2C1 1953383950 UBLUAAAZXHPURJ-BYPYZUCNSA-N 167.172 -1.560 50 10 AAGE COC(=O)c1c(B(O)O)cnn1C 2209171211 UKJPAMKFDSQTBX-UHFFFAOYSA-N 183.960 -2.114 50 10 AAGE CN(O)C(=O)c1ncncc1B(O)O 2241480607 KGUJDAKWOAYOCW-UHFFFAOYSA-N 196.959 -2.382 50 10 AAGE N#CC1=C(N)CC(=O)NC1=O 204941830 JBKMDLMANXWZPL-UHFFFAOYSA-N 151.125 -1.231 50 10 AAGE CC(=O)NN/C(N)=C\C#N 216310655 LRVKFVSIGSSOSJ-DJWKRKHSSA-N 140.146 -1.049 50 10 AAGE Cn1nc2c(c1B(O)O)CCCC2 584882050 JYODGBCSKMIJAL-UHFFFAOYSA-N 180.016 -1.021 50 10 AAGE N[C@@H]1N[C@H](Cl)[C@@H]2NCN[C@@H]2N1 585662373 WQAUMAKLAOPFGY-QMKXCQHVSA-N 177.639 -2.169 50 10 AAGE NNC(=O)C[N+]1(N)CCOCC1 1614798002 MDXGXPSGPSJJHF-UHFFFAOYSA-O 175.212 -2.303 50 10 AAGE COC(=O)NCCCNC(=O)NN 1881854273 VFCUMKIEUMPERT-UHFFFAOYSA-N 190.203 -1.095 50 10 AAGE O=C(NNCCO)[C@H]1COCCO1 1929833232 GJUWOCBMLZOYPM-ZCFIWIBFSA-N 190.199 -1.985 50 10 AAGE C[C@@H](C(=O)NNCCO)n1cncn1 1929834452 BTVYYWXEAAWYFP-LURJTMIESA-N 199.214 -1.548 50 10 AAGE Cn1nc([C@@H](N)[C@H](O)C#N)ccc1=O 1953021869 QEIXGIQGFTVLBA-HTRCEHHLSA-N 194.194 -1.335 50 10 AAGE NNC(=O)C(=O)NC1[C@@H]2CC[C@@H]12 1953501919 JZQXSQXPBXGREI-QWWZWVQMSA-N 169.184 -1.499 50 10 AAGE NC1CN(c2ncccc2B(O)O)C1 2210068153 MSTYUHCPFRILJS-UHFFFAOYSA-N 193.015 -2.091 50 10 AAGE C#CCN(C)C(=O)C#CB(O)O 2241468678 SEFFIARVSVGKQB-UHFFFAOYSA-N 164.957 -1.907 50 10 AAGE CCN(CCN)C(=O)C#CB(O)O 2241468899 WQODKRYXYDKDJU-UHFFFAOYSA-N 184.004 -2.191 50 10 AAGE O=C(NO)c1ncsc1B(O)O 2241584609 QVAPTCIOZBZHFS-UHFFFAOYSA-N 187.973 -2.058 50 10 AAGE Nc1cncc(B(O)O)c1C=O 206091425 DYVFPNCKFREURP-UHFFFAOYSA-N 165.945 -1.844 50 10 AAGE C[C@H](O)[C@H](O)/C=C/C=NNC(N)=O 308083562 SWKXUMHVDGLSRT-KMLWGXEQSA-N 187.199 -1.062 50 10 AAGE COC/C=C\n1cc(B(O)O)cn1 689667253 WTNXVVGFDJICOB-IHWYPQMZSA-N 181.988 -1.320 50 10 AAGE CNNC(=O)[C@H](C)S(C)(=O)=O 707580292 QLVKRPAUCAUCIT-BYPYZUCNSA-N 180.229 -1.330 50 10 AAGE C[C@@H]1OCCO[C@@H]1C(=O)NN 885172843 PHOWUTRJXPVRQC-WHFBIAKZSA-N 160.173 -1.220 50 10 AAGE Cn1cc(C(=O)NN=C2COC2)nn1 1328009268 IYYRZSHBXSIGLN-UHFFFAOYSA-N 195.182 -1.069 50 10 AAGE NNC(=O)CN1CC[C@@H](O)C12CCC2 1914396814 RQHBNANSZFYRLY-SSDOTTSWSA-N 199.254 -1.034 50 10 AAGE NNC(=O)N[C@@H]1CNC[C@H]1F 1923843873 PQLKBZUFHYXESH-QWWZWVQMSA-N 162.168 -1.531 50 10 AAGE C[C@@H]1CC(=O)N(C(=O)C#CB(O)O)C1 2241468098 HHLCWFNWUDSBOV-ZCFIWIBFSA-N 194.983 -1.603 50 10 AAGE O=C(C#CB(O)O)NCC(F)F 2241468615 RFDOETIWLKIZNM-UHFFFAOYSA-N 176.915 -1.617 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2CC[C@H]2C1=O 2241505104 ZZRMYXCUWOTHFR-SYDPRGILSA-N 197.194 -1.629 50 10 AAGE O=C(NO)c1cncc(B(O)O)c1 2241584990 WSICPLGYNFACSZ-UHFFFAOYSA-N 181.944 -2.120 50 10 AAGE NNC(=O)Cn1cccc(F)c1=O 2241640088 YVHKZEFQRRBANM-UHFFFAOYSA-N 185.158 -1.023 50 10 AAGE CNCCN(C)[C@@H](C)C(=O)NN 70534925 NZEWTPLOMBLMGC-LURJTMIESA-N 174.248 -1.484 50 10 AAGE C[C@H](C(=O)NN)N1CCC[C@@H]1CO 82470207 LIKBWTYINCSSDW-RNFRBKRXSA-N 187.243 -1.179 50 10 AAGE C[C@@H](O)CN(C)CCC(=O)NN 82471098 XECZTIWDEIYLGC-ZCFIWIBFSA-N 175.232 -1.321 50 10 AAGE C[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)C(=O)F 115459022 PDNVQOUXEOAXBR-MGCNEYSASA-N 182.147 -2.054 50 10 AAGE OB(O)c1ccc(C2(O)COC2)nc1 170013792 YXIJIBXBKIQFEU-UHFFFAOYSA-N 194.983 -2.021 50 10 AAGE CN(N)C(=O)CC(=O)NN 231378809 VLKZXAVQYBJCMZ-UHFFFAOYSA-N 146.150 -2.302 50 10 AAGE C[C@]1(O)CCN(CC(=O)NN)C1 235713007 UUFAYLIQMJTMQK-ZETCQYMHSA-N 173.216 -1.567 50 10 AAGE O=C(O)[C@@H]1CN[C@H]2[C@H](Cl)C(=O)N12 306789355 SWPPKWGZGHMTRY-YVZJFKFKSA-N 190.586 -1.182 50 10 AAGE CC(=O)NNC(=O)c1nc(=O)[nH][nH]1 307008541 GZNGCLSERPUJKO-UHFFFAOYSA-N 185.143 -2.121 50 10 AAGE O=C(NCB(O)O)NCC(F)(F)F 701942140 DCYJKAODXMRVRR-UHFFFAOYSA-N 199.925 -1.140 50 10 AAGE OB(O)c1cncc2c1OCCN2 1857788769 HDEGIWGGQYNSPW-UHFFFAOYSA-N 179.972 -1.434 50 10 AAGE COC[C@H]1C[C@H]1C(=O)NNC(N)=O 1882998559 WLYUQEWTKGRJLI-RFZPGFLSSA-N 187.199 -1.032 50 10 AAGE NNC(=O)CN1CC[C@@H](C2(O)CC2)C1 1886998168 AYIUTRSXSKWRHG-SSDOTTSWSA-N 199.254 -1.177 50 10 AAGE O=C(COC1CC1)NCC=CB(O)O 1892923993 LVDOEEODLVOEBT-UHFFFAOYSA-N 199.015 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AAGE NNC(=O)C(=O)N[C@@H]1COC2CC1C2 1886080135 RJFVEAQBQDUUHO-JMMWHDCWSA-N 199.210 -1.730 50 10 AAGE CC[C@@H]1C[C@@H]1NC(=O)C#CB(O)O 2241468803 VDQYUISQIVHAAC-RQJHMYQMSA-N 181.000 -1.084 50 10 AAGE CC(=O)NCCNC(=O)C#CB(O)O 2241471700 LCVVHNGJBZVELP-UHFFFAOYSA-N 197.987 -2.746 50 10 AAGE O=C(C#CB(O)O)NCC1(CO)CC1 2241475938 IMWXRZXDTSNVGG-UHFFFAOYSA-N 196.999 -2.110 50 10 AAGE NC(=O)CN1CCC(B(O)O)CC1 2241741222 KQGGKJVIRMMPPT-UHFFFAOYSA-N 186.020 -1.590 50 10 AAGE C[C@H](O)CN(C)CCC(=O)NN 82471097 XECZTIWDEIYLGC-LURJTMIESA-N 175.232 -1.321 50 10 AAGE Cn1cc(CB(O)O)nn1 236067086 DQUQCHHRKYKWHH-UHFFFAOYSA-N 140.939 -1.630 50 10 AAGE COc1c(CO)cncc1B(O)O 238386172 DJCVMOSBHRNCRM-UHFFFAOYSA-N 182.972 -1.738 50 10 AAGE C[C@H](CC(=O)NN)[C@@H](O)C(=O)NN 238451690 CFBDPRCKOURCRL-NQXXGFSBSA-N 190.203 -2.647 50 10 AAGE N#Cc1nccc(CN)c1B(O)O 238689426 JMSJRTMQCGWPEO-UHFFFAOYSA-N 176.972 -1.908 50 10 AAGE CCN1CCOC[C@@H]1C(=O)NN 306443262 QBRKUNIMLFABDW-ZCFIWIBFSA-N 173.216 -1.303 50 10 AAGE NNC(=O)C(=O)N1C[C@@H](F)[C@H](F)C1 714557506 BVTURXRCSGLQJS-QWWZWVQMSA-N 193.153 -1.505 50 10 AAGE NC(=O)NNC(=O)COC1CC1 716856992 IDPLKMFBGAGEAW-UHFFFAOYSA-N 173.172 -1.135 50 10 AAGE O=C1C[C@H](Cl)N[C@@H]2NCNN12 953055254 KJIXGHCVYOCVLF-WUJLRWPWSA-N 176.607 -1.278 50 10 AAGE NNC(=O)[C@@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3 1346319518 KVQXNHOBPWMUMW-VODXULPGSA-N 195.222 -1.109 50 10 AAGE C[C@@H]1CN(C(=O)C#CB(O)O)C[C@H]1O 1878548712 WPPJXEHMNCEKKJ-RNFRBKRXSA-N 196.999 -2.159 50 10 AAGE C[C@]1(C(=O)NCC#CB(O)O)C[C@H]1F 1895237588 BILKGDYNHJIMOB-SVRRBLITSA-N 198.990 -1.134 50 10 AAGE C[C@H](CC(=O)NN)N1CC[C@@H]1CO 1929740820 MPUGBTLVCUDAQS-RNFRBKRXSA-N 187.243 -1.179 50 10 AAGE NNC(=O)[C@@H]1[C@H]2CC[C@H]1NC2 1953290849 WPIJSPKQJRQYPV-KVQBGUIXSA-N 155.201 -1.026 50 10 AAGE CN(CCN)C(=O)C1(B(O)O)CC1 2241473206 FVLSBIBGNYFMLC-UHFFFAOYSA-N 186.020 -1.590 50 10 AAGE Cc1cc(C(N)=O)sc1B(O)O 2241473969 UGKQSQGWCCIHOL-UHFFFAOYSA-N 185.013 -1.165 50 10 AAGE C[C@H]1CCCN1C(=O)C(=O)NN 37912454 UGDMFQPSYSGMPD-YFKPBYRVSA-N 171.200 -1.013 50 10 AAGE C[C@@H](O)CNC(=O)C(=O)NN 58844749 JOXDRSJQEKZDLX-GSVOUGTGSA-N 161.161 -2.527 50 10 AAGE NNC(=O)C(=O)N[C@@H]1CCOC1 87788898 NKRJPIYGBHWODM-SCSAIBSYSA-N 173.172 -2.119 50 10 AAGE O=C(O)[C@H](O)[C@](O)(OO)C(=O)O 103835830 DONFFNSWBSKBRF-KQVAGGMYSA-N 182.084 -2.305 50 10 AAGE NNC(=O)CN1C[C@@H]2CC[C@H](O)[C@H]2C1 125784088 ZNRYQNPVKNSERG-FXQIFTODSA-N 199.254 -1.321 50 10 AAGE COCCC(=O)NN/C(N)=C\C#N 138626058 LRHSQODEPXGMNN-KXFIGUGUSA-N 184.199 -1.033 50 10 AAGE Cn1nnc2ccc(B(O)O)cc21 231404597 HOACZEXGGFAODP-UHFFFAOYSA-N 176.972 -1.352 50 10 AAGE Cc1c(C=O)cncc1B(O)O 238439924 WXNWABFYQTYQBV-UHFFFAOYSA-N 164.957 -1.118 50 10 AAGE N=C(N)NNC(=O)c1nccnc1N 238588532 KBFYRIILGLOEQS-UHFFFAOYSA-N 195.186 -1.813 50 10 AAGE O=C[C@H](O)[C@H](O)[C@@H](O)/C=C/B(O)O 238611130 WRTNKKAVXFZOQQ-LZNUOCMVSA-N 189.960 -3.164 50 10 AAGE Cn1cc(C(=O)NCB(O)O)nn1 702018407 UHGUSYLDDAEOKB-UHFFFAOYSA-N 183.964 -2.443 50 10 AAGE CS(=O)(=O)NCC#CB(O)O 1880468325 NQSYZYIGJSJOQY-UHFFFAOYSA-N 176.990 -2.449 50 10 AAGE CN(C)NC(=O)[C@@]1(O)CCCNC1 1882569822 KBWRCFQWBAUHEN-MRVPVSSYSA-N 187.243 -1.306 50 10 AAGE CNNC(=O)N1CC[C@@H](O)C1 1914083183 PHKWZDXXBLVBTP-RXMQYKEDSA-N 159.189 -1.103 50 10 AAGE Cn1ncc(B(O)O)c1F 1951331163 PVGMPBZBLKKQGR-UHFFFAOYSA-N 143.914 -1.761 50 10 AAGE NNC(=O)CN1CCO[C@@H](CF)C1 1954060697 YQBRQJVZZOTTFX-LURJTMIESA-N 191.206 -1.353 50 10 AAGE NNC(=O)NCCc1nccc(O)n1 1955975183 CVJCEQDLQGIIJU-UHFFFAOYSA-N 197.198 -1.102 50 10 AAGE NNC(=O)[C@H]1CNCc2nccn2C1 1955999970 MVPCYOIQIQENIN-LURJTMIESA-N 195.226 -1.408 50 10 AAGE C[C@H](CO)Nc1ccc(B(O)O)cn1 2210060386 JURMSEBNXXAXHV-ZCFIWIBFSA-N 196.015 -1.446 50 10 AAGE Cc1cc(=NC(=O)C#CB(O)O)[nH][nH]1 2241468622 RGYSGLTUPVZRSF-UHFFFAOYSA-N 192.971 -1.906 50 10 AAGE O=C(C#CB(O)O)NCCF 2241478886 MWLRXPGTTSMGMI-UHFFFAOYSA-N 158.925 -1.913 50 10 AAGE CNC(=O)c1cc(B(O)O)cs1 2241480389 HZSROZJYYMVHCH-UHFFFAOYSA-N 185.013 -1.213 50 10 AAGE NOCCNC(=O)[C@H]1C[C@@H]1B(O)O 2241494862 FCVYTUYLZZCICX-WHFBIAKZSA-N 187.992 -2.144 50 10 AAGE OB(O)c1ncc2n1CCC2 2297004032 NAWIJXHQHIPILX-UHFFFAOYSA-N 151.962 -1.491 50 10 AAGE NNC(=O)C(=O)NCCO 58837079 IPLOEMRLHVVSDN-UHFFFAOYSA-N 147.134 -2.915 50 10 AAGE COc1coc(B(O)O)c1OC 169907286 TVFXHRAECKGZKI-UHFFFAOYSA-N 171.945 -1.023 50 10 AAGE Cc1nc(CNC(=O)C(=O)NN)no1 231840909 HHUVWCRQKUADPP-UHFFFAOYSA-N 199.170 -2.016 50 10 AAGE N#CSC[C@@H]1OC(=O)[C@@H](O)[C@H]1O 306246588 BIHOZRIUSOSOLT-YUPRTTJUSA-N 189.192 -1.152 50 10 AAGE N#CC1=CO[C@H](CO)[C@@H](O)[C@H]1O 306288206 MAQCDQZOLGWUQE-DSYKOEDSSA-N 171.152 -1.493 50 10 AAGE C[C@H](NC(=O)C(=O)NN)c1ncon1 306790959 ZKBLOUTYYMGALL-VKHMYHEASA-N 199.170 -1.763 50 10 AAGE O[C@@H]1[C@H](O)[C@@H](Cl)[C@H](O)[C@@H](O)[C@@H]1O 307159004 BSMLUJHFZGTHOG-UOTPTPDRSA-N 198.602 -2.588 50 10 AAGE NNC(=O)CN1C[C@@H](CO)C2(CC2)C1 885802981 ALRXCOSPKYNPSL-ZETCQYMHSA-N 199.254 -1.319 50 10 AAGE N[C@@]1(B(O)O)COCC1(F)F 1880447224 VTRBPFHHJNXNLT-VKHMYHEASA-N 166.920 -1.639 50 10 AAGE C[C@@H](O)C(=O)NN(C)S(C)(=O)=O 1888561286 ADOOSMOJEHUGOH-SCSAIBSYSA-N 196.228 -1.710 50 10 AAGE OCC#CCN1CC[C@@H](B(O)O)C1 1891540561 XNEMSAUBMKESMZ-MRVPVSSYSA-N 183.016 -1.469 50 10 AAGE C[C@H](Cn1ncccc1=O)C(=O)NN 1912229916 VWPRYCHQNYODCL-ZCFIWIBFSA-N 196.210 -1.131 50 10 AAGE CNC(=O)Nc1ncccc1B(O)O 1913666919 CAARTCAPENLPPU-UHFFFAOYSA-N 194.987 -1.487 50 10 AAGE C[C@H](C(=O)NN)N(C)C1CC(O)C1 1914601203 LEQLHPWNURBZEA-GRQBKTHUSA-N 187.243 -1.180 50 10 AAGE COC1(C(=O)NN(C)C)CNC1 1917734781 YXPOMQIHLUYDEV-UHFFFAOYSA-N 173.216 -1.432 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1[C@H]2CC[C@H]21 2241478235 AWJRJWFTRDWEDV-BDINMYNLSA-N 178.984 -1.474 50 10 AAGE NC1CCN(C(=O)C#CB(O)O)CC1 2241478596 INTMGAXIRKXCJA-UHFFFAOYSA-N 196.015 -2.049 50 10 AAGE NNC(=O)c1[nH]nc(O)c1CCO 4852188 SQCZNYXWFSDWPB-UHFFFAOYSA-N 186.171 -1.746 50 10 AAGE C[C@@H]1CO[C@@H](CO)CN1C(=O)NN 88093020 LFTJBMIDAONXOV-PHDIDXHHSA-N 189.215 -1.349 50 10 AAGE O=C(O)Cn1cc(B(O)O)cn1 230539856 ZCOQWMJMOWDUBL-UHFFFAOYSA-N 169.933 -2.353 50 10 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LXWYQQJPSWGEBM-UHFFFAOYSA-N 169.977 -2.136 50 10 AAGE OC[C@@H]1O[C@H](Cl)[C@H](O)[C@@H](O)[C@H]1O 306365973 JPYHXSWNADKGBI-XKTQNOIPSA-N 198.602 -1.975 50 10 AAGE NNC(=O)CN1CCNS1(=O)=O 307261198 UUESXQSUIXAHAS-UHFFFAOYSA-N 194.216 -2.874 50 10 AAGE COc1cc(F)cc(B(O)O)n1 307407441 CNQHWXLEMFAQBH-UHFFFAOYSA-N 170.936 -1.091 50 10 AAGE O=C(O)/C=C\B(O)O 378991691 KBOLJYKTFJNSPL-UPHRSURJSA-N 115.881 -1.361 50 10 AAGE CC(=O)NNC(=O)c1cnnc(O)c1 1624651643 JIPREXUWCUFBDX-UHFFFAOYSA-N 196.166 -1.037 50 10 AAGE NC1(B(O)O)CC(n2cncn2)C1 1882382216 SJOPKPAWQWZIOY-UHFFFAOYSA-N 181.992 -1.678 50 10 AAGE C[C@H](C(=O)NN)N1C[C@H]2C[C@H]1CN2C 1887148212 LXEPTYRDGQNKTL-PRJMDXOYSA-N 198.270 -1.247 50 10 AAGE CCc1nc(B(O)O)cn1C 1914461792 VOJYTOIRDCVWFQ-UHFFFAOYSA-N 153.978 -1.338 50 10 AAGE NC[C@H](CO)NC(=O)C#CB(O)O 2241468112 HMNFCKPYPYBBBU-RXMQYKEDSA-N 185.976 -3.562 50 10 AAGE CN(O)C(=O)c1n[nH]cc1B(O)O 2241475276 UYBPHTNQGFDPME-UHFFFAOYSA-N 184.948 -2.449 50 10 AAGE NNC(=O)C(=O)NC1CCC1 52213618 GOKZSRDYDFXPFP-UHFFFAOYSA-N 157.173 -1.355 50 10 AAGE OC[C@H]1O[C@H](Cl)[C@@H](O)[C@H]1O 79108621 ZKHGIPARYPCVPA-STGXQOJASA-N 168.576 -1.336 50 10 AAGE Cn1cnc2ncc(B(O)O)cc21 238530132 MELQUFHBPXCKOT-UHFFFAOYSA-N 176.972 -1.352 50 10 AAGE NNC(=O)[C@](O)(CO)C[C@H](O)CO 238557420 MIRMJUUYKXXXNV-UJURSFKZSA-N 194.187 -3.557 50 10 AAGE N[C@H](CO)CSS(=O)(=O)O 238688473 KPMUMWRLWNPMPW-GSVOUGTGSA-N 187.242 -1.158 50 10 AAGE NNC(=O)C[S@@](=O)C[C@H](O)CO 526887421 YPOMWEYLCSLNEZ-BAVBESHTSA-N 196.228 -2.922 50 10 AAGE N[C@H]1N[C@@H]2NCC[C@H]2[C@@H](Cl)N1 585665127 ODARHCRZUCREHU-OMMKOOBNSA-N 176.651 -1.078 50 10 AAGE NNC(=O)CCN1C[C@H]2COC[C@@H]2C1 718237869 BTIJHUGXWBYLCE-YUMQZZPRSA-N 199.254 -1.055 50 10 AAGE COC(=O)c1coc(B(O)O)c1 1881158903 JIWRHUMUTXVIDT-UHFFFAOYSA-N 169.929 -1.254 50 10 AAGE NC(=O)CCN1CC[C@H](B(O)O)C1 1891491793 KYCOWOYVPMNZAC-LURJTMIESA-N 186.020 -1.590 50 10 AAGE NNC(=O)CO[C@H]1CCNC1 1932652235 GQDODOYHFAOFDU-YFKPBYRVSA-N 159.189 -1.645 50 10 AAGE N#C[C@H](O)[C@H](N)Cc1nn[nH]n1 1952795318 SAHGDVHOMDVEJE-DMTCNVIQSA-N 168.160 -2.046 50 10 AAGE CCN(C(=O)C#CB(O)O)C1CNC1 2241468345 MBZCLLDXLTVTBO-UHFFFAOYSA-N 196.015 -2.178 50 10 AAGE O=C(C#CB(O)O)NCc1nc[nH]n1 2241468361 MNXFYUPPUDOUFG-UHFFFAOYSA-N 193.959 -2.564 50 10 AAGE O=C(N1CC[C@H]1CO)C1(B(O)O)CC1 2241473504 LOPQGHYIBBPHEY-LURJTMIESA-N 199.015 -1.413 50 10 AAGE Cc1cc(B(O)O)cc(C(=O)NN)c1 2241479747 AFOGGCIWCYFELD-UHFFFAOYSA-N 193.999 -1.722 50 10 AAGE COCCNC(=O)[C@H]1C[C@H]1B(O)O 2241496470 SVISREIMMJZPKU-NTSWFWBYSA-N 187.004 -1.388 50 10 AAGE CN(/N=C/C(N)=O)C(N)=O 104645441 LGZWHUIZCCITOR-FARCUNLSSA-N 144.134 -1.532 50 10 AAGE O=CNNC(=O)C(=O)O 144737650 HMWDAFBJOKPUGS-UHFFFAOYSA-N 132.075 -2.152 50 10 AAGE CC(=O)NN[C@H]1CCOC1=O 306444564 PHOMRESJVLKHNZ-YFKPBYRVSA-N 158.157 -1.057 50 10 AAGE C[C@H]1C[C@H](O)CCN1CC(=O)NN 606258764 OXAZUDASYKRXJJ-NKWVEPMBSA-N 187.243 -1.179 50 10 AAGE CC(=O)NNC(=O)Cn1cnc(N)n1 1539517557 BJSSQVGLTWYFRE-UHFFFAOYSA-N 198.186 -1.972 50 10 AAGE C[C@H](CN)N(C)C(=O)C#CB(O)O 1888774222 BPXOFLOUVUXOIU-ZCFIWIBFSA-N 184.004 -2.193 50 10 AAGE C[C@H]1CN([C@H](C)C(=O)NN)C[C@@H]1O 1890259179 QUIDFGZODFRZFB-XVMARJQXSA-N 187.243 -1.323 50 10 AAGE NC(=O)CN1CC[C@H](B(O)O)C1 1891559657 LEIZLWDVUZVWLO-YFKPBYRVSA-N 171.993 -1.980 50 10 AAGE C[C@]12CCO[C@@H]1[C@@](N)(B(O)O)C2 1933397704 KMJOXVWHLMBRFO-RRKCRQDMSA-N 171.005 -1.105 50 10 AAGE N[C@@]1(B(O)O)CN2CC[C@H]1C2 1953249801 DNOLKMXRAAIDCL-WDSKDSINSA-N 155.994 -1.969 50 10 AAGE C[C@H]1C[C@@H]1N(C)C(=O)C(=O)NN 1953722978 PEVOGUZMAFEWRA-WHFBIAKZSA-N 171.200 -1.157 50 10 AAGE CN1CCN(C(=O)C(=O)NN)[C@H]2C[C@H]21 1956639447 VRJHKCSEVOXKDU-RITPCOANSA-N 198.226 -2.109 50 10 AAGE C[C@@H](N)COc1ncc(B(O)O)cn1 2210060368 JQCGTLLHNRLPPF-RXMQYKEDSA-N 197.003 -2.118 50 10 AAGE OCCCOc1ncccc1B(O)O 2210063649 BKJBMKPLOOEURW-UHFFFAOYSA-N 196.999 -1.477 50 10 AAGE C[C@@H](CO)Nc1ccc(B(O)O)cn1 2210064802 JURMSEBNXXAXHV-LURJTMIESA-N 196.015 -1.446 50 10 AAGE NCCCCNC(=O)C#CB(O)O 2241478365 CXFIRPBIIWXLDR-UHFFFAOYSA-N 184.004 -2.143 50 10 AAGE CN(C)NC(=O)[C@H]1C[C@@H]1B(O)O 2241495883 NZPUOENBLKPBLA-WHFBIAKZSA-N 171.993 -1.558 50 10 AAGE O=C(NCB(O)O)[C@H]1[C@@H]2CCCO[C@@H]21 2297046886 ZLNGCYCYFZJNOV-ACZMJKKPSA-N 199.015 -1.460 50 10 AAGE C[C@H]1[C@H](CO)CCN1CC(=O)NN 307290330 BKXLPOQWYKQCNI-BQBZGAKWSA-N 187.243 -1.321 50 10 AAGE CNNC(=O)[C@@H]1CNC(=O)C1 575560437 WQZNVAAJABEOFG-BYPYZUCNSA-N 157.173 -1.627 50 10 AAGE O=C(NCB(O)O)N1C[C@H]2C[C@H]2C1 885449167 KIFGMHLPDNYAOR-OLQVQODUSA-N 184.004 -1.340 50 10 AAGE COC1=C=C(C(=O)N(C)N)NN1C 885449407 BVGJMXQTLSSHKY-UHFFFAOYSA-N 184.199 -1.261 50 10 AAGE O=S(=O)(CCCF)NCB(O)O 1923810068 BJIPXVNUBIEOAZ-UHFFFAOYSA-N 199.012 -1.723 50 10 AAGE CSC=CC(=O)NCB(O)O 1923920797 JKEDIVJNDVQQOQ-UHFFFAOYSA-N 175.018 -1.009 50 10 AAGE CN(C)NC(=O)[C@H]1CNC[C@H](O)C1 1934304549 FJMDCOSEPWSBHI-RNFRBKRXSA-N 187.243 -1.450 50 10 AAGE CNC(=O)N[C@H](CB(O)O)C(=O)O 1954524950 NHGXNFVFEKFDED-GSVOUGTGSA-N 189.964 -2.159 50 10 AAGE NNC(=O)[C@]12C[C@](N)(CO1)C2 2241401140 DWTPBVRFAPVCFI-IZLXSQMJSA-N 157.173 -1.763 50 10 AAGE O=C(C#CB(O)O)N1CC[C@@H]2C[C@H]21 2241478795 LLXBOZUNOYMBAH-RNFRBKRXSA-N 178.984 -1.377 50 10 AAGE CNC(=O)c1ncc(B(O)O)cc1C 2241651090 YXSRMBQSODZUPT-UHFFFAOYSA-N 193.999 -1.571 50 10 AAGE Cn1cnc(B(O)O)c1C(=O)O 2297004369 ILBNOXSAVFCLDH-UHFFFAOYSA-N 169.933 -2.202 50 10 AAGE C[C@H]1[C@@H](O)CN1C[C@@H]1C[C@H]1C(=O)NN 2297131911 FQXWYVMJXOIPBH-HSNKUXOKSA-N 199.254 -1.323 50 10 AAGE CN1CCCN(CC(=O)NN)CC1 82466514 HGIRSNWXJGGTNO-UHFFFAOYSA-N 186.259 -1.386 50 10 AAGE CN[C@@H]1COC[C@H]1C(=O)NN 85381713 LRUBVBLWLGVKGT-RFZPGFLSSA-N 159.189 -1.789 50 10 AAGE NCCOCC(=O)NN 86435082 IUUUUFUGDJSFEA-UHFFFAOYSA-N 133.151 -2.048 50 10 AAGE Cn1cc(CN=C=O)c(=O)n(C)c1=O 144205042 LSZKBYZBZXSQDZ-UHFFFAOYSA-N 195.178 -1.080 50 10 AAGE C[C@@H](N)C(=O)N1CCC[C@H]1B(O)O 170068387 WDFZXMUIFGGBQF-RITPCOANSA-N 186.020 -1.663 50 10 AAGE in-vivo CC(=O)c1cc(B(O)O)c[nH]c1=O 206093888 MPIMBGARAYJYOH-UHFFFAOYSA-N 180.956 -1.743 50 10 AAGE OB(O)c1ccc(N2CCC2)nc1 253185251 PPQPAYIFEBQFJC-UHFFFAOYSA-N 178.000 -1.029 50 10 AAGE OB(O)c1cc(F)cc(O)n1 306708894 UGEMGOQDHBLSTI-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE NNC(=O)CCN1C[C@H]2C[C@H]1[C@@H]2CO 1902449844 ZWNRNGDVWOECLZ-PRJMDXOYSA-N 199.254 -1.321 50 10 AAGE CN(NC1=N[C@H]2C[C@H]2N1)C(N)=O 1923850166 FPSYPJJZDBNKSG-ZXZARUISSA-N 169.188 -1.398 50 10 AAGE C[C@@H](CN)[C@@H](F)C(=O)NN 1953189173 VWORTRVGDHNRRX-IUYQGCFVSA-N 149.169 -1.091 50 10 AAGE CCOC(=O)C[C@@H](N)C(=O)NN 2080997148 CCAYRPZCIBSMLR-SCSAIBSYSA-N 175.188 -1.743 50 10 AAGE O=C(C#CB(O)O)N1[C@@H]2COC[C@H]1C2 2241468072 GWSSCPAPMZNGCQ-KNVOCYPGSA-N 194.983 -1.999 50 10 AAGE CN(C)C(=O)c1c[nH]nc1B(O)O 2241474425 CRMATFIHTNGRPX-UHFFFAOYSA-N 182.976 -2.209 50 10 AAGE C[C@H](NC(=O)C#CB(O)O)C(=O)O 2241479164 SMVOZMHQWMIFBH-BYPYZUCNSA-N 184.944 -2.409 50 10 AAGE NNC(=O)c1cc(B(O)O)cs1 2241479764 ALMYKFYIXNAVFB-UHFFFAOYSA-N 186.001 -1.969 50 10 AAGE N[C@H]1C[C@H]1NC(=O)[C@H]1C[C@H](B(O)O)C1 2241496930 XKVAKBBMOAWJSY-ZTYPAOSTSA-N 198.031 -1.545 50 10 AAGE NNC(=O)[C@@H]1CC(=O)NC(=O)N1 5157191 FFMHGSYVWUODSR-REOHCLBHSA-N 172.144 -2.426 50 10 AAGE CCCC(=O)NNC(=O)CC(N)=O 238234017 NAHHIANCQAAEDZ-UHFFFAOYSA-N 187.199 -1.191 50 10 AAGE N#Cc1nc(C=O)ccc1B(O)O 238621843 GIJUMBJATUBUSO-UHFFFAOYSA-N 175.940 -1.554 50 10 AAGE [C-]#[N+][C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O 306387868 UJALVCFSKOLTHI-PFCGLBSHSA-N 189.167 -2.294 50 10 AAGE NC(=O)CC(=O)NNC(=O)CO 388521528 XKLCIEHMZIJJPL-UHFFFAOYSA-N 175.144 -2.999 50 10 AAGE COC(=O)[C@@H](Cl)C1=C=[N+](C)NN1 885553575 XZZAVBVXTFNYED-YFKPBYRVSA-N 190.610 -1.015 50 10 AAGE C[C@@]1(C(=O)NN)COCCN1 1880495585 MIZLXXMRUFNNET-LURJTMIESA-N 159.189 -1.645 50 10 AAGE CN(Cc1cnnn1C)C(=O)NN 1934944016 BZDIMHXBJRNFDC-UHFFFAOYSA-N 184.203 -1.170 50 10 AAGE Cn1ncnc1[C@H](N)[C@@H](O)C#N 1953003691 GCRINHQGCZYXAV-CRCLSJGQSA-N 167.172 -1.301 50 10 AAGE CN(C)Nc1ncc(B(O)O)cn1 2209388132 QZFZQKMNUPJMMV-UHFFFAOYSA-N 181.992 -1.955 50 10 AAGE CN(C)C(=O)c1ncc(B(O)O)cn1 2241468362 MOBKRVKJXAGUBW-UHFFFAOYSA-N 194.987 -2.142 50 10 AAGE C=C[C@@H](C)CNC(=O)C#CB(O)O 2241471405 JENYLTHTQGWUPI-SSDOTTSWSA-N 181.000 -1.060 50 10 AAGE O=C(O)c1c[nH]nc1B(O)O 2241494569 ZORQUKYZTYDCFF-UHFFFAOYSA-N 155.906 -2.212 50 10 AAGE Cn1c(=O)[nH]c2c(B(O)O)cccc21 238522254 SQUBXPHJBYJTOL-UHFFFAOYSA-N 191.983 -1.454 50 10 AAGE O=C(O)COc1ccccc1B(O)O 238628259 BPNXWXUEZLGVQK-UHFFFAOYSA-N 195.967 -1.170 50 10 AAGE CNNC(=O)[C@@H]1CCCN1 306196563 WAEIEXGNUPHVOL-YFKPBYRVSA-N 143.190 -1.011 50 10 AAGE CCOC(=O)/C(C#N)=C(/N)C(N)=O 383518827 VAKRIXWUIBVXFM-SNAWJCMRSA-N 183.167 -1.229 50 10 AAGE COC[C@H](NC(C)=O)C(=O)NN 399522821 OZOIBCYGNHWNQD-YFKPBYRVSA-N 175.188 -1.873 50 10 AAGE OB(O)/C=C/c1nnc2n1CCOC2 575463377 SPXQIYUCNAGLQD-OWOJBTEDSA-N 194.987 -1.167 50 10 AAGE CNNC(=O)C1=NNC(=O)CC1 575562480 BYMPYAXLAMRVKH-UHFFFAOYSA-N 170.172 -1.497 50 10 AAGE O=S(=O)(NCB(O)O)C(F)F 701932677 SHIAGJYRDXOEQZ-UHFFFAOYSA-N 188.948 -1.860 50 10 AAGE O=C(NCC#CB(O)O)C1CSC1 1883734708 NETFIFRBHJMHGI-UHFFFAOYSA-N 199.040 -1.519 50 10 AAGE C[C@H](C(=O)NN)N1CC2(CC[C@H]2O)C1 1885318372 MSPNENDYJXHHIR-RNFRBKRXSA-N 199.254 -1.179 50 10 AAGE C[C@@H]1CN[C@H]1C(=O)NN 1934540924 PBYSZRFJYAWQGO-QWWZWVQMSA-N 129.163 -1.416 50 10 AAGE CN(C)NC(=O)[C@H]1C[C@H]1N 1953191582 DRJUUFXXWUBVKP-CRCLSJGQSA-N 143.190 -1.074 50 10 AAGE N[C@]1(B(O)O)[C@@H]2C[C@H]2[C@H]2C[C@H]21 1953209792 LNPWIKUUMQXSBT-BIVRFLNRSA-N 152.990 -1.018 50 10 AAGE NNC(=O)CN1C(=O)[C@@H]2C[C@@H]2[C@@H]2C[C@@H]21 1957166015 XZTDPOWMQNNVOY-UCROKIRRSA-N 195.222 -1.157 50 10 AAGE O=C(F)N1CC[C@](O)(CO)[C@H](O)C1 2209148143 YFILRXCQICIRKP-VDTYLAMSSA-N 193.174 -1.134 50 10 AAGE C[C@@H](O)CN=c1ccc(B(O)O)c[nH]1 2210060674 MMNSZJCMRWKZSY-ZCFIWIBFSA-N 196.015 -2.024 50 10 AAGE CC1(NC(=O)C2(B(O)O)CC2)COC1 2241473878 RQWAPJVWGUAJEY-UHFFFAOYSA-N 199.015 -1.102 50 10 AAGE CN(CCO)C(=O)C#CB(O)O 2241476413 RWHMWXAVPVCYBK-UHFFFAOYSA-N 170.961 -2.548 50 10 AAGE CC[C@H](CO)NC(=O)C(=O)NN 58847086 KBHAMNBWJWEZHR-SCSAIBSYSA-N 175.188 -2.137 50 10 AAGE N#C/C(N)=C(C#N)/N=C/NN 62715619 WRAVHIIGHHERKU-PLNGDYQASA-N 150.145 -1.305 50 10 AAGE CSCCNC(=O)C(=O)NN 69016431 SXPFLNKISGPWQG-UHFFFAOYSA-N 177.229 -1.545 50 10 AAGE CN(C)CCC[Si](O)(O)O 197887168 GYBWMYOEVYDJDA-UHFFFAOYSA-N 165.265 -1.146 50 10 AAGE NC1(c2ncccc2B(O)O)CC1 199206101 NNLRUQJUECGGKQ-UHFFFAOYSA-N 178.000 -1.291 50 10 AAGE Cn1cnc(C(=O)NNC(N)=O)c1 236084570 MYVCPOKYTSXSQM-UHFFFAOYSA-N 183.171 -1.267 50 10 AAGE Cc1cc(C=O)c(B(O)O)cn1 238460133 KISVWHAUFZWGAV-UHFFFAOYSA-N 164.957 -1.118 50 10 AAGE Cc1cc(O)c(B(O)O)cn1 238464885 VSNVEPWXZVEIOU-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE CN1CC[C@H](NC(=O)NN)C1 258677617 DLELFWNMCIBDKW-YFKPBYRVSA-N 158.205 -1.137 50 10 AAGE O=CNNC(=O)Cc1ccn[nH]1 306290506 QLDBADGFHIGHNO-UHFFFAOYSA-N 168.156 -1.271 50 10 AAGE C[C@@H](C#N)/C(=N\N)C(=O)NN 306965456 KAUZOVNEBBPILK-SKYAAQEBSA-N 155.161 -1.549 50 10 AAGE CON[C@H](C)C(=O)NNC(C)=O 307995849 WGLNICQCUAOJPN-SCSAIBSYSA-N 175.188 -1.307 50 10 AAGE CO[C@@H](C)[C@H](O)C(=O)NNC(C)=O 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2210008390 DCZIQWXVJCCYGI-UHFFFAOYSA-N 198.226 -2.107 50 10 AAGE NC(=O)C1(B(O)O)CC1 2241473589 MTFJZHDINABUSY-UHFFFAOYSA-N 128.924 -1.521 50 10 AAGE C[C@H]1C[C@@H]1CNC(=O)C#CB(O)O 2241475625 BIDRXCMOGULTAI-NKWVEPMBSA-N 181.000 -1.226 50 10 AAGE C#CCCN(C)C(=O)C#CB(O)O 2241478462 FVFYNNHLYISIQG-UHFFFAOYSA-N 178.984 -1.517 50 10 AAGE O=C(C#CB(O)O)NC1(C(=O)O)CC1 2241584369 MSDALOIPGFWZAE-UHFFFAOYSA-N 196.955 -2.265 50 10 AAGE NNC(=O)[C@H]1CN1CCO 39064503 JTQUDWBAPNSZEQ-WZIMWHJTSA-N 145.162 -2.347 50 10 AAGE CC(CO)(CO)NCCC(=O)NN 58839668 JAKQYXCWVNFFOU-UHFFFAOYSA-N 191.231 -2.301 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@H](CN)C1 82468086 WXMMMANJYIFDPL-RNFRBKRXSA-N 186.259 -1.355 50 10 AAGE N#C/C(=C1/NCCN1CCN)[N+](=O)[O-] 169655715 SYKXKLXLRKNSDL-VOTSOKGWSA-N 197.198 -1.180 50 10 AAGE COC(=O)N1CC[C@@H]1C(=O)NN 212543140 YZRPGEVGILZMBL-SCSAIBSYSA-N 173.172 -1.183 50 10 AAGE CO[C@@H](C)CNC(=O)C(=O)NN 224487661 FTHHZJOUCIALAD-BYPYZUCNSA-N 175.188 -1.873 50 10 AAGE NNC(=O)c1cnc(N)nc1N 238562381 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C[C@@H]1CN(C(=O)NN)CC(=O)N1C 1926006497 QIRPKWDZPZFRSG-RXMQYKEDSA-N 186.215 -1.268 50 10 AAGE CN(CCC(=O)NN)[C@H]1C[C@@H](O)C1 2209097257 BCXWVMRKZAPWNT-KNVOCYPGSA-N 187.243 -1.179 50 10 AAGE O=C(C#CB(O)O)NCC1CNC1 2241478208 AEIDSVDMZWCYNG-UHFFFAOYSA-N 181.988 -2.663 50 10 AAGE C[C@@H](O)CC(=O)NCCC#CB(O)O 2241910910 XXPSGYSGEWNMEW-SSDOTTSWSA-N 199.015 -1.721 50 10 AAGE OC[C@]1(O)O[C@H](CCl)[C@H](O)[C@@H]1O 196397253 HERFDENCNURSOX-VANKVMQKSA-N 198.602 -1.973 50 10 AAGE Cc1cccnc1[B-](O)(O)O 199593291 ZHQWIHRRWRADFM-UHFFFAOYSA-N 153.954 -1.487 50 10 AAGE CC[C@H](N)C(=O)N(C)CB(O)O 200993825 YNNFSQZIVMFSJM-YFKPBYRVSA-N 174.009 -1.806 50 10 AAGE CCCCNNC(=O)[C@@H](N)CO 238242784 MQXIVKDNBKZWNV-LURJTMIESA-N 175.232 -1.273 50 10 AAGE CN(C)CC(=O)NNC(=N)N 238288712 IDYBXRWIDDLBGT-UHFFFAOYSA-N 159.193 -1.938 50 10 AAGE COc1nccc(CO)c1B(O)O 238425249 NNXVTPVEIINTEX-UHFFFAOYSA-N 182.972 -1.738 50 10 AAGE N=C(N)NNC(=O)CC(=O)O 238588187 OMIYFHRNHDGHAN-UHFFFAOYSA-N 160.133 -2.025 50 10 AAGE 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AAGE NOCCNC(=O)[C@H]1C[C@H]1B(O)O 2241494861 FCVYTUYLZZCICX-CRCLSJGQSA-N 187.992 -2.144 50 10 AAGE Cn1ccc(NNC(N)=O)nc1=O 6072419 YTHHWTLOZQBLLX-UHFFFAOYSA-N 183.171 -1.225 50 10 AAGE CN[C@H](C)CC(=O)NN 58847787 JGMVBFDNHFSHAR-SCSAIBSYSA-N 131.179 -1.026 50 10 AAGE Cn1ccn2c(C(=O)NN)nnc12 75848715 SCPMZMOXYYOJOZ-UHFFFAOYSA-N 180.171 -1.329 50 10 AAGE NC[C@H]1CC[C@@H](C(=O)NN)O1 87047522 DXVDVAQASGWTTB-UHNVWZDZSA-N 159.189 -1.517 50 10 AAGE CC(C)NNC(=O)CN 104653123 OOWFNAMSLMCBIQ-UHFFFAOYSA-N 131.179 -1.026 50 10 AAGE OC[C@@H](O)[C@H](O)CCl 104734065 DGGUDQTUJAPWME-QWWZWVQMSA-N 140.566 -1.061 50 10 AAGE COC[C@H](N)C(=O)NN(C)C 147258895 KDHOBKQSNRQZMZ-YFKPBYRVSA-N 161.205 -1.447 50 10 AAGE OB(O)c1ccc(Cl)nn1 198950836 DKWZZXALPFLTNW-UHFFFAOYSA-N 158.353 -1.190 50 10 AAGE C[C@H](Cl)C(=O)NC[C@H](O)C(N)=O 228653021 GWMBPYYPMUVSSW-IMJSIDKUSA-N 194.618 -1.424 50 10 AAGE OB(O)c1cc2c(cc1O)OCO2 238642339 QSPHQDQKRHICHX-UHFFFAOYSA-N 181.940 -1.199 50 10 AAGE NC(=O)C(=O)NN=Cc1cnc[nH]1 388263481 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1888381857 OGYARWNFMOJWCC-RXMQYKEDSA-N 186.190 -1.088 50 10 AAGE C=CC1(O)CN(C[C@H](C)C(=O)NN)C1 1891960303 NWCXCVBKOKDESO-ZETCQYMHSA-N 199.254 -1.155 50 10 AAGE C=C(Cn1ccc(O)nc1=O)B(O)O 1895191423 NQPRGIKDHXBMHB-UHFFFAOYSA-N 195.971 -1.483 50 10 AAGE N#CCCS(=O)(=O)NCB(O)O 1923810860 QBNISKFVPSFMSH-UHFFFAOYSA-N 192.005 -2.169 50 10 AAGE NNC(=O)c1cn(CCF)nn1 2242290762 WVDARKWOKVAEIH-UHFFFAOYSA-N 173.151 -1.149 50 10 AAGE CN(C)NC(=O)[C@@]12CCO[C@H]1CNC2 2242595576 BNRMMIPBUFRYCF-IONNQARKSA-N 199.254 -1.042 50 10 AAGE CC(=O)NNC(=O)[C@H]1CCCN1 49805011 DMUVDZVPSGTSHZ-ZCFIWIBFSA-N 171.200 -1.094 50 10 AAGE C[C@@H](CN)C(=O)NN 58854099 NHOBZHDCYYTFBN-VKHMYHEASA-N 117.152 -1.429 50 10 AAGE C[C@H](N)C(=S)N[C@@H](C)B(O)O 169954392 BTELILDAVLHMTG-IMJSIDKUSA-N 176.050 -1.349 50 10 AAGE Cc1c[n+]([O-])ccc1B(O)O 170001255 GKMHVPGGGPWOSN-UHFFFAOYSA-N 152.946 -1.692 50 10 AAGE NNC(=O)CNC(=O)c1ccoc1 306547037 FIQXLHVIQCSOAM-UHFFFAOYSA-N 183.167 -1.001 50 10 AAGE C[C@H](O)[C@@H](O)[C@H](O)C=NNC(N)=O 308050797 GNSOSMKGZQXBHQ-VPENINKCSA-N 191.187 -2.257 50 10 AAGE Cc1cc(C(=O)NCB(O)O)on1 701939397 QGCZQJBZNSJZNR-UHFFFAOYSA-N 183.960 -1.275 50 10 AAGE O=C(CCn1cccn1)NCB(O)O 701957581 FQOVDMRIURTJGV-UHFFFAOYSA-N 197.003 -1.599 50 10 AAGE C[C@@H]1CO[C@H](C(=O)NCB(O)O)C1 718526349 LMBQHEZKCAQSTH-WDSKDSINSA-N 187.004 -1.460 50 10 AAGE CC1(O)CC2(CN(CC(=O)NN)C2)C1 1886136396 AXDYQMYAAVOOSU-UHFFFAOYSA-N 199.254 -1.177 50 10 AAGE O=C(NCB(O)O)[C@]12CCOC[C@@H]1C2 1891627536 QXRCEVMYSDHOJS-XPUUQOCRSA-N 199.015 -1.459 50 10 AAGE NNC(=O)CN1[C@H]2CC[C@@H]1C[C@@H](O)C2 1934048958 CRFIYOXGSFQFIL-RNLVFQAGSA-N 199.254 -1.036 50 10 AAGE OB(O)c1cnn(C[C@H]2CO2)c1 1951329728 UBSQXTNEXQOPKX-LURJTMIESA-N 167.961 -2.038 50 10 AAGE C[C@@H](CN)Oc1cc(B(O)O)ccn1 2210059752 CNMGOZCPEKZDSA-LURJTMIESA-N 196.015 -1.513 50 10 AAGE CCNCCNC(=O)C#CB(O)O 2241468960 XRQMATOHYUGJQG-UHFFFAOYSA-N 184.004 -2.273 50 10 AAGE C[C@H]1CCC(=O)N1C(=O)C#CB(O)O 2241475739 DPOLJHVPUXTCFJ-LURJTMIESA-N 194.983 -1.461 50 10 AAGE NNC(=O)C1(N)CC1 83836264 UPDJYOAJNYKBLS-UHFFFAOYSA-N 115.136 -1.532 50 10 AAGE CCOC(=O)[C@@H](N)C(=O)NN 160104460 LAJJXWXOAAIBNE-VKHMYHEASA-N 161.161 -2.133 50 10 AAGE C[C@@H](C(=O)NNC=O)n1cncn1 307510211 KLSAPBPBGLPIGE-YFKPBYRVSA-N 183.171 -1.384 50 10 AAGE N#CC(/C=N/NC(N)=O)=C(/O)NC=O 307510401 OLXINOFQLRHWRX-BNIAPZMKSA-N 197.154 -1.320 50 10 AAGE COCC(=O)NNC(=O)C(N)=O 307942016 ZGUFVDCNDSDNLN-UHFFFAOYSA-N 175.144 -2.735 50 10 AAGE COC(=O)CNC(=O)NNC(C)=O 379410312 FUJTXRNWURHHJC-UHFFFAOYSA-N 189.171 -1.490 50 10 AAGE C[C@@H]1[C@@H](O)CN1CCCC(=O)NN 1882448829 ZSFIHDQWJCMHSM-RQJHMYQMSA-N 187.243 -1.179 50 10 AAGE C[C@@H]1CC[C@H]([C@H](N)C(=O)NN)O1 1953709388 YBCDVCFGIKWHNC-PBXRRBTRSA-N 173.216 -1.129 50 10 AAGE COC(=O)[C@H](N)CB(O)O 2080978594 OAPKYUSVDLKHLW-GSVOUGTGSA-N 146.939 -2.041 50 10 AAGE NOCCN=c1ccc(B(O)O)c[nH]1 2210059768 CTXFAZDDWPFYJN-UHFFFAOYSA-N 197.003 -2.515 50 10 AAGE N#CCONC(=O)C1(B(O)O)CC1 2241473545 MIOFXSHSGOKPON-UHFFFAOYSA-N 183.960 -1.435 50 10 AAGE CO[C@H]1C[C@H]1NC(=O)C1(B(O)O)CC1 2241481601 UHYYAWXFENASLZ-RITPCOANSA-N 199.015 -1.103 50 10 AAGE O=C([C@@H]1C[C@@H]1B(O)O)N1CCCN1 2241495770 MIRYUEQKDUZJOT-RITPCOANSA-N 184.004 -1.414 50 10 AAGE CN(C)NC(=O)[C@@H]1CN=C(N)NC1 4423216 CXPDETNHNUZPAE-UHFFFAOYSA-N 185.231 -1.887 50 10 AAGE OC[C@H]1O[C@@H](O)[C@H](Cl)[C@@H](O)[C@H]1O 44608298 SNGNCYILSHZBLM-VFUOTHLCSA-N 198.602 -1.975 50 10 AAGE NNC(=O)C1=CC(=O)NC1=O 115749332 WVUBHLNQILXSAF-UHFFFAOYSA-N 155.113 -2.441 50 10 AAGE NNC(=O)C(F)C(=O)NN 138046204 LNJVRKGDIAGUAX-UHFFFAOYSA-N 150.113 -2.696 50 10 AAGE C[C@@H](O)[C@H]1CCN(CC(=O)NN)C1 159485221 NEAMEWTVPSIXQM-RQJHMYQMSA-N 187.243 -1.321 50 10 AAGE CO/C(C=O)=C/[C@H](O)[C@@H](O)CO 238332068 LOUBRDMWHMERSC-MVZICMOUSA-N 176.168 -1.570 50 10 AAGE Cc1ccc(B(O)O)nc1C=O 238530751 MGVTWSHEQRZHNF-UHFFFAOYSA-N 164.957 -1.118 50 10 AAGE NNc1ccc(B(O)O)c(C=O)c1 306917350 YZDFWNHEACCENI-UHFFFAOYSA-N 179.972 -1.536 50 10 AAGE COCC(=O)NNC(=O)C(=O)OC 308403889 INTIHTSBWABLOZ-UHFFFAOYSA-N 190.155 -2.047 50 10 AAGE CN(CC(=O)NN)CC1(C)COC1 702970670 YRFHCJZGXHLHOK-UHFFFAOYSA-N 187.243 -1.055 50 10 AAGE NNC(=O)CCN1CC2(CC[C@@H]2O)C1 1885318627 PNPJRQMSOXWDRU-ZETCQYMHSA-N 199.254 -1.177 50 10 AAGE Cc1ncc[nH]c1=NC(=O)C(=O)NN 1886892510 UENYUSMXJTTYFC-UHFFFAOYSA-N 195.182 -1.865 50 10 AAGE NNC(=O)CN1CC([C@H](O)CO)C1 1887182329 QNEKQNHMBYXBAF-ZCFIWIBFSA-N 189.215 -2.739 50 10 AAGE COC[C@H](C)C(=O)NNCCO 1924080725 HRINBOWRMYTVOC-LURJTMIESA-N 176.216 -1.118 50 10 AAGE N[C@H]1C[C@H](CNC(=O)C#CB(O)O)C1 2241478311 CABOOAVNZGRFEJ-LJGSYFOKSA-N 196.015 -2.145 50 10 AAGE CN(CCO)C(=O)[C@H]1C[C@H]1B(O)O 2241495063 GMCYKNCWHDITNY-NTSWFWBYSA-N 187.004 -1.700 50 10 AAGE CC1(O)[C@H]2C[C@H]1CN(CC(=O)NN)C2 2241819557 MVIMBKSJQJKUAT-BQBZGAKWSA-N 199.254 -1.321 50 10 AAGE OB(O)c1ccc2c(n1)CCOC2 2242392068 PXCRXTDPBWZHCK-UHFFFAOYSA-N 178.984 -1.166 50 10 AAGE O=C1C[C@H](O)C(=O)O1 113244930 KPYCVQASEGGKEG-REOHCLBHSA-N 116.072 -1.179 50 10 AAGE NNC(=O)c1cc(C(=O)NN)ncn1 196030419 ZOOQSWHSXRCYPZ-UHFFFAOYSA-N 196.170 -2.316 50 10 AAGE COCc1ccc(B(O)O)cn1 219565153 YECZITSTIBVKQJ-UHFFFAOYSA-N 166.973 -1.092 50 10 AAGE CCC(=O)NNC(=O)CC(N)=O 238211433 GZJHXRLMEFGKRM-UHFFFAOYSA-N 173.172 -1.581 50 10 AAGE Cc1cc([N+](=O)[O-])cnc1B(O)O 238554599 JSMCIRKNTMRRGY-UHFFFAOYSA-N 181.944 -1.022 50 10 AAGE Nc1ccc(B(O)O)c(N)n1 238573543 FUHJAAZUOISULI-UHFFFAOYSA-N 152.950 -2.074 50 10 AAGE NNC(=O)OC[C@@H](N)C(=O)O 238662588 NWKNFSNTFZZTLY-UWTATZPHSA-N 163.133 -2.002 50 10 AAGE NCc1ccc(B(O)O)c(F)n1 238676366 FOYLNJKNAMCXLV-UHFFFAOYSA-N 169.952 -1.641 50 10 AAGE CNCC(=O)NNC(=O)C(F)(F)F 306224075 SQRCMSYRDGNLCY-UHFFFAOYSA-N 199.132 -1.085 50 10 AAGE COC[C@@H](C)NC(=O)NNC(N)=O 308401242 HDXCLGCEWSGGQK-SCSAIBSYSA-N 190.203 -1.096 50 10 AAGE NNC(=O)CN1CCC[C@@H]1CCO 379344147 OSHFBWQCXYFLIH-SSDOTTSWSA-N 187.243 -1.177 50 10 AAGE NC(=O)NNC(=O)c1cccnn1 606257014 TZPHXTGTPJZPCE-UHFFFAOYSA-N 181.155 -1.210 50 10 AAGE NNC(=O)[C@H]1CCOCC[C@@H]1N 1880610047 NEWNOPYTUPUWIP-WDSKDSINSA-N 173.216 -1.270 50 10 AAGE NNC(=O)C(=O)N1CCCO1 1928668078 GYZHMOZUJNYRQC-UHFFFAOYSA-N 159.145 -1.860 50 10 AAGE N#C[C@@H](O)[C@H](N)c1c[nH]c(=O)cn1 1952958055 JBWDMBCPORSRDR-IYSWYEEDSA-N 180.167 -1.346 50 10 AAGE O=C(C#CB(O)O)NC[C@H]1C[C@H](O)C1 2241467971 FGMSXWBFRJWKLR-LJGSYFOKSA-N 196.999 -2.111 50 10 AAGE C[C@@]1(O)CCN(C(=O)C#CB(O)O)C1 2241479522 ZQICKDSGWLYIQK-MRVPVSSYSA-N 196.999 -2.015 50 10 AAGE CNC(=O)C1CC(B(O)O)C1 2241496431 SOMMLHCLXVLCPZ-UHFFFAOYSA-N 156.978 -1.015 50 10 AAGE O=CN1CCc2c(B(O)O)cccc21 2241562479 OMDBFOLUGREOLE-UHFFFAOYSA-N 190.995 -1.115 50 10 AAGE C[C@@H](CC(=O)NN)N1C(=O)CCC1=O 2297013495 RUIKKGVKHPCQQJ-YFKPBYRVSA-N 199.210 -1.096 50 10 AAGE CN[C@@H](C)C(=O)NN 39224470 OIOJIKOJUVGDDA-VKHMYHEASA-N 117.152 -1.416 50 10 AAGE OC(O)[C@H](O)CCl 104689415 DMHHQIBDZZWDEJ-UWTATZPHSA-N 126.539 -1.103 50 10 AAGE O=C1C[C@@H](C(=O)NCCCl)NN1 170233013 NNTFLJSKOQQVAO-BYPYZUCNSA-N 191.618 -1.266 50 10 AAGE Nc1ccc([N+](=O)[O-])cc1B(O)O 211875966 IXVBWLHKOCPVJG-UHFFFAOYSA-N 181.944 -1.143 50 10 AAGE C[C@H](O)CN(C)C[C@@H](C)C(=O)NN 216474446 XREQFURYKVDOJC-RQJHMYQMSA-N 189.259 -1.075 50 10 AAGE NC(=O)NN=Cc1cc(O)nc(O)n1 263604333 OOESPNWBLCLGOI-UHFFFAOYSA-N 197.154 -1.110 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](O)[C@H](Cl)[C@H]1O 306316593 CRJLKIILIKSPDH-ZSNZIGRDSA-N 198.602 -1.975 50 10 AAGE CN(C)C1CN(C(=O)C(=O)NN)C1 307628219 LZANGJZJJXDNFM-UHFFFAOYSA-N 186.215 -2.251 50 10 AAGE NNC(=O)C[S@](=O)CC(=O)O 526845211 CNIQQNATGDMSRG-NSHDSACASA-N 180.185 -2.190 50 10 AAGE CNNC(=O)[C@@H]1CC(=O)NC(=O)N1 575567784 YMEWDCJRPMTXSO-VKHMYHEASA-N 186.171 -2.165 50 10 AAGE OB(O)/C=C\c1nnc2n1CCOC2 701540581 SPXQIYUCNAGLQD-UPHRSURJSA-N 194.987 -1.167 50 10 AAGE C[C@H](N=C=O)C1=C=[N+](C)NN1 885239839 HMYZBKBXZZCTNQ-YFKPBYRVSA-N 153.165 -1.071 50 10 AAGE O=C(NCB(O)O)[C@]12CCOC[C@H]1C2 1891627535 QXRCEVMYSDHOJS-SVRRBLITSA-N 199.015 -1.459 50 10 AAGE C[C@H]1CN[C@@H](C(=O)NN(C)C)CO1 1954879684 DYYALVVRRBZNPT-NKWVEPMBSA-N 187.243 -1.044 50 10 AAGE CN(C)Nc1ncccc1B(O)O 2209386574 FTEDKEBWLPEXCR-UHFFFAOYSA-N 181.004 -1.350 50 10 AAGE Cn1cc(B(O)O)c(C(=O)NC#N)n1 2241468309 LGVCRXBHPKLZBF-UHFFFAOYSA-N 193.959 -2.689 50 10 AAGE NC(=O)NNC(=O)c1cc(=O)cc[nH]1 2241652403 SJUGFHMLBVRWFI-UHFFFAOYSA-N 196.166 -1.312 50 10 AAGE Cn1nccc1C(=O)NNC(N)=S 83590886 KXHCVVXMENKIBC-UHFFFAOYSA-N 199.239 -1.102 50 10 AAGE N[C@@]12C[C@@H]1C(=O)OC2=O 100180968 GAVGHGRWCNPBET-MVHIGOERSA-N 127.099 -1.213 50 10 AAGE COCCN(CCO)CC(=O)NN 124256105 UPVWPSZPNWVNNM-UHFFFAOYSA-N 191.231 -2.083 50 10 AAGE NNC(=O)CCN1C[C@H](O)[C@H](O)C1 236234423 BWPVRXSXUFSTLS-OLQVQODUSA-N 189.215 -2.596 50 10 AAGE OB(O)c1c(O)ccnc1F 238614237 IETQCKJGSXUAIG-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE Nc1ncc(B(O)O)s1 238673453 BMIFBGHFYXPLIO-UHFFFAOYSA-N 143.964 -1.595 50 10 AAGE Cn1c(C(=O)NN)cc(=O)n1C 306278481 QHYSXIRGJZWKSD-UHFFFAOYSA-N 170.172 -1.673 50 10 AAGE NC(=O)NNC(=O)N[C@H]1CCOC1 306996636 SWQFCDFELPBRNQ-BYPYZUCNSA-N 188.187 -1.342 50 10 AAGE C[C@@H]1OCCN[C@H]1C(=O)NN 307307826 NIDIHNNXBZHZIE-CRCLSJGQSA-N 159.189 -1.647 50 10 AAGE NC(=O)NN[C@@H]1CCS(=O)(=O)C1 307575382 IPCQLSUWYIJYLT-SCSAIBSYSA-N 193.228 -1.654 50 10 AAGE NNC(=O)[C@@H]1C[C@H](F)CN1 575564159 DRPZTTBKJDBFGC-IMJSIDKUSA-N 147.153 -1.324 50 10 AAGE CC(C)[S@](=O)NCB(O)O 701948628 BRRMTCRNEUYXOZ-JTQLQIEISA-N 165.023 -1.340 50 10 AAGE C[C@H](O)CN(C)NC(=O)CC(N)=O 1332174456 DETJMAAPWSHDNI-YFKPBYRVSA-N 189.215 -1.794 50 10 AAGE CCc1cc(B(O)O)on1 1880057503 PADWMZMNCCDBIJ-UHFFFAOYSA-N 140.935 -1.083 50 10 AAGE NNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]21 1880147374 DOIMSZMMYDDCDB-LMVFSUKVSA-N 157.173 -1.053 50 10 AAGE NCC12CC(C(=O)NN)(CCO1)C2 1882176946 LISHQEFOFGBYHP-UHFFFAOYSA-N 185.227 -1.126 50 10 AAGE C=C(CN1CC2(COC2)C1)B(O)O 1883733506 VJAGBYNFRKXDAN-UHFFFAOYSA-N 183.016 -1.113 50 10 AAGE CCC#CC(=O)NCCC#CB(O)O 1890856115 FVMNYSGIINUXPX-UHFFFAOYSA-N 193.011 -1.079 50 10 AAGE C[C@@H]1CC(=O)N1CCC(=O)NN 1953458477 RWDMTQYIVDQYEB-RXMQYKEDSA-N 171.200 -1.013 50 10 AAGE C[C@@H]1C[C@H]1S(=O)(=O)NCB(O)O 1953599542 GXTHVNZRSJPVGS-RFZPGFLSSA-N 193.033 -1.674 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@H]1C[C@@H]2O 1956910850 GTUBKPDSYUJHTE-SRQIZXRXSA-N 199.210 -2.042 50 10 AAGE C=C(CS(=O)(=O)N(C)C)B(O)O 2241488653 AQMYBMNGOHMEDQ-UHFFFAOYSA-N 193.033 -1.554 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@H](O)[C@H]1C 2242163312 QTIYPDGGRSXPFC-VQVTYTSYSA-N 187.243 -1.180 50 10 AAGE NNC(=O)CCOC1COC1 98059731 WEGPAOOESCZWFL-UHFFFAOYSA-N 160.173 -1.218 50 10 AAGE CNCC(=O)NNC(C)=O 197838901 JTAHDFINWCVLRB-UHFFFAOYSA-N 145.162 -1.627 50 10 AAGE O=C1OC(=O)[C@@H]2CNC[C@@H]12 207563273 WGRNJBASWAHMQX-QWWZWVQMSA-N 141.126 -1.095 50 10 AAGE N/C=C(/C=O)NC=O 211967908 FVKUUCXWFLRAJD-RJRFIUFISA-N 114.104 -1.269 50 10 AAGE Cc1cnc(N)c(C(=O)NN)n1 238529468 FSRHAOWJXXWXLS-UHFFFAOYSA-N 167.172 -1.029 50 10 AAGE COC1(C)CN(C(=O)C(=O)NN)C1 307272370 UDQYQRJDIHHHAH-UHFFFAOYSA-N 187.199 -1.776 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H](C)[C@@H](O)C1 307468135 QUIDFGZODFRZFB-VQVTYTSYSA-N 187.243 -1.323 50 10 AAGE COC(=O)NNC(=O)N[C@@H](C)CO 308145447 AECDMNXSNZKLLE-BYPYZUCNSA-N 191.187 -1.063 50 10 AAGE NNC(=O)C[S@@](=O)CCC(N)=O 526909193 HPKYYNFGCZLNBU-LBPRGKRZSA-N 193.228 -2.400 50 10 AAGE C[C@H](C(=O)NN)N1CC(CO)C1 1929744229 YXMZNRYPLIRSKI-RXMQYKEDSA-N 173.216 -1.711 50 10 AAGE CC(C)(O)CNC(=O)C#CB(O)O 2241467940 DRUMSRSASHIBSC-UHFFFAOYSA-N 184.988 -2.111 50 10 AAGE CC(C)(C)ONC(=O)C#CB(O)O 2241468107 HJHAWCLXPJADNZ-UHFFFAOYSA-N 184.988 -1.152 50 10 AAGE CCOCCNC(=O)C#CB(O)O 2241468258 KHCZPUQYZAGWPS-UHFFFAOYSA-N 184.988 -1.846 50 10 AAGE O=C(C#CB(O)O)Nc1nc(O)n[nH]1 2241468747 UFWLZVMMIDVFGR-UHFFFAOYSA-N 195.931 -2.536 50 10 AAGE NC(=O)[C@H]1CCN1C(=O)C#CB(O)O 2241470831 CLVDWOXNZSJMTF-RXMQYKEDSA-N 195.971 -2.912 50 10 AAGE CONC(=O)c1coc(B(O)O)c1 2241472135 PJPGIKVNDWWLHA-UHFFFAOYSA-N 184.944 -1.749 50 10 AAGE CC1(NC(=O)[C@H]2C[C@H]2B(O)O)CNC1 2241494818 DNCRJESUIJJYIU-NTSWFWBYSA-N 198.031 -1.673 50 10 AAGE CN(C)CCNCCC(=O)NN 58840094 HFTGVYMQACTUGX-UHFFFAOYSA-N 174.248 -1.482 50 10 AAGE CNC(=O)CN(C)CCC(=O)NN 82467404 BFYUVLIOCRVXCB-UHFFFAOYSA-N 188.231 -1.956 50 10 AAGE CN(C)NC(=O)C(=O)NCCO 238336891 SDWPDKLYMJPVLV-UHFFFAOYSA-N 175.188 -2.312 50 10 AAGE C[C@@H]1NC(=O)[C@H](Cl)[C@H](O)N1 306786042 KHVWBDHZOIDPHQ-NUNKFHFFSA-N 164.592 -1.022 50 10 AAGE N#CC1=C[C@H](O)[C@H](O)[C@H](O)C1 307384982 JPADHRXNLSKNGS-XVMARJQXSA-N 155.153 -1.077 50 10 AAGE Cl[C@@H]1NCN[C@@H]2NNC[C@@H]12 585664611 RFVDHCFQEFZCRL-VPENINKCSA-N 162.624 -1.248 50 10 AAGE OB(O)c1ccnn1-c1ccccn1 1887825578 LFARLAUWGMHSBW-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@H](O)[C@H]1C 1914256383 QTIYPDGGRSXPFC-QYNIQEEDSA-N 187.243 -1.180 50 10 AAGE OB(O)c1cccnc1OC1CNC1 2210066274 TVOOLWONYONZSM-UHFFFAOYSA-N 193.999 -1.888 50 10 AAGE CC1(O)CN(C(=O)C#CB(O)O)C1 2241479528 ZTRJRJJPKCSJGI-UHFFFAOYSA-N 182.972 -2.405 50 10 AAGE Cn1nc(C(=O)NN)cc1B(O)O 2241495531 KDSWDSKJHMGHSD-UHFFFAOYSA-N 183.964 -3.297 50 10 AAGE NCCONC(=O)[C@H]1C[C@H]1B(O)O 2241496467 SVBPTGNZKVTPPO-CRCLSJGQSA-N 187.992 -2.144 50 10 AAGE NNC(=O)N1CC(O)(CCO)C1 2241808048 HUAOCSAVKOICAJ-UHFFFAOYSA-N 175.188 -2.001 50 10 AAGE CN(CC1CC1)C(=O)C(=O)NN 37926232 ZDVLSAOTINIWSB-UHFFFAOYSA-N 171.200 -1.155 50 10 AAGE NNC(=O)C(=O)NC[C@H]1CCOC1 61148292 KITILKQUPRSLQA-RXMQYKEDSA-N 187.199 -1.871 50 10 AAGE NC1(c2cncc(B(O)O)c2)CC1 199207104 DHEZQDYVNRDKQA-UHFFFAOYSA-N 178.000 -1.291 50 10 AAGE NNC(=O)C1[C@H]2CNC[C@H]12 885228698 BQHMYUTZMVKMAM-IMJSIDKUSA-N 141.174 -1.558 50 10 AAGE N[C@H](B(O)O)[C@@H]1[C@@H]2CCOC[C@H]21 1880852222 UVZIGRKCXLFFSE-GBNDHIKLSA-N 171.005 -1.392 50 10 AAGE O=C1CC([C@@H](O)CO)CC(=O)O1 1951726324 UZGKZBGGSBXWMQ-YFKPBYRVSA-N 174.152 -1.181 50 10 AAGE N#C[C@H](O)[C@H](N)c1cc(O)nc(O)n1 1952956828 PLXXKHCLHKDAAB-UJURSFKZSA-N 196.166 -1.228 50 10 AAGE Cn1ncc(B(O)O)c1OCC1CC1 2060001680 ANOCLHQSUNDIHT-UHFFFAOYSA-N 196.015 -1.111 50 10 AAGE CN(CCO)c1ncc(B(O)O)cn1 2210060988 OZCVSYVGOXGQLK-UHFFFAOYSA-N 197.003 -2.415 50 10 AAGE O=C(C#CB(O)O)N1C[C@@H]2C[C@H](C1)O2 2241467900 CWAXETFKDOSGHI-KNVOCYPGSA-N 194.983 -1.999 50 10 AAGE CC1(N)CN(C(=O)C#CB(O)O)C1 2241468375 MUISAFSKQHOAFC-UHFFFAOYSA-N 181.988 -2.439 50 10 AAGE NC(=O)NC(=O)C#CB(O)O 2241584592 QJABEHMPUYQLFE-UHFFFAOYSA-N 155.906 -2.803 50 10 AAGE NC(=O)[C@@](O)(CCl)CC(=O)O 146644679 LZJZJKBTVXNNFN-YFKPBYRVSA-N 181.575 -1.084 50 10 AAGE OC[Si](O)(O)O 195883005 AJBXXAZBWHWHER-UHFFFAOYSA-N 110.141 -2.566 50 10 AAGE in-vitro N#C/C(=C/N)C(=O)/N=C/N 211961298 GOPMWAZQUYURSG-RJRFIUFISA-N 138.130 -1.134 50 10 AAGE Cc1c(O)cncc1B(O)O 238545196 DTUBKFODMLPDRP-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE O=C(O)c1nc(F)ccc1B(O)O 238623291 LIKUBUWRQKKLCA-UHFFFAOYSA-N 184.919 -1.401 50 10 AAGE CO[C@H]1OC(C=O)=C[C@H](O)[C@H]1O 306715226 YISYJKZMQGJXSO-XVMARJQXSA-N 174.152 -1.206 50 10 AAGE NCC(=O)N/N=C/c1c[nH]cn1 306982217 RFROVOBMLXHZJE-XCVCLJGOSA-N 167.172 -1.182 50 10 AAGE CC(=O)NN[C@H](C)c1nnnn1C 307749101 FIDCVFBJSAUOQY-SCSAIBSYSA-N 184.203 -1.088 50 10 AAGE CC(=O)NNC(=O)CNCCCO 308130337 AMTVOZXBEHKBOO-UHFFFAOYSA-N 189.215 -1.874 50 10 AAGE COC[C@@H](C)NNC(=O)C(=O)OC 308407243 KASIMIIQEVXOHZ-RXMQYKEDSA-N 190.199 -1.185 50 10 AAGE C[C@@H](NNC(=O)C1CC1)C(N)=O 379314196 LZNFLYIIJQXKRD-SCSAIBSYSA-N 171.200 -1.109 50 10 AAGE CC(C)[C-]1NC#CN1CC(=O)NN 885411708 NARHTUVUTITWNY-UHFFFAOYSA-N 181.219 -1.055 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@@H](O)[C@H]1C 1914256861 QTIYPDGGRSXPFC-FSDSQADBSA-N 187.243 -1.180 50 10 AAGE NNC(=O)C1=CCCNC1 1923218702 ZHUKXHCQGPKOIC-UHFFFAOYSA-N 141.174 -1.104 50 10 AAGE Cn1nncc1CNCB(O)O 1923931112 GSOCCUYAOTUQML-UHFFFAOYSA-N 169.981 -2.083 50 10 AAGE NNC(=O)C1[C@H]2CS(=O)(=O)C[C@H]12 1953770956 NEPLJEOPDMFOPN-IMJSIDKUSA-N 190.224 -1.733 50 10 AAGE NCCONc1ncc(B(O)O)cn1 2210061154 RABPFCRDBKLSCL-UHFFFAOYSA-N 197.991 -2.541 50 10 AAGE O=C(C#CB(O)O)NCCC(F)F 2241467787 AXHUZSYHCLSQJH-UHFFFAOYSA-N 190.942 -1.227 50 10 AAGE O=C(C#CB(O)O)NC1CNC1 2241479208 TYSQHSNVNVFFBH-UHFFFAOYSA-N 167.961 -2.910 50 10 AAGE OB(O)c1nncn1C1CC1 2297006046 JIPUWHXDGRROKQ-UHFFFAOYSA-N 152.950 -1.707 50 10 AAGE NNC(=O)C(=O)NNc1ccccn1 1884471 OWVGSBZCBFBNFT-UHFFFAOYSA-N 195.182 -1.485 50 10 AAGE COC(=O)/C(NN)=C(\C#N)C(=O)O 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Cn1nc(C(=O)NN)ccc1=O 37387959 OJVJLLRTSBVQOV-UHFFFAOYSA-N 168.156 -1.616 50 10 AAGE C[C@@H](CC(=O)NN)N1CCNCC1 82469784 PYDYOINYZFJPIH-ZETCQYMHSA-N 186.259 -1.340 50 10 AAGE N#C/C(C(N)=O)=C1\NCCO1 100435446 GYJUPLPULOMMAQ-XQRVVYSFSA-N 153.141 -1.173 50 10 AAGE O[C@@H]1[C@@H](CCl)O[C@@H](O)[C@@H]1O 104686539 BFLITKCZBOUHRA-TXICZTDVSA-N 168.576 -1.336 50 10 AAGE CC(=O)/C(=N\O)C(=O)NN 210614519 XAEKGYISSCGIGK-XVNBXDOJSA-N 145.118 -1.605 50 10 AAGE COc1nccnc1B(O)O 226195710 FUQFNHRIASZDRG-UHFFFAOYSA-N 153.934 -1.835 50 10 AAGE N#Cc1ncc(B(O)O)cc1CN 238627457 WLOGBNLERXJMBW-UHFFFAOYSA-N 176.972 -1.908 50 10 AAGE NNC(=O)NC1=NC(=O)CC(=O)N1 238661035 QVHOPGAUVLCKEB-UHFFFAOYSA-N 185.143 -2.438 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2CC[C@H]1C2 306567543 SOICEVYNUGHMGN-WDSKDSINSA-N 183.211 -1.013 50 10 AAGE C[C@@H](CS(C)(=O)=O)C(=O)NN 307212370 VMPWLUSDGSJUOX-BYPYZUCNSA-N 180.229 -1.343 50 10 AAGE CC(=O)NN[C@H](C)C(N)=O 307527448 SEBRITDSMPVMAF-GSVOUGTGSA-N 145.162 -1.499 50 10 AAGE 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CC(=O)NNC(=O)[C@H]1COC(=O)N1 307663943 JOHJTPWBGKWFPB-SCSAIBSYSA-N 187.155 -1.738 50 10 AAGE O=CC1=C=[N+](C[C@H]2CCC(=O)N2)NN1 885666689 DACLIIAYUZWFLI-ZCFIWIBFSA-O 195.202 -1.947 50 10 AAGE NNC(=O)[C@H](N)C1CS(=O)(=O)C1 1881414183 ULXHBPUMKVJMPS-SCSAIBSYSA-N 193.228 -2.652 50 10 AAGE NNC(=O)N1C[C@H]2C[C@H]1[C@H]2CO 1881555540 FBHJCNPQKXEYKK-SRQIZXRXSA-N 171.200 -1.118 50 10 AAGE CN(C(=O)NN)[C@@H]1CCC(=O)NC1 1882577014 LAGBITYLKQACJF-RXMQYKEDSA-N 186.215 -1.220 50 10 AAGE N=c1[nH][nH]c2ccc(B(O)O)cc12 1883106648 SDEPQPYDLSLWQC-UHFFFAOYSA-N 176.972 -1.345 50 10 AAGE CO[C@@H](C(=O)NN)C1CCNCC1 1968305169 WKHUJDSMOZQQIW-SSDOTTSWSA-N 187.243 -1.009 50 10 AAGE CO[C@@H](C)[C@H](C)NC(=O)C#CB(O)O 2241478993 PJJRDKWOOQFPMM-BQBZGAKWSA-N 199.015 -1.459 50 10 AAGE NC(=O)NN=C1C(=O)NC(=O)NC1=O 1695837 JDSQZFBBZTWYER-UHFFFAOYSA-N 199.126 -2.623 50 10 AAGE N#C[C@H](O)CO 116317417 GLZDDCMPOSSPQC-VKHMYHEASA-N 87.078 -1.137 50 10 AAGE O=C/C=C\n1c(=O)[nH]c(=O)[nH]c1=O 199444242 WHLDRBZDESOOJR-UPHRSURJSA-N 183.123 -2.106 50 10 AAGE COC(=O)Nc1ccc(B(O)O)cn1 199735353 DBYJOFVINFDIFV-UHFFFAOYSA-N 195.971 -1.060 50 10 AAGE NCc1ncc(Cl)cc1B(O)O 238603380 PRTCUDJWZNPKIH-UHFFFAOYSA-N 186.407 -1.127 50 10 AAGE CCON(C)C(=O)C(=O)NN 1928668460 NXIRUPUUYWBMQL-UHFFFAOYSA-N 161.161 -1.614 50 10 AAGE NNC(=O)N[C@H]1CC(=O)NC1=O 1932170721 IHVLWVGBJKEDJW-REOHCLBHSA-N 172.144 -2.426 50 10 AAGE CC(=O)N=c1nc(B(O)O)[nH]s1 1953353697 NOLVWSMLFPPTER-UHFFFAOYSA-N 186.989 -2.402 50 10 AAGE CN(Cc1cnn(C)n1)C(=O)NN 1954081341 MWWKJHBTKNVEJR-UHFFFAOYSA-N 184.203 -1.170 50 10 AAGE NNC(=O)CN1C[C@@H](O)C[C@@H](O)C1 1954542558 TVDIGCLFEVPKAR-OLQVQODUSA-N 189.215 -2.596 50 10 AAGE NOCCOc1ccc(B(O)O)cn1 2210063726 CDQHDWKFIQGQHW-UHFFFAOYSA-N 197.987 -1.970 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C[C@H]1F 2241468022 FYVRCYAUYDLHMY-UHNVWZDZSA-N 170.936 -1.772 50 10 AAGE NC[C@@H]1CCN1C(=O)C#CB(O)O 2241468645 RPFLDGJOEUKIPB-LURJTMIESA-N 181.988 -2.439 50 10 AAGE O=C(NC[C@@H]1CCO1)[C@@H]1C[C@@H]1B(O)O 2241474894 MSJQVEYEJABNEZ-XVMARJQXSA-N 199.015 -1.246 50 10 AAGE CN(CCC#N)C(=O)C#CB(O)O 2241476141 MKYPPAGUFCPTGI-UHFFFAOYSA-N 179.972 -1.626 50 10 AAGE CCN1CC(NC(=O)C#CB(O)O)C1 2241478913 NNCZNKJJHJGUHI-UHFFFAOYSA-N 196.015 -2.178 50 10 AAGE NNC(=O)c1c[nH]c(=O)[nH]1 104087172 HJOPVXFJISJOSH-UHFFFAOYSA-N 142.118 -1.694 50 10 AAGE O=C(CO)[C@H](O)[C@@H](O)CCl 104688463 BRPVATGUACRJDP-WVZVXSGGSA-N 168.576 -1.492 50 10 AAGE CN(C)NC(=O)[C@]1(N)CCOC1 147312161 YVWGMKHFFKPGDL-ZETCQYMHSA-N 173.216 -1.303 50 10 AAGE Cc1nnn2c(B(O)O)cccc12 209747669 SVOOXCPDUXBWNS-UHFFFAOYSA-N 176.972 -1.282 50 10 AAGE C[C@@H]1CN(C)CCN1CC(=O)NN 235467085 IKRCPDAASSDLRX-SSDOTTSWSA-N 186.259 -1.388 50 10 AAGE NNC(=O)c1cn([C@@H]2CCOC2)nn1 238567822 MHNLLLUOIMFKBR-RXMQYKEDSA-N 197.198 -1.157 50 10 AAGE N#CC1=CO[C@H](CO)[C@H](O)[C@H]1O 306288207 MAQCDQZOLGWUQE-VQVTYTSYSA-N 171.152 -1.493 50 10 AAGE COCCOCC(=O)NNC=O 379327706 LXWPXLGHWVIBPR-UHFFFAOYSA-N 176.172 -1.573 50 10 AAGE C[C@@H](C(=O)N(C)N)S(C)(=O)=O 704702276 MTXXQOOJGOALCS-BYPYZUCNSA-N 180.229 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CMVAPZWLQBERNZ-UHFFFAOYSA-N 197.198 -1.974 50 10 AAGE CC(C)[C@H](O)C(=O)NN 82464769 VXPCKFRTFWHVDK-BYPYZUCNSA-N 132.163 -1.007 50 10 AAGE C[C@@H](SCC(N)=O)C(=O)NN 300774229 RQTYIIRKMOAJHH-GSVOUGTGSA-N 177.229 -1.417 50 10 AAGE CNC(=O)CCCC(=O)NNC=O 308388556 YKGALVSSLKTMEC-UHFFFAOYSA-N 187.199 -1.320 50 10 AAGE CC1(O)CN(C2=C(C#N)C#CNN2)C1 885559053 NTKSBPGIZBESLT-UHFFFAOYSA-N 190.206 -1.143 50 10 AAGE Cc1c([N+]2=C=C(C=O)NN2)nnn1C 885590793 WERGPCDBYVQGIP-UHFFFAOYSA-N 193.190 -1.457 50 10 AAGE NNC(=O)[C@H]1C[C@H]1CN1CCNCC1 885909440 PFHARKRPACITMR-YUMQZZPRSA-N 198.270 -1.482 50 10 AAGE NNC(=O)CN1CC[C@@H]2[C@@H](O)C[C@H]21 1882062733 SYHZDOQUWLCXSJ-XVMARJQXSA-N 185.227 -1.569 50 10 AAGE CN(CC(=O)NN)C[C@H]1[C@H]2OCC[C@H]12 1884453083 SPJQWVQZEFGWKM-BHNWBGBOSA-N 199.254 -1.057 50 10 AAGE Cc1cc(C(=O)NNCCO)nn1C 1929834124 WGSIACIFGAAEOK-UHFFFAOYSA-N 198.226 -1.045 50 10 AAGE NNC(=O)N1C[C@@H](O)[C@@H]2COC[C@@H]21 1954367766 XSTQNVBWFOWYLW-NGJCXOISSA-N 187.199 -1.739 50 10 AAGE CCn1ncc(C(=O)NNC(N)=O)n1 1956951107 QSDFTXFQULWDRM-UHFFFAOYSA-N 198.186 -1.389 50 10 AAGE CC[C@@H](CO)CNC(=O)C#CB(O)O 2241467984 FKHGJQSWXXCYQE-SSDOTTSWSA-N 199.015 -1.864 50 10 AAGE NC(=O)c1coc(B(O)O)c1 2241471326 IRDHCVJDUGYZRD-UHFFFAOYSA-N 154.918 -1.942 50 10 AAGE N#CCCNC(=O)[C@H]1C[C@@H]1B(O)O 2241495323 IQRRJKXRGBZOCA-WDSKDSINSA-N 181.988 -1.121 50 10 AAGE NNC(=O)N1CC[C@H]1[C@H](O)CO 2241829260 BBCVUKGTWWNXRA-CRCLSJGQSA-N 175.188 -2.003 50 10 AAGE CCCN(C)C(=O)C(=O)NN 37098811 DCTNUYLQMHPZOD-UHFFFAOYSA-N 159.189 -1.155 50 10 AAGE CCC(=O)NNC(=N)C(N)=O 39135349 VCFBXZCODRKGEE-UHFFFAOYSA-N 158.161 -1.520 50 10 AAGE NNC(=O)CCCP(=O)(O)O 95572669 WHSDCWUSGOKBQR-UHFFFAOYSA-N 182.116 -1.066 50 10 AAGE CC(=O)N1C(=O)N[C@@H]2C(=O)OC(=O)[C@H]21 238055221 OZKKVMOXYNOZIO-IMJSIDKUSA-N 198.134 -1.621 50 10 AAGE CCC(=O)NNc1cc(=O)[nH]c(=O)[nH]1 238211631 BRNZSCMHABBBRO-UHFFFAOYSA-N 198.182 -1.084 50 10 AAGE OB(O)c1ncc(O)cc1F 238638868 DREAQHRNPVAEDU-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE NNC(=O)[C@@H]1CCN1 307607819 GCIMDKXYEVELJK-VKHMYHEASA-N 115.136 -1.662 50 10 AAGE NNC(=O)[C@@H]1CC(=O)N1 718998310 PBSQLKFNEJARPZ-REOHCLBHSA-N 129.119 -2.135 50 10 AAGE C[C@]1(CO)CCCN1CC(=O)NN 723000568 PRVAWAKPQQCTHG-MRVPVSSYSA-N 187.243 -1.177 50 10 AAGE CC1=C=C(C(=O)NCB(O)O)NN1C 885839791 OWWCQKGOVNAFFV-UHFFFAOYSA-N 197.003 -2.049 50 10 AAGE OB(O)c1cnc([C@@H]2CCNC2)nc1 1614487920 IJCYXBGOUZZWPH-ZCFIWIBFSA-N 193.015 -1.767 50 10 AAGE O=C(CO)NC1(B(O)O)CCC1 1923809506 NTVLGRLEHRTBPZ-UHFFFAOYSA-N 172.977 -1.970 50 10 AAGE CS(=O)(=O)C[C@H](O)C#N 1951361312 QPMHJUFBQSEQOQ-SCSAIBSYSA-N 149.171 -1.085 50 10 AAGE CN(C)NC(=O)[C@@]12CNC[C@H]1COC2 1955584351 YWJYBPLYWPLUQJ-IONNQARKSA-N 199.254 -1.185 50 10 AAGE O=C(C#CB(O)O)N1C[C@@H]2C[C@H]2C1=O 2241478837 MAHRCQFEBSTEDX-NTSWFWBYSA-N 192.967 -1.993 50 10 AAGE OB(O)c1nnc2ncccn12 2297005871 FIXDJMNJOGXASZ-UHFFFAOYSA-N 163.933 -2.196 50 10 AAGE Cc1noc(C(=O)NN)c1C(=O)NN 34101538 NPJWLNRPYROYOV-UHFFFAOYSA-N 199.170 -1.810 50 10 AAGE C[C@@H](O)CN1C[C@@H]1C(=O)NN 39065439 LDUAFGARFMSJDS-DALOQNNESA-N 159.189 -1.959 50 10 AAGE C[C@@H](CC(=O)NN)NC[C@@H](C)O 58839076 MHJHFCJXOIUGEU-NTSWFWBYSA-N 175.232 -1.275 50 10 AAGE O=C1O[C@H]2[C@H](O[C@@H](O)[C@@H]2O)[C@H]1Cl 307030436 JVPLUSMMESVGIN-YBSDWZGDSA-N 194.570 -1.403 50 10 AAGE CN1C(=O)[C@H](C(=O)NN)C1(C)C 307376734 VOVZUQDYXRQMOA-BYPYZUCNSA-N 171.200 -1.157 50 10 AAGE O=CC1=C=[N+](CC2(O)CCC2)NN1 642863748 WWXYWKJBKHPVBM-UHFFFAOYSA-N 182.203 -1.311 50 10 AAGE C=C1C[C@H]1C(=O)NCB(O)O 1890910661 HJKHHZJSDDUUJE-RXMQYKEDSA-N 154.962 -1.309 50 10 AAGE CN(CC(=O)NN)C1(CO)CCC1 1914997815 CNVFCCAMXQTNNJ-UHFFFAOYSA-N 187.243 -1.177 50 10 AAGE C[C@H](F)CN=c1ccc(B(O)O)c[nH]1 2210068137 MHZVHMLUMTVCAB-LURJTMIESA-N 198.006 -1.047 50 10 AAGE C#C[C@@H](C)NC(=O)C#CB(O)O 2241469041 ZBZKZVNQECCYJW-ZCFIWIBFSA-N 164.957 -1.860 50 10 AAGE NNC(=O)c1ccsc1B(O)O 2241479941 CAUIIFJWHFMEEN-UHFFFAOYSA-N 186.001 -1.969 50 10 AAGE NC[C@@H]1CCN1C(=O)[C@H]1C[C@H]1B(O)O 2241494891 FPDQIWHBEQVMDP-LYFYHCNISA-N 198.031 -1.591 50 10 AAGE NNC(=O)CN1CCCNCC1 82470527 IMZLMBNJDPOZDA-UHFFFAOYSA-N 172.232 -1.728 50 10 AAGE CCNC(=O)NNC(=O)CO 225858556 BHVQBLVGOXJBTA-UHFFFAOYSA-N 161.161 -1.671 50 10 AAGE C[C@]1(O)CCN(C(=O)C(=O)NN)C1 235710117 DZBSXCIVOFZOFW-ZETCQYMHSA-N 187.199 -2.040 50 10 AAGE C[C@@H]1C[C@@H](C(=O)NN)NC1=O 238415848 WRVJLRJMCCSQSM-DMTCNVIQSA-N 157.173 -1.499 50 10 AAGE OB(O)c1cnn2c1NCCC2 238638053 PTYMSSQUSFXHRK-UHFFFAOYSA-N 166.977 -1.622 50 10 AAGE CC[C@H]1CN(CC(=O)NN)C[C@H]1O 306881620 HVBAKFUUAULBNO-NKWVEPMBSA-N 187.243 -1.321 50 10 AAGE C[C@H]1CN(C(=O)NN)C[C@@H]1O 307376363 BRASMYXNGVEWGW-WHFBIAKZSA-N 159.189 -1.118 50 10 AAGE C#CCCC(=O)NNN 307591164 DBLIFZIFDCJFGJ-UHFFFAOYSA-N 127.147 -1.106 50 10 AAGE C[C@H]1NC(=O)CC[C@@H]1NC(=O)NN 307599098 QIVUFWAYOOAIPO-UHNVWZDZSA-N 186.215 -1.174 50 10 AAGE Nc1nccc(B(O)O)c1O 691011565 ROMZUMYKGOYNDP-UHFFFAOYSA-N 153.934 -1.951 50 10 AAGE CN(N)C(=O)Cc1cc(O)nc(O)n1 704705270 GKAKFJMSHFDVSC-UHFFFAOYSA-N 198.182 -1.238 50 10 AAGE OCCCn1cc(B(O)O)cn1 716783539 GPABVLQLAAXQDY-UHFFFAOYSA-N 169.977 -2.055 50 10 AAGE N#CC1=C(N2CC(CN)C2)NNC#C1 885540602 QLBFSYXSVXMJRG-UHFFFAOYSA-N 189.222 -1.319 50 10 AAGE CN(C)C(=O)NCC=CB(O)O 1881336395 SWLFLRHUJYFZRH-UHFFFAOYSA-N 171.993 -1.174 50 10 AAGE C[C@@H](C(=O)NN)N1CC2(CN(C)C2)C1 1932061828 ZIOXKOHRWOREPP-ZETCQYMHSA-N 198.270 -1.388 50 10 AAGE Cn1nncc1[C@@H](N)[C@@H](O)C#N 1953065867 DDCZUPTWMOFZQT-NTSWFWBYSA-N 167.172 -1.301 50 10 AAGE C[C@@H](N)COCC(=O)NN(C)C 1953745703 OOBKZTLEXPYKIG-ZCFIWIBFSA-N 175.232 -1.057 50 10 AAGE CCN(C)c1cc(B(O)O)ncn1 1954361417 CMVKGWIHGXSYDT-UHFFFAOYSA-N 181.004 -1.388 50 10 AAGE C[C@H](CN1CC=C[C@@H](O)C1)C(=O)NN 1956307671 SKSZNOQRQZJYML-HTQZYQBOSA-N 199.254 -1.155 50 10 AAGE C/C=C/Cn1cc(B(O)O)cnc1=O 2210081635 PJXFMFYVCSPYCW-NSCUHMNNSA-N 193.999 -1.501 50 10 AAGE NC(=O)c1cc(B(O)O)cn1C1CC1 2241474045 VSJKJYFNVZPQEC-UHFFFAOYSA-N 193.999 -1.398 50 10 AAGE NNC(=O)[C@H](O)CO 115341660 ZSKOXNZLFYXWIR-UWTATZPHSA-N 120.108 -2.671 50 10 AAGE CN(CC(=O)NN)C(C)(C)CO 134188402 XMXGFVLKEONKRI-UHFFFAOYSA-N 175.232 -1.321 50 10 AAGE COc1nccc(O)c1B(O)O 238427871 LUAWNAZQXWTBMG-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE OB(O)c1cnc([C@H]2CCOC2)nc1 238653817 KFMVSEHZNLIRCF-LURJTMIESA-N 193.999 -1.340 50 10 AAGE O=C1N=C=C(C(=O)NCB(O)O)N1 885468132 PIRDSFJDNBOTLC-UHFFFAOYSA-N 182.932 -2.609 50 10 AAGE O=C(NNCCO)[C@]12COC[C@@H]1C2 1929836106 CYHSBYNUJCWHNP-POYBYMJQSA-N 186.211 -1.364 50 10 AAGE NNC(=O)C(=O)Nc1ccncn1 1933166989 PHQBPFSJCKKRMQ-UHFFFAOYSA-N 181.155 -1.595 50 10 AAGE NNC(=O)N1C[C@@H]2C[C@H]1[C@H](O)[C@H]2O 1954501745 CHQUSKOSLYVITN-BXKVDMCESA-N 187.199 -2.004 50 10 AAGE NNC(=O)C1(CN2CC(O)C2)CCC1 2209999118 PVPZDMAYJPOKCB-UHFFFAOYSA-N 199.254 -1.177 50 10 AAGE C[C@@H]1CC(=O)N1C(=O)C#CB(O)O 2241467836 BSBMKVURBFZSLK-RXMQYKEDSA-N 180.956 -1.851 50 10 AAGE O=C(C#CB(O)O)N1CC[C@@H](O)C1 2241468279 KRDAYJXGOGSVNJ-ZCFIWIBFSA-N 182.972 -2.405 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C[C@@H](CF)C1 2241468485 PFUDKQOOJVFFEJ-KNVOCYPGSA-N 198.990 -1.134 50 10 AAGE C#CC[C@H](C)NC(=O)C#CB(O)O 2241476103 LSNMMQOGDULYRV-ZETCQYMHSA-N 178.984 -1.470 50 10 AAGE CC1(CONC(=O)C#CB(O)O)CC1 2241479112 RNQRWSFYUGJPCJ-UHFFFAOYSA-N 196.999 -1.150 50 10 AAGE OC[C@@H]1O[C@@H](O)[C@@H](O)[C@H](Cl)[C@@H]1O 22054427 CRJLKIILIKSPDH-SXUWKVJYSA-N 198.602 -1.975 50 10 AAGE C[C@H](NNC(N)=O)C(=O)O 38887923 BCWAVSSLHRDPOL-REOHCLBHSA-N 147.134 -1.368 50 10 AAGE CC[C@H](COC)NC(=O)C(=O)NN 70659700 KRONVVHBISUIAL-RXMQYKEDSA-N 189.215 -1.483 50 10 AAGE C[C@H](O)C(=O)NC(=O)N(C)N 168029534 AEJLNWQHWLYDJN-VKHMYHEASA-N 161.161 -1.591 50 10 AAGE CNc1ccc(N)c(B(O)O)c1 204746463 CSEIWEFPBYTXNH-UHFFFAOYSA-N 165.989 -1.010 50 10 AAGE O=CNCc1ccc(B(O)O)cc1F 208614058 HZAFYVJWIPMONA-UHFFFAOYSA-N 196.974 -1.249 50 10 AAGE NNC(=O)CN1CCS1(=O)=O 307362492 IYGIYVZYSOOVQC-UHFFFAOYSA-N 179.201 -2.378 50 10 AAGE O[C@H](CCl)[C@H](O)[C@H](O)[C@H]1CO1 307648297 DQODCZOZAFGOJJ-ARQDHWQXSA-N 182.603 -1.293 50 10 AAGE COC(=O)C(=O)NNC(=O)CO 307933712 KJFUYEKBQJTYKZ-UHFFFAOYSA-N 176.128 -2.701 50 10 AAGE CC(=O)ONNC(=O)/C=C\C(=O)O 308005625 CFBGQOFGKFYVCY-IHWYPQMZSA-N 188.139 -1.274 50 10 AAGE COCCCCn1ccc(B(O)O)n1 694226636 FGXDRMXKBRNFRB-UHFFFAOYSA-N 198.031 -1.011 50 10 AAGE CO[C@@H](C)C(=O)NNC(N)=O 700859849 PUZPDXMNHMMYPT-VKHMYHEASA-N 161.161 -1.279 50 10 AAGE C[C@H]1CNC(=O)CN1C(=O)NN 1880840166 JYWNKSPANIXJAH-BYPYZUCNSA-N 172.188 -1.610 50 10 AAGE COCc1sncc1B(O)O 1931559121 ZLLBFRNOPRNQFA-UHFFFAOYSA-N 173.002 -1.031 50 10 AAGE O[C@H]1O[C@H](CCl)[C@H](O)[C@H](O)[C@H]1O 38234922 QMWDIHPSUCUMFU-PHYPRBDBSA-N 198.602 -1.975 50 10 AAGE C[C@H]1CNC[C@H](C)N1CC(=O)NN 77002861 ICGLBBPGXAHKSX-BQBZGAKWSA-N 186.259 -1.342 50 10 AAGE O[C@@H]1[C@H](O)O[C@H](CCl)[C@@H]1O 212044663 BFLITKCZBOUHRA-MGCNEYSASA-N 168.576 -1.336 50 10 AAGE COc1cc(CN)c(B(O)O)cn1 238402435 WNHNNQBIZPAFMQ-UHFFFAOYSA-N 181.988 -1.771 50 10 AAGE N#Cc1cc(C#N)c(B(O)O)cn1 238632008 BCXGIONTHUMHIC-UHFFFAOYSA-N 172.940 -1.495 50 10 AAGE O=NN(CC(=O)O)C(=O)CO 238685309 DATTUVPCDZAFQJ-UHFFFAOYSA-N 162.101 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2241468550 QFXIKWJGNYAZBM-YFKPBYRVSA-N 197.987 -2.666 50 10 AAGE N#CNC(=O)c1cscc1B(O)O 2241472509 SSMJIPLLCBIOTO-UHFFFAOYSA-N 195.996 -1.361 50 10 AAGE O=C(C#CB(O)O)N1CC=C[C@@H]1CF 2241479050 QNJUQCCWNZQSFM-SSDOTTSWSA-N 196.974 -1.262 50 10 AAGE CC(=O)NNC(=O)CSCCN 37035682 OJBUAGVZJFIREX-UHFFFAOYSA-N 191.256 -1.154 50 10 AAGE NNC(=O)Cn1ccn(C2CC2)c1=O 87667124 MEFVXGBVCYRGPB-UHFFFAOYSA-N 196.210 -1.025 50 10 AAGE COc1noc(OC)c1B(O)O 203581539 BAYKQWAGAJDCPO-UHFFFAOYSA-N 172.933 -1.628 50 10 AAGE O=C1Cc2ccc(B(O)O)cc2O1 238647550 NCHQKYWVQGVOBO-UHFFFAOYSA-N 177.952 -1.172 50 10 AAGE CNNC(=O)[C@H](N)[C@@H]1CCN(C)C1 259017182 IHCWDTPQHRJYOS-RNFRBKRXSA-N 186.259 -1.484 50 10 AAGE CN1CCC[C@@H]1C[N+]1=C=C(C=O)NN1 885687913 OPHIBUZWJIOYBP-SECBINFHSA-N 195.246 -1.132 50 10 AAGE N#CCC(=O)NNC(=O)c1cnn[nH]1 1627298179 DEUJOMQKHQPJOG-UHFFFAOYSA-N 194.154 -1.521 50 10 AAGE O=C(NCC#CB(O)O)c1ccc[nH]1 1895239183 LSNJQEBRUWJFGE-UHFFFAOYSA-N 191.983 -1.240 50 10 AAGE NNC(=O)CCn1cnnc1 1928828573 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XNMSOGUQGRIITP-RXMQYKEDSA-N 188.231 -1.957 50 10 AAGE CNNC(=O)[C@@H](N)CO 104654713 VTDPDAOAIIOCIT-VKHMYHEASA-N 133.151 -2.443 50 10 AAGE C[C@H](O)[C@]1(O)C=C[C@@](O)(C#N)[C@H]1O 261501554 HGQUNQCSXPPEAJ-LXGUWJNJSA-N 185.179 -1.716 50 10 AAGE Cc1ccnc(B(O)O)c1N 306738624 AMKVVVLEZKFHMS-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE C[C@H]1CCN1C(=O)C(=O)NN 606246816 MWMIGGPCHMQQTR-BYPYZUCNSA-N 157.173 -1.403 50 10 AAGE C=CCCS(=O)(=O)NCB(O)O 710144991 SOHMHOPIHOGJGR-UHFFFAOYSA-N 193.033 -1.506 50 10 AAGE CN(C)NC(=O)C1=C=NN2CCN[C-]12 885768125 JMNZYDMGOJYWBC-UHFFFAOYSA-N 194.218 -1.501 50 10 AAGE C=CC[C@@H](O)[C@H]1CCN1CC(=O)NN 1886738688 PHMNQUSCWHTZHC-HTQZYQBOSA-N 199.254 -1.012 50 10 AAGE NNC(=O)[C@H]1C[C@@H]1CN1CC(CO)C1 1929742322 WPAKXNMYEOCKGW-SFYZADRCSA-N 199.254 -1.464 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@]1(C)CO 1932968127 UHRWLHISLBUQJO-POYBYMJQSA-N 187.243 -1.179 50 10 AAGE NNC(=O)N1CCN(CCO)CC1 36231734 XQTKJTVTUWNTTE-UHFFFAOYSA-N 188.231 -1.820 50 10 AAGE CCN(CCO)[C@@H](C)C(=O)NN 82468807 XRQAGHMYAQUZCR-LURJTMIESA-N 175.232 -1.321 50 10 AAGE COC[C@@H](N)C(=O)NN 88004450 NIKRDIJQAWZRTE-GSVOUGTGSA-N 133.151 -2.050 50 10 AAGE OB(O)c1ccc(B(O)O)o1 238619760 RBLLWSXNPJXRSN-UHFFFAOYSA-N 155.711 -3.361 50 10 AAGE NC(=O)c1csc(B(O)O)c1 307063660 PRRIBRXDYAYJKI-UHFFFAOYSA-N 170.986 -1.473 50 10 AAGE Cn1ncnc1/C=C\B(O)O 388132567 VBUXIBBNRKPLQE-IHWYPQMZSA-N 152.950 -1.160 50 10 AAGE CO[C@]1(C(=O)NN)CCCNC1 575524490 CKGAKXSMJCQIGE-SSDOTTSWSA-N 173.216 -1.255 50 10 AAGE CC(=O)NCC(=O)NNC(N)=S 700852449 IHZOVSVHHYQQOR-UHFFFAOYSA-N 190.228 -2.013 50 10 AAGE Cc1cc(C(=O)NCB(O)O)no1 702032883 VKMAYCWYTNIQEZ-UHFFFAOYSA-N 183.960 -1.275 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@H]1[C@H]2CO 1884057332 MPZAACGGYPBCHM-VQVTYTSYSA-N 185.227 -1.711 50 10 AAGE C=CC[C@@H](O)[C@@H]1CCN1CC(=O)NN 1886738689 PHMNQUSCWHTZHC-JGVFFNPUSA-N 199.254 -1.012 50 10 AAGE Cc1cc(C(=O)NNCCO)n[nH]1 1929832693 WWVJTVXOOLSYDG-UHFFFAOYSA-N 184.199 -1.055 50 10 AAGE CC(=O)NNS(=O)(=O)[C@@H](C)C#N 1953750394 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PFNDQIGIGLDQAY-UHFFFAOYSA-N 185.147 -2.477 50 10 AAGE C[C@H](CO)CN(C)C(=O)C(=O)NN 688387309 LGQMKTMWCOFVDJ-YFKPBYRVSA-N 189.215 -1.937 50 10 AAGE Nc1c[nH]nc1B(O)O 1951329424 PNCQRDXIQUJMRS-UHFFFAOYSA-N 126.912 -2.328 50 10 AAGE CNC(=O)[C@@H](C)NC(=O)C#CB(O)O 2241468292 KXFDZWWWHNKMAR-RXMQYKEDSA-N 197.987 -2.748 50 10 AAGE C[C@H](O)C[C@H](C)NC(=O)C#CB(O)O 2241471213 HDMYFRYEYWJTBX-BQBZGAKWSA-N 199.015 -1.723 50 10 AAGE CO[C@H]1CC[C@@H]1NC(=O)C#CB(O)O 2241478423 FAGJCKIPEKKZMT-BQBZGAKWSA-N 196.999 -1.705 50 10 AAGE O=C(C#CB(O)O)NC1CCNCC1 2241478977 OWJDJUJEWIRRQX-UHFFFAOYSA-N 196.015 -2.130 50 10 AAGE N[C@@H]1C[C@@H]1NC(=O)[C@H]1C[C@H]1B(O)O 2241480144 DRUGYRWRARRHDM-KCDKBNATSA-N 184.004 -1.935 50 10 AAGE COC(=O)c1cn(C)c(B(O)O)n1 2241492558 CLDXXKKUIZTNTG-UHFFFAOYSA-N 183.960 -2.114 50 10 AAGE NC(=O)c1nccnc1B(O)O 2241502268 HRLDXAQOELPXKO-UHFFFAOYSA-N 166.933 -2.745 50 10 AAGE NNC(=O)C(=O)N[C@H]1C[C@H](Cl)C1 2241654068 QYVOSNFCPGNXQU-JPYJGEKTSA-N 191.618 -1.138 50 10 AAGE 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C[C@H](CN)Oc1ncc(B(O)O)cn1 2210061037 PPLJOVMSAFGHNK-RXMQYKEDSA-N 197.003 -2.118 50 10 AAGE CCNC(=O)c1occc1B(O)O 2241467751 ALJZSSUOEBDJRJ-UHFFFAOYSA-N 182.972 -1.291 50 10 AAGE NNC(=O)c1csc(B(O)O)c1 2241468254 KGAHZHRMQDQSBU-UHFFFAOYSA-N 186.001 -1.969 50 10 AAGE N[C@H]1CCN(C(=O)C2(B(O)O)CC2)C1 2241473086 CMIQCNJCLRRNLE-LURJTMIESA-N 198.031 -1.447 50 10 AAGE O=C(C#CB(O)O)N1CC[C@H]1CO 2241475927 IFHFGYMAAKWHON-LURJTMIESA-N 182.972 -2.405 50 10 AAGE CCCNC(=O)c1c[nH]nc1B(O)O 2241496789 WOIQPOXPHBXNRJ-UHFFFAOYSA-N 197.003 -1.771 50 10 AAGE NNC(=O)Nc1ccc(B(O)O)cc1 2241584019 HZBLBLZVSNTLGQ-UHFFFAOYSA-N 194.987 -1.638 50 10 AAGE NNC(=O)Cc1cc(=O)[nH]c(N)n1 72417272 KQBCLWRQNSYGBK-UHFFFAOYSA-N 183.171 -2.116 50 10 AAGE COC[C@@H](ON)C(=O)NN(C)C 710546279 VOJPFZVYFNYRLU-RXMQYKEDSA-N 177.204 -1.516 50 10 AAGE CN(C)NC(=O)[C@@H]1COCC[C@H]1N 1881914605 KHAOJIMWPWXZPO-RNFRBKRXSA-N 187.243 -1.057 50 10 AAGE CO[C@@H](C)C(=O)NCC=CB(O)O 1883503165 ZRLDRKQDDVMHJX-LURJTMIESA-N 187.004 -1.294 50 10 AAGE 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CCC(=O)NNC(=O)C(N)=O 164519140 SHMRJJODZZYUQD-UHFFFAOYSA-N 159.145 -1.971 50 10 AAGE OB(O)C1=NCCCO1 200988056 NSEDCBUTKQDYDT-UHFFFAOYSA-N 128.924 -1.183 50 10 AAGE Cc1nnc2ccc(B(O)O)cn12 209768036 FKLWIBNFXSLOBQ-UHFFFAOYSA-N 176.972 -1.282 50 10 AAGE NC(=O)NNC(=O)c1c[nH]ccc1=O 236181402 IVBOTHDEERAWCZ-UHFFFAOYSA-N 196.166 -1.312 50 10 AAGE NNC(=O)c1cnc(O)cn1 238562426 OYKNAJJMTQIVNA-UHFFFAOYSA-N 154.129 -1.214 50 10 AAGE N[C@H]1NC[C@H](Br)NC1=O 306328863 NXESRPNCRGFHCV-GBXIJSLDSA-N 194.032 -1.288 50 10 AAGE CC(C)C(=O)NNC(=O)C(N)=O 306446610 BMGIGNVPNYYXHF-UHFFFAOYSA-N 173.172 -1.725 50 10 AAGE N#CCS(=O)(=O)NCB(O)O 701932999 UIYSXJVYEBNXFQ-UHFFFAOYSA-N 177.978 -2.559 50 10 AAGE C[C@H](O)C1CN(CCC(=O)NN)C1 719809207 YMXAFGUPYVGBEI-LURJTMIESA-N 187.243 -1.321 50 10 AAGE C[C@H](O)[C@@H]1CCN1CC(=O)NN 1880869672 ZFWGWQPMBBGNRB-WDSKDSINSA-N 173.216 -1.569 50 10 AAGE NNC(=O)CN1CCOCCO1 1881446373 UBIAPYJEMLKKRO-UHFFFAOYSA-N 175.188 -1.760 50 10 AAGE CC1(F)CC(NC(=O)C(=O)NN)C1 1882664063 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AAGE CNNC(=O)CN1CCCC1=O 704605316 BWUGCEIMFCIEBJ-UHFFFAOYSA-N 171.200 -1.141 50 10 AAGE CON=CC(=O)NNC(=O)N(C)C 1542414862 DKLJVBURWYTWSX-UHFFFAOYSA-N 188.187 -1.079 50 10 AAGE NNC(=O)C(=O)N[C@H]1CC1(F)F 1880631017 VHMJGGBLTCBVGQ-REOHCLBHSA-N 179.126 -1.500 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@H]2C[C@H](O)[C@H]1C2 1884635098 PNAKZEPMSADYTR-OSMVPFSASA-N 199.254 -1.180 50 10 AAGE O=C(NCC=CB(O)O)c1ccon1 1892923822 KCQAMHKSDACDBO-UHFFFAOYSA-N 195.971 -1.027 50 10 AAGE CN(C)CC(=O)NNCCO 1929830016 DSUVYOSHANXHLS-UHFFFAOYSA-N 161.205 -1.839 50 10 AAGE NNC(=O)N[C@@H]1CC(=O)NC1=O 1932170722 IHVLWVGBJKEDJW-UWTATZPHSA-N 172.144 -2.426 50 10 AAGE CCN=c1cc(B(O)O)c(C)c[nH]1 2209386516 DXGNKWYVGSZNLO-UHFFFAOYSA-N 180.016 -1.076 50 10 AAGE N[C@H]1C[C@@H]1CNC(=O)C1(B(O)O)CC1 2241473815 QOUYFALERNQWET-RITPCOANSA-N 198.031 -1.543 50 10 AAGE C#CCNC(=O)c1ccc(B(O)O)o1 2241480786 LRPFJVMHWJAMPI-UHFFFAOYSA-N 192.967 -1.678 50 10 AAGE CN(C)C(=O)c1nn(C)cc1B(O)O 2241481544 TWLMVEJFCJBHOP-UHFFFAOYSA-N 197.003 -2.198 50 10 AAGE NNC(=O)C(=O)N(CCO)C1CC1 42481959 BCCAICCEMGPIIS-UHFFFAOYSA-N 187.199 -2.040 50 10 AAGE NNC(=O)c1cnc2ccnn2c1N 58836354 QEVVCYVCBUHEHJ-UHFFFAOYSA-N 192.182 -1.085 50 10 AAGE O=CC(C=O)=CNCC(=O)O 238608885 GHGPSSHIQQTLQZ-UHFFFAOYSA-N 157.125 -1.058 50 10 AAGE Cc1nc(N)c(CC(=O)NN)c(O)n1 306949041 UXAXRZMODMWWJH-UHFFFAOYSA-N 197.198 -1.395 50 10 AAGE OB(O)c1ccn(C[C@@H]2CCOC2)n1 694277302 SEKLKORVKZHKFR-ZETCQYMHSA-N 196.015 -1.401 50 10 AAGE Cc1ncnc(OCCF)c1B(O)O 1886033379 MIEQKIVLQWVEKO-UHFFFAOYSA-N 199.978 -1.187 50 10 AAGE C=C1CON(CC(=O)NNC(C)=O)C1 1892436816 WIQNKKYBULSCRI-UHFFFAOYSA-N 199.210 -1.043 50 10 AAGE C[C@H](CN(C)C)N(C)CC(=O)NN 1893429149 PMPGCTWNXJKLHP-SSDOTTSWSA-N 188.275 -1.142 50 10 AAGE C[C@H]1[C@H](O)CCN1CCC(=O)NN 1914255898 OZIBYCNQJAIPOP-NKWVEPMBSA-N 187.243 -1.179 50 10 AAGE CN1CCN=C1NN(C)C(N)=O 1923850237 GACVJEGSSAJVEH-UHFFFAOYSA-N 171.204 -1.197 50 10 AAGE NC[C@H](O)CCC(=O)NN 1953154836 STDDOPCWMCPJPG-SCSAIBSYSA-N 147.178 -1.924 50 10 AAGE NNC(=O)C(=O)N1CCO[C@H]2C[C@@H]21 1954050673 GTFKMPANVRYLNO-WHFBIAKZSA-N 185.183 -2.024 50 10 AAGE NNC(=O)c1cn(CC(=O)O)nn1 1954396994 WNMCKKMREBCIDI-UHFFFAOYSA-N 185.143 -2.034 50 10 AAGE COCC1(NC(=O)C#CB(O)O)CC1 2241476457 SOQNKTORPQPAMJ-UHFFFAOYSA-N 196.999 -1.703 50 10 AAGE CN[C@@H]1COC[C@H]1C(=O)NN(C)C 147238827 RTRJNXRTCIEDAM-RNFRBKRXSA-N 187.243 -1.186 50 10 AAGE NCc1ccc(B(O)O)o1 211338626 TYDMLQCIJISNAB-UHFFFAOYSA-N 140.935 -1.582 50 10 AAGE COc1cncc(OC)c1B(O)O 238347450 WMWQJXXAMOBRKN-UHFFFAOYSA-N 182.972 -1.221 50 10 AAGE NNC(=O)C(=O)N[C@H]1C[C@@H]2C[C@@H]2C1 306612059 MIMGFWFCZOTQGO-FPFOFBBKSA-N 183.211 -1.109 50 10 AAGE C#CCNC(=O)NNC(N)=O 307457068 FHDIXHNRXQCPBD-UHFFFAOYSA-N 156.145 -1.498 50 10 AAGE NNc1cc(B(O)O)ccc1C=O 307462128 BNVLZAGSNCFQSN-UHFFFAOYSA-N 179.972 -1.536 50 10 AAGE CC[N+]1=C=C([C@H](O)C#N)NN1 642834712 RBGMUDFGSLQAGI-ZCFIWIBFSA-N 153.165 -1.520 50 10 AAGE CCO[C@H]1CNC[C@H]1C(=O)NN 690069204 VXCXKBBHZIUKFL-RITPCOANSA-N 173.216 -1.399 50 10 AAGE NNC(=O)C(F)(F)CCO 1880017547 FXEPUTGVRDNCDR-UHFFFAOYSA-N 154.116 -1.006 50 10 AAGE N[C@H]1CS(=O)(=O)C[C@@H]1NC(=O)F 1881052500 BLXYVCWUPOSKEL-IMJSIDKUSA-N 196.203 -1.210 50 10 AAGE NNC(=O)N1C[C@H]2C[C@@]2(CO)C1 1881521132 IMOWECIYCBXLAS-VDTYLAMSSA-N 171.200 -1.116 50 10 AAGE C#CCN1CCN(CC(=O)NN)C1=O 1956773513 DKMCALQZQJDEON-UHFFFAOYSA-N 196.210 -1.653 50 10 AAGE C[C@H]1C[C@H]1Oc1ncc(B(O)O)cn1 1956954974 QWTHYNZWTUDFSK-CAHLUQPWSA-N 193.999 -1.056 50 10 AAGE CC(C)(CO)CNC(=O)C#CB(O)O 2241472679 WBOAOGCXDHKICM-UHFFFAOYSA-N 199.015 -1.864 50 10 AAGE CN(C(=O)C1(B(O)O)CC1)C1COC1 2241474021 VGNIMPIVGZPYOJ-UHFFFAOYSA-N 199.015 -1.149 50 10 AAGE NNC(=O)CN1CCC[C@H](CO)C1 70072997 AVQQBIIBPAZENI-ZETCQYMHSA-N 187.243 -1.319 50 10 AAGE CC[C@H](CN)C(=O)NN 83605695 HDJGJEMOSWTWLT-SCSAIBSYSA-N 131.179 -1.039 50 10 AAGE NNC(=O)C1=NNC(=O)C1 100252558 RRSLTOPLODYUFD-UHFFFAOYSA-N 142.118 -2.148 50 10 AAGE O=C[C@H]1NC(=O)OC1=O 104709916 NOUSLRPODKOLKT-UWTATZPHSA-N 129.071 -1.180 50 10 AAGE OB(O)c1cnc(-n2cccn2)cn1 198083060 KASNPNASKPWOPW-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE O=C(CO)c1ccc(B(O)O)cc1 203998797 QMVZPUFRUBMACK-UHFFFAOYSA-N 179.968 -1.459 50 10 AAGE CC(=O)c1c(O)cncc1B(O)O 206093558 JRSOCVONGMPXAS-UHFFFAOYSA-N 180.956 -1.330 50 10 AAGE NNC(=O)[C@@H](N)C1CCOCC1 259006037 NNTQJCVWIXWUAY-LURJTMIESA-N 173.216 -1.270 50 10 AAGE N#C[C@@H](O)[C@H]1NC(=O)CNC1=O 260720939 JATAXIPSPLTZCL-NQXXGFSBSA-N 169.140 -2.515 50 10 AAGE C[C@H](O)[C@H](O)[C@H](O)[C@@H](O)C(=O)F 308010730 PDNVQOUXEOAXBR-NEEWWZBLSA-N 182.147 -2.054 50 10 AAGE C[C@@H]1CN(CC(=O)NN)C(=O)O1 606252037 HARKVSVOZMBKHK-SCSAIBSYSA-N 173.172 -1.183 50 10 AAGE Cn1cc(B(O)O)c(C2CC2)n1 716784787 VEJAUZWCUGXCLU-UHFFFAOYSA-N 165.989 -1.023 50 10 AAGE O=C(CCO)NCB(O)O 1880072702 ZFZVKINYAJXQEW-UHFFFAOYSA-N 146.939 -2.503 50 10 AAGE NNC(=O)N1C[C@@H]2C(C(N)=O)[C@H]2C1 1883971749 WZUZBQWRYYZYJC-IMJSIDKUSA-N 184.199 -1.767 50 10 AAGE Cn1cncc1C(=O)NNCCO 1929832839 ZMSLPDDZKGVOHM-UHFFFAOYSA-N 184.199 -1.353 50 10 AAGE OB(O)c1cc(-n2cccn2)ncn1 1955188747 JOPHNTGMCVBRRM-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE O=C(C#CB(O)O)N[C@H]1[C@@H]2CNC[C@@H]21 2241479101 RJCYAIFTGXVESM-BDINMYNLSA-N 193.999 -2.664 50 10 AAGE NNC(=O)COCC(N)=O 58845072 IBJQNXQBSQNDBR-UHFFFAOYSA-N 147.134 -2.522 50 10 AAGE O=C(OC(=O)[C@H]1CCN1)[C@H]1CCN1 59498766 QMTVBCYYNGSIPT-PHDIDXHHSA-N 184.195 -1.220 50 10 AAGE C[C@@H]1C(=O)NCCN1CC(=O)NN 82478292 CXLQBNBRRHYKRC-RXMQYKEDSA-N 186.215 -2.203 50 10 AAGE NNC(=O)C[C@H]1CCNC1 84383741 YWAKQUUFZHUGAQ-RXMQYKEDSA-N 143.190 -1.024 50 10 AAGE NNC(=O)C(=O)NCC(F)F 148012996 GXUZLQDZVUQITP-UHFFFAOYSA-N 167.115 -1.642 50 10 AAGE C=CC(=O)Nc1ccnc(B(O)O)c1 223388318 ZIBVSZILSWOFHA-UHFFFAOYSA-N 191.983 -1.114 50 10 AAGE NNc1cccc(B(O)O)c1CO 307526295 HVBLEXRQBDFUPU-UHFFFAOYSA-N 181.988 -1.856 50 10 AAGE C#CCCC(=O)NCB(O)O 706479611 SRJAIRMONZAATR-UHFFFAOYSA-N 154.962 -1.472 50 10 AAGE N[C@]1(B(O)O)CCO[C@@]12CCOC2 885503647 DMNHAQGJSDSUGI-RNFRBKRXSA-N 187.004 -1.725 50 10 AAGE C[C@H]1C[C@]1(F)C(=O)NCB(O)O 1881630554 UVFKXPLHEQROJM-UJURSFKZSA-N 174.968 -1.137 50 10 AAGE CC(=O)NNC(=O)Cn1cc(N)cn1 1888929569 LFRHUXDEHMSVMM-UHFFFAOYSA-N 197.198 -1.367 50 10 AAGE COCC1CN([C@H](C)C(=O)NN)C1 1916277054 XIDKABYBPJHQRW-ZCFIWIBFSA-N 187.243 -1.057 50 10 AAGE NC1(B(O)O)C[C@H]2COC[C@@H]2C1 1934819160 CEXOZXBNTSHXNG-WDSKDSINSA-N 171.005 -1.248 50 10 AAGE CCNC(=O)C1(NC(=O)NN)CC1 1954430411 OQRGUYKFRRARMZ-UHFFFAOYSA-N 186.215 -1.172 50 10 AAGE C[C@@H](CN)NC(=O)[C@H]1C[C@@H]1B(O)O 2241495340 ITPNKMRNKVVMAG-ZLUOBGJFSA-N 186.020 -1.687 50 10 AAGE N[C@H](C(=O)O)[C@H](O)CCl 5131962 CETUIFTXYGHITB-GBXIJSLDSA-N 153.565 -1.002 50 10 AAGE in-vitro CNc1cc(B(O)O)ccc1N 204734506 CXDMRRXCOWALIM-UHFFFAOYSA-N 165.989 -1.010 50 10 AAGE Nc1cccc(B(O)O)c1O 204762111 VILXZFWSDBLPIA-UHFFFAOYSA-N 152.946 -1.346 50 10 AAGE [C-]#[N+]C1=C[C@](O)([C@H](C)O)[C@@H](O)[C@H]1O 205087106 IGGOWFZBVPRSMG-PSQAKQOGSA-N 185.179 -1.363 50 10 AAGE CC(C=NNC(N)=O)=NN=C(N)N 256067811 PPPYNDYQYGMMBT-UHFFFAOYSA-N 185.191 -1.710 50 10 AAGE O=C(CO)NNC(=O)[C@@H]1CCO1 306236642 FBZHKCTWWCPFCO-BYPYZUCNSA-N 174.156 -2.085 50 10 AAGE N#C[C@H](O)[C@H](O)[C@H](O)CO 306269706 SWNJRURQYJZVFL-LMVFSUKVSA-N 147.130 -2.415 50 10 AAGE O=C(NCB(O)O)[C@@H]1CCCOC1 702027921 AAGQFPSZQYSXEU-ZCFIWIBFSA-N 187.004 -1.459 50 10 AAGE CCN(C(=O)C(=O)NN)C1COC1 1915651724 WQYCHLQLMRNRKM-UHFFFAOYSA-N 187.199 -1.776 50 10 AAGE CCN(O)C(=O)c1ccoc1B(O)O 2241481433 SMLRBIPPOUYTAY-UHFFFAOYSA-N 198.971 -1.189 50 10 AAGE CNC(=O)CCNC(=O)NN 45014870 YQVUGJVWBIOVJM-UHFFFAOYSA-N 160.177 -1.705 50 10 AAGE CC(=O)NNCCS(=O)(=O)O 71621555 IYYBXKYCCZFNEE-UHFFFAOYSA-N 182.201 -1.485 50 10 AAGE OC1[C@H](O)[C@H](O)C(Cl)[C@@H](O)[C@H]1O 108474187 BSMLUJHFZGTHOG-LMEIFLMCSA-N 198.602 -2.588 50 10 AAGE CN(C)NC(=O)[C@H]1C[C@@H](O)CN1 147293404 AFHZREBOVGZUJO-PHDIDXHHSA-N 173.216 -1.698 50 10 AAGE N#Cc1nc(O)ccc1B(O)O 238624515 OTPABRAAZUAATL-UHFFFAOYSA-N 163.929 -1.661 50 10 AAGE O=C1C[C@@H](c2ccc(B(O)O)cc2)N1 306756884 MVALJYDGKWNWTR-QMMMGPOBSA-N 190.995 -1.073 50 10 AAGE Cc1ccnnc1B(O)O 1880068176 MNKWDWOASSHFCK-UHFFFAOYSA-N 137.935 -1.535 50 10 AAGE CC(C)[S@@](=O)NCC#CB(O)O 1881440394 PAVCAFAVDKGISA-GFCCVEGCSA-N 189.045 -1.337 50 10 AAGE NNC(=O)N[C@@H]1CC(=O)N2CCC[C@H]12 1887642756 URNRONYUWKWYOK-PHDIDXHHSA-N 198.226 -1.077 50 10 AAGE NNC(=O)CN1C[C@@H](O)CCC1=O 1914265837 BACMSWMIRHIZIZ-YFKPBYRVSA-N 187.199 -2.040 50 10 AAGE Cn1cc(C(=O)NN)c(CO)n1 1953670757 KYTWKHDXBYYPFS-UHFFFAOYSA-N 170.172 -1.484 50 10 AAGE NCCOc1ncccc1B(O)O 2209388522 WQVRGEYBTIPJQE-UHFFFAOYSA-N 181.988 -1.901 50 10 AAGE NC[C@@H]1CC[C@H](C(=O)NN)CO1 2241251555 ZWQQECXEYHOOGP-WDSKDSINSA-N 173.216 -1.270 50 10 AAGE O=C(C#CB(O)O)N[C@H]1CC[C@@H]1CO 2241468130 HYCCEDYFKCWGND-RQJHMYQMSA-N 196.999 -2.111 50 10 AAGE O=C(C#CB(O)O)NC1CC(O)C1 2241479270 VEKNPXBOAVSZJZ-UHFFFAOYSA-N 182.972 -2.359 50 10 AAGE CN1CC[C@@H](C(=O)NN)C1 37758660 WDWQQBSTYTYPBA-RXMQYKEDSA-N 143.190 -1.072 50 10 AAGE OC[C@H]1O[C@@H](O)[C@H](O)[C@H](Cl)[C@@H]1O 101185571 CRJLKIILIKSPDH-QZABAPFNSA-N 198.602 -1.975 50 10 AAGE O=C1O[C@@H]([C@H](O)CCl)C(=O)C1=O 210177985 MWGHCIMLVHHKJH-MVHIGOERSA-N 192.554 -1.350 50 10 AAGE CN(CCCO)C(=O)C(=O)NN 300747745 DNAVVSNXGUPDOJ-UHFFFAOYSA-N 175.188 -2.183 50 10 AAGE CONC(=O)NNC(N)=O 306342542 MIDPHPHKZLBYMR-UHFFFAOYSA-N 148.122 -1.570 50 10 AAGE Cn1cc2c(B(O)O)ccnc2n1 307640826 HSEOZIPFSHFNIN-UHFFFAOYSA-N 176.972 -1.352 50 10 AAGE CC(=O)N[C@H](C)C(=O)NNC(N)=O 706020264 WROZNMDPBMZVPQ-GSVOUGTGSA-N 188.187 -1.790 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@@H](O)C[C@H]1C2 710474322 DMQYWMSPZDDJLC-BWZBUEFSSA-N 199.254 -1.179 50 10 AAGE CN(NC(=O)[C@@H]1[C@H]2COC[C@H]21)C(N)=O 831519043 JREFVBYXEIVCKI-FMCRUOTFSA-N 199.210 -1.080 50 10 AAGE CN(CC(=O)NN)C[C@H]1CCN1C 1882693265 CWCARLBNDYVGQR-SSDOTTSWSA-N 186.259 -1.388 50 10 AAGE C[C@@H](C(=O)NN)N1CC([N+](=O)[O-])C1 1883146974 QHRALOYJYILZFE-BYPYZUCNSA-N 188.187 -1.674 50 10 AAGE CO[C@H]1C[C@@H]1C(=O)NCC=CB(O)O 1892925472 UZURDDUKCMPZNC-BQBZGAKWSA-N 199.015 -1.294 50 10 AAGE CNNC(=O)CCn1cnnn1 1928828603 LXHHRWAXVDYHBJ-UHFFFAOYSA-N 170.176 -1.686 50 10 AAGE CNNC(=O)[C@H]1CCS1(=O)=O 1930853743 RETHUJUCNGSBKA-SCSAIBSYSA-N 178.213 -1.576 50 10 AAGE C[C@H](CS(N)(=O)=O)NC(=O)NN 1932515650 VUMZPSQJTBSJKC-GSVOUGTGSA-N 196.232 -2.164 50 10 AAGE NNC(=O)NCc1nccc(O)n1 1954689666 YUEFWEALBGWTGF-UHFFFAOYSA-N 183.171 -1.145 50 10 AAGE Cn1nc(Cl)c(B(O)O)n1 2208928378 IVNNZXOQELHFCK-UHFFFAOYSA-N 161.357 -1.852 50 10 AAGE C[C@H]1CN(C(=O)C#CB(O)O)CCO1 2241478382 DDTQKZWHYAGIDS-ZETCQYMHSA-N 196.999 -1.751 50 10 AAGE NNC(=O)C[C@]1(O)CN2CCC1CC2 21987021 OWBLJTBJSMEPJZ-VIFPVBQESA-N 199.254 -1.177 50 10 AAGE C[C@H](O)CNC[C@H](C)C(=O)NN 58837086 YUUJZTVUSKTORE-WDSKDSINSA-N 175.232 -1.417 50 10 AAGE CN(C)CCNNC(N)=O 104591926 AHAMDCHRUKAGDP-UHFFFAOYSA-N 146.194 -1.279 50 10 AAGE N#CC1=C[C@@H](O)[C@H](O)[C@@H](CO)O1 211484042 XEFNLUVAZWYCPL-QYNIQEEDSA-N 171.152 -1.493 50 10 AAGE CNC(=O)[C@H](C)CN(C)C(=O)NN 234366918 INDBQLNQZBIWNY-RXMQYKEDSA-N 188.231 -1.116 50 10 AAGE 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CN(C)NC(=O)[C@@H]1CO[C@H]2CNC[C@H]12 1955556423 LWTBLUCNYDYZPJ-PRJMDXOYSA-N 199.254 -1.186 50 10 AAGE C[C@H](CN)Oc1cc(B(O)O)ccn1 2210059753 CNMGOZCPEKZDSA-ZCFIWIBFSA-N 196.015 -1.513 50 10 AAGE CC1(C)CN(C(=O)C#CB(O)O)C1 2241467916 DDNBQVIVKKXOHZ-UHFFFAOYSA-N 181.000 -1.130 50 10 AAGE COCC(C)(C)NC(=O)C#CB(O)O 2241471162 GUUIHYIKUCKUNQ-UHFFFAOYSA-N 199.015 -1.457 50 10 AAGE C[C@H](NC(=O)C#CB(O)O)C(C)(C)N 2241478349 COAGOHSJBRXDDJ-LURJTMIESA-N 198.031 -1.756 50 10 AAGE CC(C)NC(=O)c1cc(B(O)O)n[nH]1 2241481988 YJNXFLASDAWSLR-UHFFFAOYSA-N 197.003 -1.772 50 10 AAGE N#CNCc1cc(B(O)O)cs1 2241555988 SFWLOFCIPSQDIW-UHFFFAOYSA-N 182.013 -1.001 50 10 AAGE N#CC1=C(C(N)=O)NCCN1 39064794 HDJUOVSPNFLKTQ-UHFFFAOYSA-N 152.157 -1.600 50 10 AAGE CS(=O)(=O)CC(=O)NNC(N)=O 70044680 DTEKUKVXBBROBS-UHFFFAOYSA-N 195.200 -2.270 50 10 AAGE NC(=S)NNC(=O)c1cn[nH]c1 83590934 CVZDPVXXCSYNFQ-UHFFFAOYSA-N 185.212 -1.112 50 10 AAGE OC[C@@H](O)COOC[C@H](O)CO 112972785 CGORWLLFUJDORA-PHDIDXHHSA-N 182.172 -2.359 50 10 AAGE CC(=O)NNC(=O)C1(C(N)=O)CC1 307617503 RTBBSAVGVKAKOX-UHFFFAOYSA-N 185.183 -1.581 50 10 AAGE O=C(NN[C@@H]1CCNC1=O)C1CC1 307706414 ZSHIBOLQBAPHJI-ZCFIWIBFSA-N 183.211 -1.094 50 10 AAGE CNC(=O)CC(=O)NN(C)C(N)=O 388920676 ROYGLOHGIZUQIS-UHFFFAOYSA-N 188.187 -1.836 50 10 AAGE NNC(=O)N1C[C@@H](O)C[C@H](O)C1 1880965830 CVKKGMXEYNSYMG-WHFBIAKZSA-N 175.188 -2.003 50 10 AAGE O=C1C[C@@H](C(=O)NNCCO)CN1 1929831748 HPHOVOHNQREWGU-RXMQYKEDSA-N 187.199 -2.264 50 10 AAGE NNC(=O)[C@H]1CCNC[C@H]1F 1953298324 ICRCGRJHNWRRTN-CRCLSJGQSA-N 161.180 -1.076 50 10 AAGE OB(O)c1cnccc1-n1ccnc1 1956965175 JOFOIDLQKUZDKU-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE N[C@@H]1[C@H]2C[C@H]1N(C(=O)C#CB(O)O)C2 2241468276 KPYDNTWSUGBOIG-SHYZEUOFSA-N 193.999 -2.440 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1CNC(=O)C1 2241468405 NOJSTGSFTGPXST-YFKPBYRVSA-N 195.971 -2.994 50 10 AAGE C[C@]1(F)CCN(C(=O)C#CB(O)O)C1 2241468834 VPDYWMYGYHYSDN-QMMMGPOBSA-N 198.990 -1.038 50 10 AAGE O=C(N[C@@H]1CCNC1)[C@@H]1C[C@@H]1B(O)O 2241496516 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LGYDRNPATKLWIB-ZCFIWIBFSA-N 185.227 -1.425 50 10 AAGE OB(O)c1ccnc(N2CCCC2)n1 1885688147 VYZAMSWIVPQBRV-UHFFFAOYSA-N 193.015 -1.243 50 10 AAGE CN(C)NC(=O)[C@H]1C[C@@H]1N 1953191583 DRJUUFXXWUBVKP-WHFBIAKZSA-N 143.190 -1.074 50 10 AAGE C#CCN(C)c1cc(B(O)O)ccn1 2210061670 XHHSVOYYSRNIOD-UHFFFAOYSA-N 190.011 -1.169 50 10 AAGE O=C(NCCO)[C@H]1C[C@@H]1B(O)O 2241495284 IAPMPRNQYMZRDA-WHFBIAKZSA-N 172.977 -2.042 50 10 AAGE COCCNC(=O)[C@H]1C[C@@H]1B(O)O 2241496471 SVISREIMMJZPKU-WDSKDSINSA-N 187.004 -1.388 50 10 AAGE O=C(N[C@@H]1CCNC1)[C@H]1C[C@@H]1B(O)O 2241496517 UESJJDILQWLRKN-VQVTYTSYSA-N 198.031 -1.673 50 10 AAGE NNC(=O)C(=O)N1CC[C@H](O)C1 61713357 IULFXFOJKHHRIG-BYPYZUCNSA-N 173.172 -2.431 50 10 AAGE Nc1ccc(CO)cc1B(O)O 204746939 NFKZZMYQAWSTOA-UHFFFAOYSA-N 166.973 -1.559 50 10 AAGE C[C@H](C(=O)NN)[C@H](O)C(=O)NN 238434360 VWUUBBVNWAWOJK-HRFVKAFMSA-N 176.176 -3.037 50 10 AAGE N=C(N)N1NC(N)=NC=C1C=O 238613933 KUCDPNMFRAKSKY-UHFFFAOYSA-N 168.160 -1.945 50 10 AAGE CO[C@H]1C[C@H](CO)N(C(=O)NN)C1 306484545 GDHCFYPDKIZNMC-RITPCOANSA-N 189.215 -1.349 50 10 AAGE NC(=O)C(=O)NN=Cc1ncc[nH]1 308376808 OGXOKOVGQJATMK-UHFFFAOYSA-N 181.155 -1.655 50 10 AAGE CC(=O)C(=NO)C(=O)NN 383827952 XAEKGYISSCGIGK-UHFFFAOYSA-N 145.118 -1.605 50 10 AAGE O=S(=O)(NCB(O)O)C1CC1 701970852 JFMYHXXWEZBFHF-UHFFFAOYSA-N 179.006 -1.920 50 10 AAGE N#C[C@@H](O)[C@H](N)c1cc(O)nc(O)n1 1952956826 PLXXKHCLHKDAAB-INEUFUBQSA-N 196.166 -1.228 50 10 AAGE O=C(NO)c1ccc(B(O)O)c(F)c1 2241584480 OMBKTAWXROHWHK-UHFFFAOYSA-N 198.946 -1.376 50 10 AAGE CN(C)NC(=O)[C@]12CCO[C@@H]1CNC2 2242595575 BNRMMIPBUFRYCF-APPZFPTMSA-N 199.254 -1.042 50 10 AAGE CN(C)C(=O)NNC=O 78211103 NVSYNGMODMVSHZ-UHFFFAOYSA-N 131.135 -1.081 50 10 AAGE NNC(=O)Cn1ccc(=O)cc1 84691056 CGCNFBLONNHEBN-UHFFFAOYSA-N 167.168 -1.162 50 10 AAGE Cc1ccc(O)c(B(O)O)n1 306886528 PMWUPHDMNSIIFA-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE C[C@H](C(=O)NN)N1CC(O)C1 307258478 FSQAHHWULLRNSM-SCSAIBSYSA-N 159.189 -1.959 50 10 AAGE NNC(=O)C(=O)N1CC[C@@H](CF)C1 711429607 HQNVDSITKSPWIZ-YFKPBYRVSA-N 189.190 -1.206 50 10 AAGE N#C[C@@H](O)C1=C=[N+](CCO)NN1 885296752 CMSKKJYESACVCK-ZCFIWIBFSA-N 169.164 -2.548 50 10 AAGE C#CC(=O)NNC(=O)c1ncon1 1639099490 TUKJMAUGDQLBDG-UHFFFAOYSA-N 180.123 -1.536 50 10 AAGE CP(C)(=O)CNC(=O)C(=O)NN 1881404263 ULWHLCPIVLMXIF-UHFFFAOYSA-N 193.143 -1.327 50 10 AAGE NNC(=O)CN1C[C@H]2C[C@]2(CO)C1 1883943320 RXCBDFBHVKDRQQ-HTRCEHHLSA-N 185.227 -1.710 50 10 AAGE NNC(=O)CCN1C[C@@H]2[C@@H](CO)[C@@H]2C1 1885716241 SZBUEYRJJZPIAC-JIGDXULJSA-N 199.254 -1.464 50 10 AAGE N[C@@H]1C[C@@H]1Nc1ncccc1B(O)O 2210067791 FRZCZQCMUOXUSU-RQJHMYQMSA-N 193.015 -1.727 50 10 AAGE CC1(C)C[C@@H]1NC(=O)C#CB(O)O 2241476059 KUBFRJFLYLTETE-LURJTMIESA-N 181.000 -1.084 50 10 AAGE CC(C)(NC(=O)C#CB(O)O)C(N)=O 2241478461 FUJFJNLVDFULRX-UHFFFAOYSA-N 197.987 -2.618 50 10 AAGE NNC(=O)[C@@H]1CC[C@H]2CNC[C@H]2O1 2242190760 ZFKNTSQPYPNLCP-LYFYHCNISA-N 185.227 -1.257 50 10 AAGE O[C@H]1O[C@H](CCl)[C@@H](O)[C@H](O)[C@@H]1O 15657744 QMWDIHPSUCUMFU-PQMKYFCFSA-N 198.602 -1.975 50 10 AAGE in-vitro NNC(=O)c1cc(=O)c(O)c[nH]1 34243910 KIDVXDFSLNXGEA-UHFFFAOYSA-N 169.140 -1.316 50 10 AAGE NNC(=O)N1CC(=O)NC(=O)C1 85086609 WXEUDLXLYIZCBD-UHFFFAOYSA-N 172.144 -2.472 50 10 AAGE COC(=O)c1cc(B(O)O)c(F)cn1 224280821 KPBVQHCMNVCFCH-UHFFFAOYSA-N 198.946 -1.313 50 10 AAGE C[C@H](C#N)/C(=N/N)C(=O)NN 306668188 KAUZOVNEBBPILK-SHWSUELLSA-N 155.161 -1.549 50 10 AAGE NNc1ncccc1B(O)O 307292898 CYPDAPMYRAGLCX-UHFFFAOYSA-N 152.950 -1.953 50 10 AAGE NC(=O)NN=C/C=C\NCC(=O)O 379333661 KECSEDOVKINKPT-BVSSSWPKSA-N 186.171 -1.172 50 10 AAGE Cn1ccc(CC(=O)NNC(N)=O)n1 694861769 WMAWNNXJOPKDKX-UHFFFAOYSA-N 197.198 -1.338 50 10 AAGE C[C@@H](N)[C@@H](O)C(=O)NN(C)C 1880157477 RJBKNOSFEIMAGH-RFZPGFLSSA-N 161.205 -1.713 50 10 AAGE CS(=O)(=O)NCC=CB(O)O 1880424252 KZCLQGYQMCMAHC-UHFFFAOYSA-N 179.006 -1.896 50 10 AAGE NNC(=O)C(=O)N1CC=C[C@H]1CO 1881713698 FNPOXEJXFZMBMF-YFKPBYRVSA-N 185.183 -2.264 50 10 AAGE NNC(=O)CN1CC=CC[C@@H]1CO 1881716429 UEYHFSVYHXJMQL-SSDOTTSWSA-N 185.227 -1.401 50 10 AAGE CN(CCC(=O)NN)C1COC1 1915650901 QHCIOVQCVHTDJJ-UHFFFAOYSA-N 173.216 -1.303 50 10 AAGE CCN(C)NC(=O)[C@@H]1CN=CN1 1923512392 SPEZQQXIBAWTHV-LURJTMIESA-N 170.216 -1.031 50 10 AAGE NNC(=O)C1(n2ccnn2)CC1 1923838792 OJMXIAZUUBQXAK-UHFFFAOYSA-N 167.172 -1.243 50 10 AAGE NNC(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1O2 1935285086 URLCYCYCPADVKM-KVQBGUIXSA-N 199.210 -1.588 50 10 AAGE NNC(=O)CN1C[C@@H]2CC[C@@H]2C1=O 1935426117 FWOFEVWMHDJPNI-WDSKDSINSA-N 183.211 -1.155 50 10 AAGE NNC(=O)CN1CCC2(CC(O)C2)C1 1957157940 RVDDWJLDRRHFDU-UHFFFAOYSA-N 199.254 -1.177 50 10 AAGE CC(CO)(CO)C(=O)NCB(O)O 2241246686 RFUKJJGATSHLOP-UHFFFAOYSA-N 190.992 -2.895 50 10 AAGE CN(C)C(=O)c1ccncc1B(O)O 2241472125 PFRBEGYCJBOXCW-UHFFFAOYSA-N 193.999 -1.537 50 10 AAGE COC(=O)c1c(B(O)O)c(C)nn1C 2241492936 HNEIIFHITNMMKP-UHFFFAOYSA-N 197.987 -1.805 50 10 AAGE NNC(=O)[C@@H]1C[C@H]2NCC[C@H]21 2241863062 URSUXRNBDAMLRZ-KVQBGUIXSA-N 155.201 -1.026 50 10 AAGE CC(=O)NCCNC(=O)C(=O)NN 36746652 WGQZYWBEBVNNQQ-UHFFFAOYSA-N 188.187 -2.771 50 10 AAGE C[C@@H](C(=O)NN)n1ccc(C(N)=O)n1 70327573 UTGDGXGTJBVVJV-BYPYZUCNSA-N 197.198 -1.467 50 10 AAGE N[C@H](CO)Cc1ccc(B(O)O)cc1 195953356 PXLCSHVXTZAPBB-VIFPVBQESA-N 195.027 -1.772 50 10 AAGE NCC(=O)Nc1cccc(B(O)O)c1 201430629 HWTKKJSSVUXZCN-UHFFFAOYSA-N 193.999 -1.736 50 10 AAGE CC(=O)NC(=O)[C@@](O)(C#N)NO 238067493 CHGRQLPQMFSWIY-YFKPBYRVSA-N 173.128 -2.160 50 10 AAGE C[C@H](CC(=O)NN)SCC(N)=O 300794700 ZOCVUAFZNXPMNW-SCSAIBSYSA-N 191.256 -1.027 50 10 AAGE CC(=O)NCCCC(=O)NN 307541327 AWEPFMMEXBVEOH-UHFFFAOYSA-N 159.189 -1.107 50 10 AAGE NC(=O)NN=C[C@H](N)CO 307848051 WWSPMOAJFMYVOQ-VKHMYHEASA-N 146.150 -2.040 50 10 AAGE COCC(=O)NN[C@H]1CCOC1=O 308425466 QVYQBODSZVHJHA-YFKPBYRVSA-N 188.183 -1.431 50 10 AAGE CC(=O)NCCC(=O)NNC(C)=O 388654482 STKYHEMYVVGSAC-UHFFFAOYSA-N 187.199 -1.320 50 10 AAGE NNC(=O)C[C@@H](N)C(F)F 724712617 OWMBCDIKMIOVHW-UWTATZPHSA-N 153.132 -1.041 50 10 AAGE C[C@@H]1OCCO[C@H]1C(=O)NN 885265890 PHOWUTRJXPVRQC-CRCLSJGQSA-N 160.173 -1.220 50 10 AAGE O=C(NCC=CB(O)O)c1cnco1 1892923587 HMTCFJHINRTWBF-UHFFFAOYSA-N 195.971 -1.027 50 10 AAGE O=C(NCB(O)O)N1CC[C@@H](O)C1 1914097972 OILOIVAGGVESGN-RXMQYKEDSA-N 187.992 -2.225 50 10 AAGE NNC(=O)[C@@H]1C[C@H]1CN1CCC1=O 1928994031 KWTJMDUDACXKJR-NTSWFWBYSA-N 183.211 -1.155 50 10 AAGE N#C[C@H](O)[C@@H](N)c1cc(O)nc(O)n1 1952956827 PLXXKHCLHKDAAB-NJGYIYPDSA-N 196.166 -1.228 50 10 AAGE NNC(=O)N1C[C@H]2C[C@H]1[C@H](O)[C@H]2O 1954501751 CHQUSKOSLYVITN-VANKVMQKSA-N 187.199 -2.004 50 10 AAGE CCn1cnnc1B(O)O 2208933648 MKCUSSWSVDMLQH-UHFFFAOYSA-N 140.939 -2.022 50 10 AAGE C[C@H]1CC[C@H]1NC(=O)C#CB(O)O 2241475766 FBPMHISCULMIQD-NKWVEPMBSA-N 181.000 -1.084 50 10 AAGE NC[C@@H]1C[C@H]1NC(=O)C#CB(O)O 2241479488 ZBZWBNMEGDTTRD-NTSWFWBYSA-N 181.988 -2.535 50 10 AAGE NNC(=O)CN1CC[C@H]1[C@H](O)CO 2241811048 LIQABIIXZYTYDL-NTSWFWBYSA-N 189.215 -2.596 50 10 AAGE N[C@H]1CC[C@@H]1CNC(=O)C#CB(O)O 2241972888 QOHJCKRJHMGMBC-RQJHMYQMSA-N 196.015 -2.145 50 10 AAGE CC(C)NC(=O)COCC(=O)NN 58856387 AVZPISWIZVKEHM-UHFFFAOYSA-N 189.215 -1.483 50 10 AAGE O=C(O)[C@@H](O)[C@@](O)(OO)C(=O)O 103835827 DONFFNSWBSKBRF-HWCWNYAQSA-N 182.084 -2.305 50 10 AAGE CN(C)NC(=O)[C@@H](N)CCC(=O)O 147264314 SJBKDHMAPQJJPT-YFKPBYRVSA-N 189.215 -1.229 50 10 AAGE NCCNc1cccc(B(O)O)c1 209834180 SHXRXYDEWGFKKX-UHFFFAOYSA-N 180.016 -1.263 50 10 AAGE O=C(O)c1ccc(B(O)O)cc1O 238621532 BYHPEMWCVMIKTK-UHFFFAOYSA-N 181.940 -1.230 50 10 AAGE N#Cc1cccn(CC(=O)NN)c1=O 306567539 SNJXTYBTFQBVAV-UHFFFAOYSA-N 192.178 -1.290 50 10 AAGE C[C@H]1C[C@H]1C(=O)NCC(=O)NN 306631745 OCRDTJRNEVCZNF-CRCLSJGQSA-N 171.200 -1.252 50 10 AAGE O=[N+]([O-])c1c(O)cccc1B(O)O 306921023 OWCZDXRYPHSNEL-UHFFFAOYSA-N 182.928 -1.020 50 10 AAGE C[C@@H]1C[C@H]1C(=O)NCB(O)O 575452333 WYWIAAUQGKFUOJ-RFZPGFLSSA-N 156.978 -1.229 50 10 AAGE NNC(=O)[C@@H]1Cn2cnnc2CN1 575533100 DGDQQVGPXGRABE-BYPYZUCNSA-N 182.187 -2.260 50 10 AAGE CN1CCN(C(=O)NN)CCC1=O 606259346 AIGGRRKWCUCEHO-UHFFFAOYSA-N 186.215 -1.266 50 10 AAGE O=C(NCB(O)O)c1cncc(F)c1 702018222 RQUQPNWKWVYFBA-UHFFFAOYSA-N 197.962 -1.038 50 10 AAGE Cn1cccc1C(=O)NCB(O)O 702030667 QEAAIXGWQUPDHJ-UHFFFAOYSA-N 181.988 -1.233 50 10 AAGE NNC(=O)[C@@H]1C[C@H]1C(=O)O 849364942 SYHHRAFVDOTRIK-PWNYCUMCSA-N 144.130 -1.303 50 10 AAGE NNC(=O)N1C[C@@H]2C[C@H]2[C@@H]1CO 1881459337 HKJULZFSKFSUQO-JKUQZMGJSA-N 171.200 -1.118 50 10 AAGE C[C@H]1CNC[C@@H](C(=O)NN)O1 1923923218 XNPVZEJRQHJADN-WHFBIAKZSA-N 159.189 -1.647 50 10 AAGE NNC(=O)C(=O)NCCc1ccon1 1928855004 PVHNOSNGOMAMQJ-UHFFFAOYSA-N 198.182 -1.677 50 10 AAGE COC[C@](C)(N)CC(=O)NN 1953233947 WZJNCFWOKBLOEN-ZCFIWIBFSA-N 161.205 -1.270 50 10 AAGE CN(CCN)c1ccc(B(O)O)cn1 2210060452 KKKVUPNXUKXADD-UHFFFAOYSA-N 195.031 -1.844 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C[C@H]1C1CC1 2241468798 VDISIOKDQVYSNS-YUMQZZPRSA-N 193.011 -1.084 50 10 AAGE CC1(NC(=O)C2(B(O)O)CC2)CNC1 2241480614 KKAIKSBNJMVSHQ-UHFFFAOYSA-N 198.031 -1.529 50 10 AAGE O=C1CCCN1C(=O)[C@@H]1C[C@@H]1B(O)O 2241495368 JBHWLDBZFDRGTQ-RITPCOANSA-N 196.999 -1.002 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2C[C@H](C1)[C@H]2O 2241815230 PHRMLJVRVJLURZ-HSNKUXOKSA-N 199.254 -1.323 50 10 AAGE COCCN(C[C@H](C)O)C(=O)NN 2242097041 DHFUPKJMPNXSDG-LURJTMIESA-N 191.231 -1.101 50 10 AAGE O=C(OC(=O)[C@@H]1CCN1)[C@@H]1CCN1 59498762 QMTVBCYYNGSIPT-WDSKDSINSA-N 184.195 -1.220 50 10 AAGE NNC(=O)CN1CCn2cnnc2C1 81544402 SRUOOJMCXWNOPC-UHFFFAOYSA-N 196.214 -1.916 50 10 AAGE O=CNNCCO 205666596 XBMPZLNHQPUKFE-UHFFFAOYSA-N 104.109 -1.771 50 10 AAGE CC1=C(C(=O)NN)/C(=N/N)CO1 306149215 AHRJFLINMPPOSJ-RUDMXATFSA-N 170.172 -1.405 50 10 AAGE Cc1nc(B(O)O)ccc1N 307274388 NERFJPZDIQFTFI-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE CC(=NNC(N)=O)C(N)=O 383578670 JARSENPYLLAZTK-UHFFFAOYSA-N 144.134 -1.484 50 10 AAGE C[C@H](CO)CN(C)CCC(=O)NN 688387752 MWKRJJSLPHKVNB-ZETCQYMHSA-N 189.259 -1.073 50 10 AAGE NNC(=O)N[C@]12COC[C@H]1C2 717977796 UWVWCSPYMDQJAW-INEUFUBQSA-N 157.173 -1.052 50 10 AAGE C[C@H]1CN(CC(=O)NN)C(=O)N1C 885494025 GKTYBCIGBLHKTB-YFKPBYRVSA-N 186.215 -1.268 50 10 AAGE NC(=O)CC(=O)NNc1ccncn1 1627966936 IBMYKPGRJOCISN-UHFFFAOYSA-N 195.182 -1.205 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@@H]2[C@@H]1CO 1877582664 JHTGQTIKKUEPFZ-FXQIFTODSA-N 199.254 -1.321 50 10 AAGE C[C@@H](C(N)=O)N1CC[C@H](B(O)O)C1 1891559137 GVUCEDIQSANCOW-WDSKDSINSA-N 186.020 -1.591 50 10 AAGE C=CC[C@@H](NC(=O)CO)B(O)O 1923809304 KUASGIVZWLGGCD-RXMQYKEDSA-N 172.977 -1.948 50 10 AAGE C[C@@H]1CN[C@H](C(=O)NN(C)C)CO1 1954879686 DYYALVVRRBZNPT-RQJHMYQMSA-N 187.243 -1.044 50 10 AAGE C[C@@H](NC(=O)C(=O)NN)c1ncco1 1955527911 SHXWZQPIPHSQTL-SCSAIBSYSA-N 198.182 -1.158 50 10 AAGE CON(C)c1nc(C)ncc1B(O)O 1956966690 YXSRTQXNLZSJSF-UHFFFAOYSA-N 197.003 -1.538 50 10 AAGE C[C@H]1C[C@@H](NC(=O)C#CB(O)O)CO1 2241468056 GQUDUQLLILFKLP-NKWVEPMBSA-N 196.999 -1.705 50 10 AAGE O=C(NC1CC1)c1cc(B(O)O)c[nH]1 2241468995 YIHCMPHOGGRPSA-UHFFFAOYSA-N 193.999 -1.413 50 10 AAGE CC[C@@H](NC(=O)C#CB(O)O)C(N)=O 2241479030 QBHWHAVLSRKUOW-RXMQYKEDSA-N 197.987 -2.618 50 10 AAGE COc1n[nH]cc1C(=O)NNC(N)=O 2241555074 OFMBTEZKSZEDAY-UHFFFAOYSA-N 199.170 -1.269 50 10 AAGE N[C@]1(B(O)O)C[C@H]2[C@H]3CC[C@H](O3)[C@H]21 2297204739 PUZCYZJYPXHRLB-GWVFRZDISA-N 183.016 -1.107 50 10 AAGE Cn1cc(B(O)O)c([N+](=O)[O-])n1 222090155 FGIMDSUZRLUOMV-UHFFFAOYSA-N 170.921 -1.992 50 10 AAGE CN(CCOCCO)C(=O)NN 301051191 UDIKTVGUPKIHIN-UHFFFAOYSA-N 177.204 -1.490 50 10 AAGE N#CCCNC(=O)NNC(N)=O 306418699 VOMQTLLEUKUGSP-UHFFFAOYSA-N 171.160 -1.217 50 10 AAGE CCONC(=O)NNC(N)=S 306980485 FUDXQCQCJIKNCS-UHFFFAOYSA-N 178.217 -1.015 50 10 AAGE CC(/C=C/C(=O)NN)=NN 321790616 RIGJSFOTZKKRKK-ZDSFVJFVSA-N 142.162 -1.133 50 10 AAGE O=C(NCB(O)O)c1ncccc1O 701937424 GBJQRYSMHUEPPL-UHFFFAOYSA-N 195.971 -1.471 50 10 AAGE CO[C@H](C)n1cc(B(O)O)cn1 953036108 YCPIWMXEXVGFFT-RXMQYKEDSA-N 169.977 -1.272 50 10 AAGE NNC(=O)N1C[C@@H]2[C@H](C(N)=O)[C@@H]2C1 1883971752 WZUZBQWRYYZYJC-ZXFHETKHSA-N 184.199 -1.767 50 10 AAGE NNC(=O)C(=O)N1CCC[C@H]2C[C@@H]21 1916275678 GYGVQRCKMJPVKY-WDSKDSINSA-N 183.211 -1.013 50 10 AAGE C[C@@H](C(=O)NN)N1CC(N2CCC2)C1 1932052745 IJQXUOLMJPJXLV-ZETCQYMHSA-N 198.270 -1.245 50 10 AAGE CNC(=O)Nc1ccc(B(O)O)cn1 1955268978 HTZSBGBWYDYHQW-UHFFFAOYSA-N 194.987 -1.487 50 10 AAGE NNC(=O)[C@]12CCCO[C@@H]1CNC2 2209305882 ZVYUEVYSSRLWPR-SVRRBLITSA-N 185.227 -1.255 50 10 AAGE COC(=O)c1nn(C)nc1B(O)O 2209357467 CEANFAODOWWJDT-UHFFFAOYSA-N 184.948 -2.719 50 10 AAGE CC(=O)NNC(=O)CN 49804421 ZJZLHCWLEUPTJA-UHFFFAOYSA-N 131.135 -1.888 50 10 AAGE CC[C@H](C(=O)NN)N(C)CC(N)=O 82467305 MKRRGFNRIQDOCF-RXMQYKEDSA-N 188.231 -1.828 50 10 AAGE C[C@@H]1CN[C@H](C(=O)NN(C)C)CN1 147948355 GVUKURSXHUTZHX-RQJHMYQMSA-N 186.259 -1.471 50 10 AAGE CS(=O)(=O)CS(=O)(=O)N=C=O 157707441 NNNHSZWTROTSFS-UHFFFAOYSA-N 199.209 -1.346 50 10 AAGE Cn1ncc2nc(B(O)O)ccc21 231404674 VFZKCPFOZBGMON-UHFFFAOYSA-N 176.972 -1.352 50 10 AAGE CN(CCCO)CC(=O)NN 300834507 PHFSGDOOVGJLEZ-UHFFFAOYSA-N 161.205 -1.710 50 10 AAGE N#CC1(O)CCN(C(=N)NN)CC1 575498835 GSPIUJCSIHFRTH-UHFFFAOYSA-N 183.215 -1.265 50 10 AAGE CO[C@@H]1CCOC[C@@H]1NC(=O)NN 725008373 ACJKBQISYQIFBG-NTSWFWBYSA-N 189.215 -1.037 50 10 AAGE C[C-]1C#CN(CCC(=O)NN)N1 885299128 SZZDVPWPYMSACI-UHFFFAOYSA-N 167.192 -1.301 50 10 AAGE CN1C#C[C-](C(=O)NCB(O)O)N1 885425542 WTIWCGXNGQNQAB-UHFFFAOYSA-N 181.968 -2.943 50 10 AAGE O=C(F)N[C@@H]1C[C@H](O)[C@@H](O)[C@@H]1O 1881051316 LJBUFLRSGWYIIJ-KKQCNMDGSA-N 179.147 -1.480 50 10 AAGE CC12COC(C(=O)NCB(O)O)(C1)C2 1904541918 ZONTYRGTVOTCPQ-UHFFFAOYSA-N 199.015 -1.316 50 10 AAGE NNC(=O)[C@@]12CNC[C@@H]1COC2 1923843004 XFJSPJGVSYEDKI-IYSWYEEDSA-N 171.200 -1.788 50 10 AAGE CN(C)C[C@H](N)[C@@H](O)C#N 1952793723 MIKKIMJMARBMCB-WDSKDSINSA-N 143.190 -1.240 50 10 AAGE NNC(=O)[C@H]1[C@H]2CC[C@H]1NC2 1953290848 WPIJSPKQJRQYPV-JKUQZMGJSA-N 155.201 -1.026 50 10 AAGE CC(C)[C@@H](O)CNC(=O)C#CB(O)O 2241478356 CQIJUENJGPIGJF-ZETCQYMHSA-N 199.015 -1.865 50 10 AAGE C=CCNC(=O)c1ccc(B(O)O)o1 2241479404 XJGDGINIEYDVBJ-UHFFFAOYSA-N 194.983 -1.125 50 10 AAGE NC1CC(NC(=O)[C@H]2C[C@H]2B(O)O)C1 2241480984 NLPFQJHVFWVMOT-GOXNJFHPSA-N 198.031 -1.545 50 10 AAGE CN(O)C(=O)c1cc(B(O)O)n(C)n1 2241495096 GXXFJRRJGTUNDI-UHFFFAOYSA-N 198.975 -2.439 50 10 AAGE N[C@]1(B(O)O)C[C@@H]2[C@H]3CC[C@H](O3)[C@H]21 2297204741 PUZCYZJYPXHRLB-QQGCVABSSA-N 183.016 -1.107 50 10 AAGE NNC(=O)CN1CCC[C@@H](O)C1 82470421 LEWPLAKEABAXCM-ZCFIWIBFSA-N 173.216 -1.567 50 10 AAGE O=C1CNCC(=O)O1 104692130 IJSMDZFKMKEIRX-UHFFFAOYSA-N 115.088 -1.341 50 10 AAGE CNc1ncc(B(O)O)c(=O)[nH]1 195846857 XGENQSBTIUGOSM-UHFFFAOYSA-N 168.949 -2.509 50 10 AAGE CO[C@H]1CN(C(=O)NN)C[C@H]1OC 234771271 PNQKWUUGJBOEOW-OLQVQODUSA-N 189.215 -1.085 50 10 AAGE CCN(CB(O)O)C(=O)[C@@H](N)CO 238250723 OHPABKJNVCBCPD-YFKPBYRVSA-N 190.008 -2.834 50 10 AAGE CO/C(C=O)=C/[C@@H](O)[C@@H](O)CO 238332046 LOUBRDMWHMERSC-OMCVRQNISA-N 176.168 -1.570 50 10 AAGE NNC(=O)[C@@H](O)[C@@H](O)C(N)=O 238554432 BYRHQFFLRWQHOK-NCGGTJAESA-N 163.133 -3.817 50 10 AAGE N#Cc1cc(CN)ncc1B(O)O 238631626 MHBGJXRVFRABRK-UHFFFAOYSA-N 176.972 -1.908 50 10 AAGE OB(O)[C@@H]1CCNN1 585665595 WSSIHCIFZJXXRF-VKHMYHEASA-N 115.929 -2.135 50 10 AAGE O=C(NCB(O)O)[C@@H]1C[C@@H]1F 1880183067 OZSINEFZANXMMD-DMTCNVIQSA-N 160.941 -1.527 50 10 AAGE O=C(O)CNC(=O)CNC(=O)F 1881052646 DNVLYGYZOHZUAH-UHFFFAOYSA-N 178.119 -1.134 50 10 AAGE CO[C@@H]1CNCC[C@@H]1C(=O)NN 1932346426 APKFZAJZEVOBQV-NTSWFWBYSA-N 173.216 -1.399 50 10 AAGE CN(C)NC(=O)[C@@H]1CNC[C@@H](O)C1 1934302265 FJMDCOSEPWSBHI-BQBZGAKWSA-N 187.243 -1.450 50 10 AAGE NCC(CO)(CO)NC(=O)F 2241386154 JHAXQIMZMUWHBJ-UHFFFAOYSA-N 166.152 -1.652 50 10 AAGE C[C@H](O)C1(NC(=O)C#CB(O)O)CC1 2241467834 BRXGNQNXZHQHQC-LURJTMIESA-N 196.999 -1.969 50 10 AAGE C[C@H](N)C(=O)N(C)CB(O)O 200991357 NIIGOUSTYUWMFP-BYPYZUCNSA-N 159.982 -2.196 50 10 AAGE Cc1nn2ccn(C)c2c1B(O)O 238539517 XRWPMBGYKRBZAU-UHFFFAOYSA-N 178.988 -1.339 50 10 AAGE NCc1cnc(Cl)c(B(O)O)c1 238565915 BTYWYICIJAJMPW-UHFFFAOYSA-N 186.407 -1.127 50 10 AAGE NNc1ccc(B(O)O)c(S)c1 306724665 VJQYFFVZUGXNHQ-UHFFFAOYSA-N 184.029 -1.059 50 10 AAGE NNC(=O)N1C[C@H](O)C[C@@H]1CO 606252155 JCHPKMNTJQYBSL-RFZPGFLSSA-N 175.188 -2.003 50 10 AAGE O=C1CC[C@H](C(=O)NCB(O)O)N1 702022507 JNNPIQXPPGQPCL-SCSAIBSYSA-N 185.976 -2.607 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]2CNC[C@H]21 1951339447 JYTSGFDUXSBHTC-HSUXUTPPSA-N 155.201 -1.168 50 10 AAGE Cc1cc(=NC(=O)C#CB(O)O)[nH]o1 2241468382 MZUNREOEDBCBPV-UHFFFAOYSA-N 193.955 -1.641 50 10 AAGE O=C(C#CB(O)O)NCc1nn[nH]n1 2241468522 PWBLFWNMIXJFCS-UHFFFAOYSA-N 194.947 -3.169 50 10 AAGE NNC(=O)c1cccc(B(O)O)c1F 2241473927 SQXMFHXXCWUSFL-UHFFFAOYSA-N 197.962 -1.891 50 10 AAGE O=C(NC1COC1)C1(B(O)O)CC1 2241474159 XRXIQZBAAKFIEI-UHFFFAOYSA-N 184.988 -1.492 50 10 AAGE O=C1NCCN1C(=O)[C@@H]1C[C@@H]1B(O)O 2241494944 FTXBBRHMCKRMRM-UHNVWZDZSA-N 197.987 -1.599 50 10 AAGE O=C([C@@H]1C[C@@H]1B(O)O)N1CCOCC1 2241495560 KQXMDMIVJADUCV-RQJHMYQMSA-N 199.015 -1.292 50 10 AAGE COCCC(=O)NCCC#CB(O)O 2241908883 QDFGIEKTALMUSA-UHFFFAOYSA-N 199.015 -1.455 50 10 AAGE CN(NC=O)C(=N)N 1564347 MIMVIULNHPQZRW-UHFFFAOYSA-N 116.124 -1.527 50 10 AAGE NNC(=O)[C@@H]1CCCS(=O)(=O)C1 213624135 RWBIHDDYIUPARM-RXMQYKEDSA-N 192.240 -1.199 50 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LCDLFWNKBPRKAX-IHWYPQMZSA-N 152.950 -1.160 50 10 AAGE Cn1nc(O)cc1C(=O)NNC(N)=O 1913100299 PZSMJFVLUBESPI-UHFFFAOYSA-N 199.170 -1.561 50 10 AAGE CN1[C@H](C(=O)NN)CC[C@@H]1CN 1923855691 ZACOTPXQOXCVRS-RITPCOANSA-N 172.232 -1.602 50 10 AAGE C[C@@H](O)CN=c1ccc(B(O)O)c[nH]1 2210068147 MMNSZJCMRWKZSY-ZCFIWIBFSA-N 196.015 -2.024 50 10 AAGE O=C(C#CB(O)O)N[C@H]1CC[C@H]1O 2241468396 NMCQRAOCUMTEIM-NTSWFWBYSA-N 182.972 -2.359 50 10 AAGE O=C(C#CB(O)O)N[C@H]1CC[C@H](O)C1 2241478648 JPCDYZSROWEZBY-BQBZGAKWSA-N 196.999 -1.969 50 10 AAGE O=C(NC1CC(O)C1)[C@H]1C[C@@H]1B(O)O 2241496578 VEOQNCNISYOJSS-FTDRKVFOSA-N 199.015 -1.511 50 10 AAGE COC[C@@H](O)CN(C)CC(=O)NN 82470790 RIVZUMUPGKEKDJ-LURJTMIESA-N 191.231 -2.085 50 10 AAGE NNC(=O)CCCNC(N)=S 165915695 XLEIOGRXSFZCKE-UHFFFAOYSA-N 176.245 -1.410 50 10 AAGE NNC(=O)CCCN1CC[C@@H](N)C1 203222853 QUXJOVNZFLWRJT-SSDOTTSWSA-N 186.259 -1.211 50 10 AAGE NC(N)C(=O)N1CCC[C@@H]1B(O)O 222268186 XRUTXSZBUINVGU-SCSAIBSYSA-N 187.008 -2.767 50 10 AAGE CC[C@@](C)(NNC(N)=O)C(N)=O 224744025 PDKGXWLWOPBICU-ZCFIWIBFSA-N 174.204 -1.187 50 10 AAGE Cc1nn(C)cc1NC(=O)C(=O)NN 227508507 SWLNNSUESSEJNG-UHFFFAOYSA-N 197.198 -1.343 50 10 AAGE OB(O)c1cnn2c1CNCC2 307031963 RDNUDGWAVXEWOE-UHFFFAOYSA-N 166.977 -2.334 50 10 AAGE COC[C@@](C)(O)C(=O)NNC(C)=O 1539518150 LVWBPGGACCDIPA-SSDOTTSWSA-N 190.199 -1.449 50 10 AAGE COC1([C@@H](N)B(O)O)CCOCC1 1931460987 JBMLHURKWZJGHN-ZCFIWIBFSA-N 189.020 -1.479 50 10 AAGE C[C@H](O)[C@H](N)[C@H](O)C#N 1952796160 VBCDNPYVVBRROZ-LMVFSUKVSA-N 130.147 -1.421 50 10 AAGE CC(=O)NC[C@@H](N)[C@@H](O)C#N 1952895407 HSUVJVYSVIHSTK-RITPCOANSA-N 157.173 -1.666 50 10 AAGE O=C(C#CB(O)O)NCc1ccon1 2241468746 UFLWGJLLUSQPRU-UHFFFAOYSA-N 193.955 -1.694 50 10 AAGE NNC(=O)c1nscc1B(O)O 2241481405 SAHIQQLDDNYVTJ-UHFFFAOYSA-N 186.989 -2.574 50 10 AAGE NN[C@H](C(=O)O)[C@H](Cl)C(=O)O 19172141 GWLHLYRBOKYJEU-LWMBPPNESA-N 182.563 -1.405 50 10 AAGE CCOCCNC(=O)C(=O)NN 36230524 WGLJBRRCNCKSAJ-UHFFFAOYSA-N 175.188 -1.871 50 10 AAGE O=C=NN1CC(=O)C1=O 59209158 CZGDJIQPSOUEAX-UHFFFAOYSA-N 126.071 -1.352 50 10 AAGE CN(C)NC(=O)C1=NNC(=O)CC1 105835408 KPOOLWKDYNIDCD-UHFFFAOYSA-N 184.199 -1.155 50 10 AAGE O=C(CCl)NCB(O)O 169879824 BLGBFTVMRZPQPQ-UHFFFAOYSA-N 151.358 -1.647 50 10 AAGE COc1cc(B(O)O)cc(C(=O)O)n1 198023965 YSZBYSINIADSNG-UHFFFAOYSA-N 196.955 -1.532 50 10 AAGE OCCc1ncc(B(O)O)cn1 238684900 BXZSOZWBQYHMTQ-UHFFFAOYSA-N 167.961 -2.309 50 10 AAGE OCc1ccc(B(O)O)c(Cl)n1 238724993 IPNZJYHHSIJQKX-UHFFFAOYSA-N 187.391 -1.093 50 10 AAGE CN1CCC[C@@H]([C@@H](N)C(=O)NN)C1 259033853 RRTLFAIQAJPDOE-RNFRBKRXSA-N 186.259 -1.355 50 10 AAGE CC(=O)NNC1=N[C@@H](C)CN1 306454033 OVVRAGILHFGFRT-BYPYZUCNSA-N 156.189 -1.025 50 10 AAGE C[C@H]1CN(C(=O)C(=O)NN)C[C@H]1O 307601869 VMOWJQUVYAUYJD-CRCLSJGQSA-N 187.199 -2.185 50 10 AAGE NNC(=O)c1cn2cnnc2cn1 606254018 KUMINQWRDRVXST-UHFFFAOYSA-N 178.155 -1.272 50 10 AAGE NC(=O)NN=Cc1cn(O)cc[n+]1=O 687807687 VFKXFYFZRPEJBG-UHFFFAOYSA-O 198.162 -1.358 50 10 AAGE OB(O)c1cnn(C[C@H]2CCOC2)c1 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2241478764 LBXSTUSZDHVLMR-UHFFFAOYSA-N 169.933 -2.437 50 10 AAGE C[C@@H](O)CC(=O)NCC#CB(O)O 2241574707 ASLLYJCGCZRJOP-ZCFIWIBFSA-N 184.988 -2.111 50 10 AAGE NNC(=O)C(=O)NCC1CCC1 37181174 HYUAKZUKZDNXPO-UHFFFAOYSA-N 171.200 -1.107 50 10 AAGE C[C@H](C(=O)NN)n1cncn1 39136665 HPYLBLKDEWZBMN-SCSAIBSYSA-N 155.161 -1.171 50 10 AAGE Cc1cc(=O)n(CC(=O)NN)c(C)n1 82599447 OAOGGKNXWUAWKI-UHFFFAOYSA-N 196.210 -1.150 50 10 AAGE NNC(=O)C(=O)Nc1ccc(=O)[nH]n1 161129840 RFQRNKOXFIPWTA-UHFFFAOYSA-N 197.154 -2.302 50 10 AAGE NNC(=O)c1cnc(C(N)=O)cn1 238562134 IXUPTMJCIUSDEA-UHFFFAOYSA-N 181.155 -1.821 50 10 AAGE O=CC1=C[C@H](O)[C@H](O)[C@H](O)[C@@H]1O 257466683 KQQCGAKRCKYICB-BNHYGAARSA-N 174.152 -2.431 50 10 AAGE N[C@@H]1CNNC(=O)[C@@H]1Cl 306823922 VAWMCEQQZVMGRC-PWNYCUMCSA-N 149.581 -1.445 50 10 AAGE COC1CN(CCC(=O)NN)C1 308107042 IKECCSCJXDKCHX-UHFFFAOYSA-N 173.216 -1.303 50 10 AAGE NC(=O)NNC(=O)[C@@H]1CNC(=O)C1 575559351 YLXXKBBRZQCVOS-VKHMYHEASA-N 186.171 -2.178 50 10 AAGE CN(N)C(=O)[C@@H]1COCCO1 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N#CNCCc1ccccc1B(O)O 2241554804 HQEOALKMQLJLPL-UHFFFAOYSA-N 190.011 -1.020 50 10 AAGE NNC(=O)C(=O)NCC[C@@H]1CCO1 2242561072 OXKFOJLKJIRNID-RXMQYKEDSA-N 187.199 -1.729 50 10 AAGE C[C@H]1C(=O)N(CC(=O)NN)C(=O)[C@@H]1C 86017246 MSMGQSBIRXSPJK-RFZPGFLSSA-N 199.210 -1.383 50 10 AAGE O=CNNC(=O)c1c[nH]cn1 114933699 DHGSKISRMGALHO-UHFFFAOYSA-N 154.129 -1.200 50 10 AAGE CN(N)C(=O)CO 140324177 IEEHDVFRFRYYBN-UHFFFAOYSA-N 104.109 -1.689 50 10 AAGE N[C@@H](CCSCB(O)O)C(=O)O 195915172 JIADETXLJBAGMM-BYPYZUCNSA-N 193.033 -1.466 50 10 AAGE O[C@H]1[C@@H](O)[C@@H](O)[C@H](Cl)[C@@H]1O 306477704 AZRSXIZEFAVCBM-FNIQGMNXSA-N 168.576 -1.949 50 10 AAGE CN(CC=O)C1=C(C#N)C#CNN1 885351530 ZONFSSTWBFOGCI-UHFFFAOYSA-N 176.179 -1.079 50 10 AAGE COCCN(C)NC(=O)CO 899053563 SLXGCCIJYUKLLJ-UHFFFAOYSA-N 162.189 -1.412 50 10 AAGE CC(C)[S@](=O)NCC#CB(O)O 1881440395 PAVCAFAVDKGISA-LBPRGKRZSA-N 189.045 -1.337 50 10 AAGE C[C@@H](C(=O)NN)N1CC(F)(C#N)C1 1888381858 OGYARWNFMOJWCC-YFKPBYRVSA-N 186.190 -1.088 50 10 AAGE CCON(C)CCOCC(=O)NN 1928677542 BHMDCUFPFHMIRB-UHFFFAOYSA-N 191.231 -1.124 50 10 AAGE CN(C)NC(=O)C1CC(O)(CN)C1 1953804814 CVQZVFCEDNJVPS-UHFFFAOYSA-N 187.243 -1.321 50 10 AAGE CC[C@H](COC)NC(=O)C#CB(O)O 2241468121 HRRKJKCXBQRGME-SSDOTTSWSA-N 199.015 -1.457 50 10 AAGE O=C(Nc1nc[nH]n1)C1(B(O)O)CC1 2241473864 RHKDWKDTSJWDHY-UHFFFAOYSA-N 195.975 -1.250 50 10 AAGE NC[C@H]1C[C@@H](NC(=O)C#CB(O)O)C1 2241478893 MYTRXRJLZAFINB-KNVOCYPGSA-N 196.015 -2.145 50 10 AAGE Cc1c(B(O)O)cccc1C(N)=O 2241479992 CTLACBFEPMXIRJ-UHFFFAOYSA-N 178.984 -1.226 50 10 AAGE O=C(NO)c1cocc1B(O)O 2241757856 QQNOCRKYMQNMBO-UHFFFAOYSA-N 170.917 -1.922 50 10 AAGE C[C@H](N)C#CC(=O)NN(C)C 2297009768 JBOFYYLUNURFFB-LURJTMIESA-N 155.201 -1.070 50 10 AAGE CN(CB(O)O)C(=O)[C@H](N)CO 216441756 XTTGWZVIXNIAGD-SCSAIBSYSA-N 175.981 -3.224 50 10 AAGE CO[C@H]1CN(C(=O)NN)C[C@@H]1OC 234859230 PNQKWUUGJBOEOW-WDSKDSINSA-N 189.215 -1.085 50 10 AAGE C[P@](=O)(O)CC[C@@H](N)C(=O)NN 238490838 DEASMHDELVYNGJ-SCSAIBSYSA-N 195.159 -1.406 50 10 AAGE Cc1cncc(B(O)O)c1C#N 238538934 UPVFHYPZKKRISO-UHFFFAOYSA-N 161.957 -1.059 50 10 AAGE CC[C@@H](NC(=O)NN)C(N)=O 306242200 SPVZCCCWJSNOGX-GSVOUGTGSA-N 160.177 -1.577 50 10 AAGE O=CC1=C[C@H](O)[C@@H](O)[C@H](CO)O1 306466671 PQVIDRCMCCXBNW-LYFYHCNISA-N 174.152 -1.818 50 10 AAGE Cc1ccc(N)c(B(O)O)n1 306966412 FPDKXTXOYMUCJC-UHFFFAOYSA-N 151.962 -1.348 50 10 AAGE O=CC1=C[C@H]2O[C@H]1[C@H]1C(=O)NC(=O)[C@H]12 307468067 QLXTWVJINCBDIY-JRTVQGFMSA-N 193.158 -1.219 50 10 AAGE CNC(=O)NNS(=O)(=O)CCO 388393313 FAHFPVLWXHTZEA-UHFFFAOYSA-N 197.216 -2.258 50 10 AAGE CO[C@@H]1C[C@@H]1C(=O)NNC(N)=S 689976662 ONJICMOEJKMRCW-IUYQGCFVSA-N 189.240 -1.114 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2C[C@H]1CO2 718287597 WTTPXHUFFJRWSZ-ACZMJKKPSA-N 185.227 -1.162 50 10 AAGE C[C-]1C#CN(CCC(=O)NN)C(=O)N1 885802881 WOXIHSGKBLOHSL-UHFFFAOYSA-N 195.202 -1.096 50 10 AAGE C[C@@H]1CNC[C@H](C(=O)NN)O1 1923923216 XNPVZEJRQHJADN-RFZPGFLSSA-N 159.189 -1.647 50 10 AAGE CCOC[C@H](N)C(=O)NN(C)C 1953436054 YDNKVXWPPLPBHK-LURJTMIESA-N 175.232 -1.057 50 10 AAGE CNC1CN(C(=O)C2(B(O)O)CC2)C1 2241480760 LDQPCPXKSWMSJZ-UHFFFAOYSA-N 198.031 -1.576 50 10 AAGE O=C(N[C@@H]1CCNC1)[C@H]1C[C@@H]1B(O)O 2241481592 UESJJDILQWLRKN-VQVTYTSYSA-N 198.031 -1.673 50 10 AAGE CCN(CC(=O)N(C)C)C(=O)NN 42517133 HDACCNMSLNJGIB-UHFFFAOYSA-N 188.231 -1.020 50 10 AAGE NC(=O)NNC(=O)[C@@H]1COCCO1 70044672 YIECCPHXJRNEMQ-BYPYZUCNSA-N 189.171 -1.899 50 10 AAGE N#Cc1cc(O)c(B(O)O)cn1 238632241 CSJNDBVMQOIWTE-UHFFFAOYSA-N 163.929 -1.661 50 10 AAGE C[C@H]1COCCN(CC(=O)NN)C1 307154281 UQHOXQUJOYJBNS-SSDOTTSWSA-N 187.243 -1.055 50 10 AAGE C[C@H]1CN(C(=O)C(=O)NN)[C@@H]1C 606252567 QMJVKSFUMMDREN-CRCLSJGQSA-N 171.200 -1.157 50 10 AAGE O=CC1=C=[N+](C[C@H]2COCCO2)NN1 885841413 XMGDYOOJFVUHEL-QMMMGPOBSA-N 198.202 -1.810 50 10 AAGE CN(C)NC(=O)C[C@@H]1COC[C@H]1N 1882796298 BSGPJKWJFHLAFO-RNFRBKRXSA-N 187.243 -1.057 50 10 AAGE NNC(=O)[C@]12C[C@H](N)[C@H]1C2 1953189869 UFECFSPTYHDILU-ALEPSDHESA-N 141.174 -1.286 50 10 AAGE C[C@@H](N)CN=c1ccc(B(O)O)c[nH]1 2210060815 NOGVWYOYRDWABW-ZCFIWIBFSA-N 195.031 -2.058 50 10 AAGE N#CNC(=O)c1cccc(B(O)O)c1 2241474968 OCBITOVTJAGJHC-UHFFFAOYSA-N 189.967 -1.423 50 10 AAGE CC[C@@H](CN)NC(=O)C#CB(O)O 2241479498 ZFRRPEPDVLWIAI-LURJTMIESA-N 184.004 -2.145 50 10 AAGE Cc1ccc(CNC=O)cc1B(O)O 2242566855 OHQLUABXPANFIJ-UHFFFAOYSA-N 193.011 -1.079 50 10 AAGE O[C@@H]1[C@H](O)O[C@@H](CCl)[C@H](O)[C@H]1O 2566147 QMWDIHPSUCUMFU-MDMQIMBFSA-N 198.602 -1.975 50 10 AAGE NNC(=O)CCCN1CCNCC1 82469768 GBGJNTRVZKZLFA-UHFFFAOYSA-N 186.259 -1.338 50 10 AAGE [C-]#[N+][C@H]1C(=O)[C@H]1C(N)=O 199133877 ZJCYGJKZAAVKSP-STHAYSLISA-N 124.099 -1.042 50 10 AAGE NNC(=O)c1cn([C@H]2CCOC2)nn1 238567840 MHNLLLUOIMFKBR-YFKPBYRVSA-N 197.198 -1.157 50 10 AAGE OB(O)c1cnc(OC(F)F)cn1 238635615 BIMLAEWHRGOCNR-UHFFFAOYSA-N 189.914 -1.242 50 10 AAGE O=C1NCN[C@@H](O)[C@@H]1Cl 306512181 PADFGQLYLYOUPH-HRFVKAFMSA-N 150.565 -1.411 50 10 AAGE O=CNN=C[C@H](O)[C@H](O)[C@H](O)CO 308231924 TYLXBMBILSJXNP-JKUQZMGJSA-N 192.171 -3.207 50 10 AAGE NC(=O)CC(=O)NN=c1cc[nH]cc1 1116514741 ORXOFNFLZPUHCC-UHFFFAOYSA-N 194.194 -1.178 50 10 AAGE CCNC(=O)NCC#CB(O)O 1881440605 RUZOBIKSUOSELA-UHFFFAOYSA-N 169.977 -1.679 50 10 AAGE CN(C)NC(=O)C[C@H]1COC[C@H]1N 1882796297 BSGPJKWJFHLAFO-NKWVEPMBSA-N 187.243 -1.057 50 10 AAGE C[C@H](C(=O)NN)N1CC(C)(CO)C1 1935359096 QSDKXVLUYIREEK-ZCFIWIBFSA-N 187.243 -1.321 50 10 AAGE NC[C@@H]1CC[C@H]1C(=O)NN 1935426649 SHZYSXCYLQHAJS-CRCLSJGQSA-N 143.190 -1.039 50 10 AAGE C[C@H]1CN(C(=O)C#CB(O)O)C[C@@H]1N 2241468164 IKYHERZSWGMAPP-BQBZGAKWSA-N 196.015 -2.193 50 10 AAGE C[C@@H](CN(C)C)NC(=O)C#CB(O)O 2241472664 VVOSZRPMUBNENG-ZETCQYMHSA-N 198.031 -1.932 50 10 AAGE CNC(=O)C(=[N+]=[N-])C(=O)NN 39136588 QEXSJNULARBOOL-UHFFFAOYSA-N 157.133 -2.607 50 10 AAGE NNC(=O)c1nonc1C(=O)NN 59503404 HENUCWCNIXAKHF-UHFFFAOYSA-N 186.131 -2.723 50 10 AAGE C[C@H]1C(=O)NCCN1CC(=O)NN 82478293 CXLQBNBRRHYKRC-YFKPBYRVSA-N 186.215 -2.203 50 10 AAGE CNc1ccc(B(O)O)cc1N 204726674 JAPRPHVDCIZUEX-UHFFFAOYSA-N 165.989 -1.010 50 10 AAGE COC(=O)/C(C#N)=C(/N)NN 204936733 ZXHLZWWADYMZMS-ARJAWSKDSA-N 156.145 -1.683 50 10 AAGE CC[C@H](C)NNC(=O)[C@H](N)CO 238279830 GIJORYVKHKWILQ-NTSWFWBYSA-N 175.232 -1.275 50 10 AAGE CNC(=S)NNC(=O)C(=O)NN 238362737 VLZDSUALXHXIND-UHFFFAOYSA-N 191.216 -2.899 50 10 AAGE C[C@H](O)[C@@](O)(CO)[C@@H](O)C(=O)NN 388696788 MHMQNUPOMLUWHA-FKZODXBYSA-N 194.187 -3.559 50 10 AAGE Cc1ncoc1CNC(=O)C(=O)NN 1928782693 FAHZYZFESUTXPP-UHFFFAOYSA-N 198.182 -1.411 50 10 AAGE COC(OC)[C@@H](N)[C@@H](O)C#N 1952862958 QOMCDAWWOABLCV-WHFBIAKZSA-N 160.173 -1.183 50 10 AAGE C#CCOc1ncccc1B(O)O 2209388149 RDQHZDYDDLSYSQ-UHFFFAOYSA-N 176.968 -1.227 50 10 AAGE N[C@H]1CC[C@H](NC(=O)C#CB(O)O)C1 2241468631 RKMJMHLGPVXCKE-BQBZGAKWSA-N 196.015 -2.002 50 10 AAGE NNC(=O)CCN1CC[C@H](CO)C1 159483766 DDYHIVPBXNPVAK-ZETCQYMHSA-N 187.243 -1.319 50 10 AAGE NCc1nc(F)ccc1B(O)O 238588753 HPVVQMWKRVQZRZ-UHFFFAOYSA-N 169.952 -1.641 50 10 AAGE NC(N)=NNC(=O)Cc1ccccn1 238603292 RGKLWPJVPLJCHR-UHFFFAOYSA-N 193.210 -1.071 50 10 AAGE O=Cc1nccc(CO)c1B(O)O 238728125 ZSNPNUROZMMOFN-UHFFFAOYSA-N 180.956 -1.934 50 10 AAGE CC(C)[C@@H](NC(=O)NN)C(=O)NN 238792137 VUNOGHWSADEBOJ-SCSAIBSYSA-N 189.219 -1.826 50 10 AAGE CC(=O)Nc1ncccc1B(O)O 306540485 RSOAQDOQMFCHJU-UHFFFAOYSA-N 179.972 -1.280 50 10 AAGE COC(=O)[C@@H]1CN(C)C[C@H]1B(O)O 307053648 QCSRLJWVHXCNJG-PHDIDXHHSA-N 187.004 -1.436 50 10 AAGE NNc1c(B(O)O)cccc1C(=O)O 307231882 BZODKLDGJXPLMF-UHFFFAOYSA-N 195.971 -1.650 50 10 AAGE CN(C)NC(=O)c1c[nH]c(=O)[nH]1 307543581 UXMKFHZBLIOAPB-UHFFFAOYSA-N 170.172 -1.091 50 10 AAGE C[C@H]1CC[C@@H](C(=O)NCB(O)O)O1 702017093 HDWVVKUUZMYERK-WDSKDSINSA-N 187.004 -1.318 50 10 AAGE CNCCOCCNC(=O)NN 1328966357 XQQLFEKCXSXGHU-UHFFFAOYSA-N 176.220 -1.605 50 10 AAGE O=C(O)C#CB(O)O 1879949950 QXTGYXNXAOYXCE-UHFFFAOYSA-N 113.865 -1.914 50 10 AAGE CCS(=O)(=O)NCC=CB(O)O 1881336343 SGHJPQZXOQVSSI-UHFFFAOYSA-N 193.033 -1.506 50 10 AAGE NNC(=O)N1CC([C@@H](O)CO)C1 1887182341 QPJFVNBCGZLLQQ-YFKPBYRVSA-N 175.188 -2.145 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@H]2C[C@H]1[C@H]2CO 1902449327 SHOCNNRJKJOBEY-YWIQKCBGSA-N 199.254 -1.323 50 10 AAGE NNC(=O)CCCN1CC(CO)C1 1929743807 UYLCKESKYTXZTF-UHFFFAOYSA-N 187.243 -1.319 50 10 AAGE O=C(C#CB(O)O)NCC1CC(O)C1 2241467972 FGMSXWBFRJWKLR-UHFFFAOYSA-N 196.999 -2.111 50 10 AAGE O=C(C#CB(O)O)NC1[C@H]2CCC[C@H]12 2241468237 JVFGYNDJQPQEHP-BQBZGAKWSA-N 193.011 -1.084 50 10 AAGE CNC(=O)c1csc(B(O)O)c1 2241468243 JWZWRJPLSQLCAV-UHFFFAOYSA-N 185.013 -1.213 50 10 AAGE C[C@@H](CN)NC(=O)[C@H]1C[C@H]1B(O)O 2241495337 ITPNKMRNKVVMAG-HCWXCVPCSA-N 186.020 -1.687 50 10 AAGE C[C@H]1C[C@H]1NC(=O)C(=O)NN 52298223 JMVIIAHMQOFZJR-IUYQGCFVSA-N 157.173 -1.499 50 10 AAGE O=C1CN(C(=O)CCl)C(=O)CN1 238530160 UFGXOSWJLICGMH-UHFFFAOYSA-N 190.586 -1.290 50 10 AAGE C[C@@H](CO)NC(=O)NNC(N)=O 306864705 KYVIRYXIFNNGLE-VKHMYHEASA-N 176.176 -1.750 50 10 AAGE NC(=O)NN=C[C@@H](N)CC(=O)O 379324707 IDSPMTJKADSQFB-VKHMYHEASA-N 174.160 -1.558 50 10 AAGE NNC(=O)CCN1C[C@@H]2COC[C@H]2C1 718237866 BTIJHUGXWBYLCE-HTQZYQBOSA-N 199.254 -1.055 50 10 AAGE N#CC1=C(N2CCNCC2)NC#CN1 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AAGE NNC(=O)N1CCNCC1 28188435 NHAHUMIXNATTFN-UHFFFAOYSA-N 144.178 -1.525 50 10 AAGE NNC(=O)C[C@H](O)CO 38250909 IRCHHMFLNKHICB-VKHMYHEASA-N 134.135 -2.280 50 10 AAGE NC(=O)N/N=C1/CCS(=O)(=O)C1 70187236 BPHNJEVFSYQPOQ-DAXSKMNVSA-N 191.212 -1.171 50 10 AAGE NNC(=O)C(=O)NCCC1CC1 83912100 IBIFVINSZJVFFG-UHFFFAOYSA-N 171.200 -1.107 50 10 AAGE NNC(=O)N1CC[C@](O)(C(N)=O)C1 306410335 ZTPLSILNHNNKRO-ZCFIWIBFSA-N 188.187 -2.508 50 10 AAGE Nc1nc2ccc(B(O)O)c(N)c2[nH]1 306821522 OTVIBWIBGPDBEN-UHFFFAOYSA-N 191.987 -1.593 50 10 AAGE OC[C@@H]1NC[C@@H](Cl)[C@H]1O 306970218 IWEPYFZAWJSTGF-MROZADKFSA-N 151.593 -1.081 50 10 AAGE CN(C)C(=O)NNC(=O)CC(N)=O 308500025 WDVNOKWADLCYGV-UHFFFAOYSA-N 188.187 -1.836 50 10 AAGE NNC(=O)CN1C[C@H]2CC[C@@H](O2)C1=O 719513890 HIYFCRBTSCPUSH-PHDIDXHHSA-N 199.210 -1.634 50 10 AAGE CC1(C)[C@H](O)[C@H](O)CN1C(=O)NN 1882318342 CYPIMWBHSQYQGR-RFZPGFLSSA-N 189.215 -1.614 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1885715465 LWYOZAPCKPBCMV-FMCRUOTFSA-N 199.210 -2.327 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2[C@H](CO)[C@@H]2C1 1885716567 WUSLFPWQGCPPIB-OOJXKGFFSA-N 199.254 -1.465 50 10 AAGE NNC(=O)CN1C[C@@H]2C[C@H](O)[C@H]2C1 1931413387 QSDSDAZZVWCISO-ACZMJKKPSA-N 185.227 -1.711 50 10 AAGE N#C[C@@H](O)[C@@H](N)c1cc(O)nc(O)n1 1952956829 PLXXKHCLHKDAAB-XINAWCOVSA-N 196.166 -1.228 50 10 AAGE CO[C@H]1C[C@](N)(B(O)O)C[C@H]1OC 1953789305 ZODWABVUJHCXIC-ZMONIFLSSA-N 189.020 -1.480 50 10 AAGE NNC(=O)C(=O)NCC1[C@H]2CC[C@H]12 1954465502 IALFZNINLFCFMK-WHFBIAKZSA-N 183.211 -1.252 50 10 AAGE NNC(=O)CN1C(=O)[C@H]2C[C@@H]1[C@@H]1C[C@H]21 1955370182 VJOPVIUPOLJXBY-BNHYGAARSA-N 195.222 -1.157 50 10 AAGE CN(C)NC(=O)[C@@H]1CO[C@H]2CNC[C@@H]12 1955556424 LWTBLUCNYDYZPJ-RNJXMRFFSA-N 199.254 -1.186 50 10 AAGE NCCc1n[nH]cc1C(=O)NN 2209025676 SYMATXWOJSWNPH-UHFFFAOYSA-N 169.188 -1.486 50 10 AAGE NC(=O)CONC(=O)C#CB(O)O 2241479304 VVWNFPNAUGAKGA-UHFFFAOYSA-N 185.932 -3.465 50 10 AAGE CC1(N)CN(C(=O)[C@H]2C[C@@H]2B(O)O)C1 2241481119 OWRAGAOKVPMLPJ-WDSKDSINSA-N 198.031 -1.591 50 10 AAGE NNC(=O)[C@@H]1C[C@@]12C[C@H]2N 2241528249 HLBYSXOKOFNMOO-MRKVFDINSA-N 141.174 -1.286 50 10 AAGE NNC(=O)N1CC[C@H](O)C1 61713355 IAHLAKYVLFOAHA-BYPYZUCNSA-N 145.162 -1.364 50 10 AAGE NNC(=O)NCCOC(N)=O 135271095 JMRGDGARMSTMNG-UHFFFAOYSA-N 162.149 -1.745 50 10 AAGE OB(O)c1ccnc(-n2cccn2)n1 198083390 XMOZUDIQHKIYOB-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE CC(C)[C@@H](NC(=O)NN)C(N)=O 231059518 ZVZZQVYYEUWCGN-SCSAIBSYSA-N 174.204 -1.331 50 10 AAGE CN(C)NC(=O)c1cncc(NN)n1 234234058 VTLCWYPBBMHXPR-UHFFFAOYSA-N 196.214 -1.031 50 10 AAGE C[C@H](OC(=O)NN)[C@H](N)C(=O)O 238456267 SDTZTXFNCFUFDG-HRFVKAFMSA-N 177.160 -1.613 50 10 AAGE OB(O)c1cncc2nccn12 238637457 JPDKJMGOGRGSTE-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE CCNC(=O)N(C)NS(N)(=O)=O 388487059 CXLLTXCFMWMQQN-UHFFFAOYSA-N 196.232 -1.644 50 10 AAGE CO[C@@]1(C)C[C@H]1NC(=O)C(=O)NN 694462368 MLLZHUDKEYCZNI-FBCQKBJTSA-N 187.199 -1.730 50 10 AAGE C=C(CN(C)C1CN(C)C1)B(O)O 1883743855 CWBQCYAOUAHQLS-UHFFFAOYSA-N 184.048 -1.200 50 10 AAGE NNC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(N)=O 1883971751 WZUZBQWRYYZYJC-SCDXWVJYSA-N 184.199 -1.767 50 10 AAGE CN1CC[C@@H]1COCC(=O)NN 1886371566 YZCRWYFCRNEKJU-ZCFIWIBFSA-N 173.216 -1.303 50 10 AAGE CC(C)N1CC[C@@](N)(B(O)O)C1 1953479465 XFWFLIPZLDKJQP-ZETCQYMHSA-N 172.037 -1.190 50 10 AAGE CN(C(=O)NN)[C@@H]1CC(=O)NC1=O 1954037604 YRTNLIWZHGGNLL-GSVOUGTGSA-N 186.171 -2.083 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H](C1)C2O 1957009563 LJEDBITUVSMVGN-XEAPYIEGSA-N 199.210 -2.185 50 10 AAGE C#CCN=c1ccc(B(O)O)c[nH]1 2209388740 ZROZKGWFZXRHFH-UHFFFAOYSA-N 175.984 -1.772 50 10 AAGE O=C(C#CB(O)O)NC[C@@H](O)CO 2241468310 LILNAYRPXJORKY-RXMQYKEDSA-N 186.960 -3.529 50 10 AAGE N#CNC(=O)c1c[nH]nc1B(O)O 2241474470 DKNXMEIWMICJNZ-UHFFFAOYSA-N 179.932 -2.700 50 10 AAGE CN(CCCN)C(=O)C#CB(O)O 2241479461 YNHQAVBDAJZJOO-UHFFFAOYSA-N 184.004 -2.191 50 10 AAGE COCCCN(C)CC(=O)NN 82469220 IGQYBXDOGDRUBE-UHFFFAOYSA-N 175.232 -1.055 50 10 AAGE C[C@@H](CCO)C(=O)NN 139383695 BJAAZNHXQVWXMR-BYPYZUCNSA-N 132.163 -1.005 50 10 AAGE Cn1ccc(C(=O)NNC(N)=S)n1 231928213 NVVZRYQNHKPCRQ-UHFFFAOYSA-N 199.239 -1.102 50 10 AAGE C[C@@H]1C[C@H](O)CN1CCC(=O)NN 306689935 AEQGREIZQTVXNX-RQJHMYQMSA-N 187.243 -1.179 50 10 AAGE O[C@H]1[C@H](O)[C@H](O)[C@H](O)[C@@H](Cl)[C@H]1O 307159002 BSMLUJHFZGTHOG-CTBIGQHSSA-N 198.602 -2.588 50 10 AAGE C[C-]1NC#CN1C[C@@H]1C[C@@H]1C(=O)NN 885687538 MUQNUIPRMTXDAY-YUMQZZPRSA-N 193.230 -1.055 50 10 AAGE NNC(=O)C12CC(C(=O)O)(CO1)C2 1882332587 UNPFZNVUUCJWJD-UHFFFAOYSA-N 186.167 -1.390 50 10 AAGE NNC(=O)C(=O)NCCc1ccno1 1886789850 ITUCELHFCJGKIM-UHFFFAOYSA-N 198.182 -1.677 50 10 AAGE NNC(=O)N[C@H]1CC(=O)N2CCC[C@@H]12 1887642758 URNRONYUWKWYOK-WDSKDSINSA-N 198.226 -1.077 50 10 AAGE Cc1cn(C)c(NC(=O)C(=O)NN)n1 1905142132 JEJUPYRCFUJFCM-UHFFFAOYSA-N 197.198 -1.343 50 10 AAGE CO[C@H]1CN(CC(=O)NN)C[C@H]1F 1928692555 QNYYDIGJLYWHHS-RITPCOANSA-N 191.206 -1.355 50 10 AAGE C[C@@H](CN)NC(=O)C1(B(O)O)CC1 2241473664 NWCAVRIVUIEISE-YFKPBYRVSA-N 186.020 -1.543 50 10 AAGE CN(C)NC(=O)[C@@H]1CCOCCN1 2241663407 DUUULJIMNKJBTI-ZETCQYMHSA-N 187.243 -1.042 50 10 AAGE O=C(NNCCO)[C@H]1[C@@H]2CCO[C@@H]21 2297043746 KXEZXIQVYWDLAJ-ACZMJKKPSA-N 186.211 -1.366 50 10 AAGE N#CCS(=O)(=O)CC(=O)NN 82692824 DZBOAHJVENVDHL-UHFFFAOYSA-N 177.185 -2.085 50 10 AAGE OB(O)c1cnc(F)nc1 195756954 ALEZNUYCXVEDPA-UHFFFAOYSA-N 141.898 -1.705 50 10 AAGE O=c1cc(B(O)O)cc(Cl)[nH]1 206059180 GETXFMJZNGWMEH-UHFFFAOYSA-N 173.364 -1.292 50 10 AAGE C[C@@H](CB(O)O)B(O)O 219546598 VWQHEWZRHOEGFZ-VKHMYHEASA-N 131.733 -1.678 50 10 AAGE CO[C@@H]1C(C#N)=C[C@H](O)[C@@H](O)[C@H]1O 306291256 QXDLLPJMUFXFAE-LXGUWJNJSA-N 185.179 -1.452 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]2C[C@@H]2C1 699257676 ATYTULIVMYLVEY-NTSWFWBYSA-N 183.211 -1.155 50 10 AAGE NNC(=O)c1cnn2c1OCC2 701485050 NLLYIFSRWHLWNK-UHFFFAOYSA-N 168.156 -1.121 50 10 AAGE NNC(=O)[C@@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 1346319516 KVQXNHOBPWMUMW-CRBZEHORSA-N 195.222 -1.109 50 10 AAGE C[C@@H](F)[C@H](N)C(=O)NN 1879975826 QOOVEXMLZOVSCW-GBXIJSLDSA-N 135.142 -1.338 50 10 AAGE CC1(NC(=O)NN)COC1 1880067561 XFDYKWWTALSCMR-UHFFFAOYSA-N 145.162 -1.052 50 10 AAGE OB(O)CNCc1cc[nH]n1 1923803733 ANRXJESTJAAFDN-UHFFFAOYSA-N 154.966 -1.489 50 10 AAGE CNc1nonc1C(=O)NN 1923852694 NVVFQIHHCIUADW-UHFFFAOYSA-N 157.133 -1.285 50 10 AAGE CN(C)C[C@H](N)[C@H](O)C#N 1952793716 MIKKIMJMARBMCB-NTSWFWBYSA-N 143.190 -1.240 50 10 AAGE C=CCNC(=O)c1ccoc1B(O)O 2241468844 VTDHKXBVYDPNKM-UHFFFAOYSA-N 194.983 -1.125 50 10 AAGE CCN(O)C(=O)c1occc1B(O)O 2241473541 MGMHSMPWHOOFKQ-UHFFFAOYSA-N 198.971 -1.189 50 10 AAGE C[C@H]1COC[C@@H]1NC(=O)C#CB(O)O 2241478619 JAOWKWWEIPXBBN-BQBZGAKWSA-N 196.999 -1.847 50 10 AAGE CC1(N)CN(C(=O)[C@H]2C[C@H]2B(O)O)C1 2241481117 OWRAGAOKVPMLPJ-NTSWFWBYSA-N 198.031 -1.591 50 10 AAGE N#CNc1ccnc(B(O)O)c1 2241558566 HLNVGPLGRQRNEE-UHFFFAOYSA-N 162.945 -1.346 50 10 AAGE C[C@H](O)[C@]1(O)C=C[C@](O)(C#N)[C@@H]1O 85643186 HGQUNQCSXPPEAJ-DKXJUACHSA-N 185.179 -1.716 50 10 AAGE NNC(=O)n1ccnn1 146060528 GSITWRKAAARBGV-UHFFFAOYSA-N 127.107 -1.291 50 10 AAGE CN(C)NC(=O)NC[C@@H](O)C(=O)O 149039861 JMKNCAHCXZPPAI-SCSAIBSYSA-N 191.187 -1.792 50 10 AAGE COc1ncc(C#N)cc1B(O)O 200996407 IVQRJPCEJUPSMX-UHFFFAOYSA-N 177.956 -1.358 50 10 AAGE Nc1nccc(B(O)O)c1Cl 205043322 OUYNSNVKRVETHC-UHFFFAOYSA-N 172.380 -1.003 50 10 AAGE N[C@@H](C/C=C\B(O)O)C(=O)O 216441220 OUJIGNMQBCCYRL-HNHRSYQESA-N 158.950 -1.643 50 10 AAGE C[C@H](C(=O)NN)c1n[nH]c(N)nc1=O 238416918 QCXOGXDHGKWGCO-REOHCLBHSA-N 198.186 -2.160 50 10 AAGE NNC(=O)CNC(=O)Cc1ccco1 238657384 RHMMSQFHICZJBO-UHFFFAOYSA-N 197.194 -1.072 50 10 AAGE NNC(=O)NC(C(N)=O)C(N)=O 695353025 YWBPVBRAGQTMLM-UHFFFAOYSA-N 175.148 -3.502 50 10 AAGE NNC(=O)[C@@H]1NC[C@H]2C[C@@H]21 705882757 VUIRTBXIXLNYNT-MROZADKFSA-N 141.174 -1.416 50 10 AAGE CC1(S(=O)(=O)NCB(O)O)CC1 706420204 SWVXVYQKFBLVKB-UHFFFAOYSA-N 193.033 -1.530 50 10 AAGE Cn1c(C(=O)NN)cnc1CN 1880797792 UDJIWBVSRCTLPY-UHFFFAOYSA-N 169.188 -1.518 50 10 AAGE C[C@H]1[C@@H](O)CN1CCC(=O)NN 1880906882 JSRZSEQAETTZNX-WDSKDSINSA-N 173.216 -1.569 50 10 AAGE O=C(NNCCO)c1c[nH]ccc1=O 1929834187 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CN1CC[C@H](C(=O)NN)S1(=O)=O 1923870495 DALIAJFURSKLQI-SCSAIBSYSA-N 193.228 -1.990 50 10 AAGE N#CCSCC(=O)NNCCO 1929835054 MBLQMLIPYQSPLG-UHFFFAOYSA-N 189.240 -1.144 50 10 AAGE NNC(=O)C(=O)N[C@H]1C[C@@H]2CC[C@H]1O2 1935285085 URLCYCYCPADVKM-HCWXCVPCSA-N 199.210 -1.588 50 10 AAGE C[C@H]1CN[C@H](C(=O)NN(C)C)CO1 1954886690 DYYALVVRRBZNPT-BQBZGAKWSA-N 187.243 -1.044 50 10 AAGE N#CNCc1cccc(B(O)O)c1 2241554520 DENQBEXDSKGNRM-UHFFFAOYSA-N 175.984 -1.063 50 10 AAGE NNC(=O)c1nccn1O 106360023 RFZZRKJEGWIAKP-UHFFFAOYSA-N 142.118 -1.276 50 10 AAGE O=C(O)CC(=O)OC(=O)C(=O)O 114843123 YVTGTVLZEHVJSM-UHFFFAOYSA-N 176.080 -1.385 50 10 AAGE NNC(=O)C1CS(=O)(=O)C1 212182340 KJSFJHAZCTVXJS-UHFFFAOYSA-N 164.186 -1.979 50 10 AAGE COc1nccc(B(O)O)c1O 238422332 DYXLDFRSLMUCFY-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE O=C1C[C@@](O)(C(=O)O)[C@@H](Cl)C1=O 238677053 MFJVJGSAEJIZEH-NJGYIYPDSA-N 192.554 -1.049 50 10 AAGE C[C@H]1OCCN[C@@H]1C(=O)NN 307307828 NIDIHNNXBZHZIE-UHNVWZDZSA-N 159.189 -1.647 50 10 AAGE CC(=O)NN=Cc1nnn(C)n1 388485174 YYPBPIYQIXAXIK-UHFFFAOYSA-N 168.160 -1.320 50 10 AAGE CN(CCO)CCN(C)C(=O)NN 691313847 MPJSZZQXQUHJOT-UHFFFAOYSA-N 190.247 -1.574 50 10 AAGE CSCCNCC(=O)NN 696878606 LEZMCADYRQVAHY-UHFFFAOYSA-N 163.246 -1.071 50 10 AAGE NNC(=O)C(=O)N[C@]12COC[C@H]1C2 717977240 UMADTHMMZNHRKF-CLZZGJSISA-N 185.183 -2.119 50 10 AAGE C=C(CN1CCN(C)[C@@H]2C[C@H]21)B(O)O 1895096510 DGCNCVVHCRMRHK-RKDXNWHRSA-N 196.059 -1.057 50 10 AAGE NNC(=O)N1CC[C@](F)(CO)C1 1917087451 OLRNQAXZNVAYJD-ZCFIWIBFSA-N 177.179 -1.024 50 10 AAGE C[C@@]1(O)CON(C(=O)C(=O)NN)C1 1930291475 MDYAJGVMRSONNP-LURJTMIESA-N 189.171 -2.499 50 10 AAGE O=CNc1ncc(B(O)O)cn1 2209028882 TYTSJIIAIZIEOS-UHFFFAOYSA-N 166.933 -2.275 50 10 AAGE CC(C)[C@H](CO)NC(=O)C#CB(O)O 2241468251 KFHDYVMUGJENJJ-ZETCQYMHSA-N 199.015 -1.865 50 10 AAGE C#CCN(CC)C(=O)C#CB(O)O 2241476254 OPIAYMXKDXBVQI-UHFFFAOYSA-N 178.984 -1.517 50 10 AAGE O=C(C#CB(O)O)N1CC=C[C@H]1CF 2241479051 QNJUQCCWNZQSFM-ZETCQYMHSA-N 196.974 -1.262 50 10 AAGE O=C(NC[C@@H]1CCO1)C1(B(O)O)CC1 2241481224 QLMGANFDVFLGJU-LURJTMIESA-N 199.015 -1.102 50 10 AAGE CN(CCO)C(=O)[C@H]1C[C@@H]1B(O)O 2241495064 GMCYKNCWHDITNY-WDSKDSINSA-N 187.004 -1.700 50 10 AAGE O=CN[C@@H]1CCC=C1B(O)O 2241556672 ZPZOPTVOVUZZBS-ZCFIWIBFSA-N 154.962 -1.167 50 10 AAGE NC(=S)NNC(=O)[C@H]1CCOC1 83590877 UXCHULOXQIOBMB-BYPYZUCNSA-N 189.240 -1.113 50 10 AAGE COCC(=O)NN/C(N)=C\C#N 138697181 MNPLIOBHVYZLTP-DJWKRKHSSA-N 170.172 -1.423 50 10 AAGE NNC(=O)NCc1ncon1 231840912 FCNOOWWGFKBFIQ-UHFFFAOYSA-N 157.133 -1.258 50 10 AAGE O=C(Cl)CN1C(=O)C[C@H](O)C1=O 238722903 QPECJIPQPAHBLD-VKHMYHEASA-N 191.570 -1.128 50 10 AAGE C[C@H](C(=O)NN)N1CCN2CC[C@H]1C2 307435228 PWTFPYJTBRTOBW-SFYZADRCSA-N 198.270 -1.245 50 10 AAGE CC(=O)NNC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-] 307527188 SANBGVJOTCUXSG-UHNVWZDZSA-N 187.155 -1.181 50 10 AAGE CN(NC(=O)CN1CCC1)C(N)=O 308270608 RTTLSHFYPJBHAO-UHFFFAOYSA-N 186.215 -1.266 50 10 AAGE C[C@H]1COC[C@H]1C(=O)NNC(N)=O 606259127 PDIMNGNJBMJJNH-CRCLSJGQSA-N 187.199 -1.032 50 10 AAGE Cc1cnc(C(=O)NCB(O)O)cn1 702023860 SYGSQZLSPWPQHA-UHFFFAOYSA-N 194.987 -1.473 50 10 AAGE C[C@H](OCCn1cncn1)C(=O)NN 1886294479 RSEICUHTAJSLJY-LURJTMIESA-N 199.214 -1.327 50 10 AAGE Cn1cnc(B(O)O)c1C(=O)NO 1887429983 CFZKCRCKGCKYJE-UHFFFAOYSA-N 184.948 -2.781 50 10 AAGE CN1CC2(C1)CN(CCC(=O)NN)C2 1932060573 IUZMCRABRBSVRO-UHFFFAOYSA-N 198.270 -1.386 50 10 AAGE NNC(=O)COC[C@H]1COCCO1 1933320045 NPEOSIICVWMMHB-ZCFIWIBFSA-N 190.199 -1.592 50 10 AAGE NC(=O)C1(O)CN(CCCl)C1 1953287082 AKBFPLNZQNSRQW-UHFFFAOYSA-N 178.619 -1.243 50 10 AAGE C[C@@H](O)CNCC(=O)NN 58838359 ZIBNLZDIFXBOAD-SCSAIBSYSA-N 147.178 -2.053 50 10 AAGE N=C(N)NNC(=O)/C=C\C(=O)O 59606999 VASJSXOERUPPSJ-UPHRSURJSA-N 172.144 -1.859 50 10 AAGE CC(=O)NNC(=O)c1cn[nH]c1N 168418832 JDPLHMBDLLSFLQ-UHFFFAOYSA-N 183.171 -1.227 50 10 AAGE COc1cc(B(O)O)cc(C#N)n1 206085975 UPIIJSQQYUJJQD-UHFFFAOYSA-N 177.956 -1.358 50 10 AAGE COc1nccc(C#N)c1B(O)O 238422565 KBRLCWVXHBSZPK-UHFFFAOYSA-N 177.956 -1.358 50 10 AAGE Cc1nccc(B(O)O)c1O 238487563 XZWIHZRIEUOHOA-UHFFFAOYSA-N 152.946 -1.225 50 10 AAGE OB(O)c1ccnc(O)c1F 238630250 YIQHDCSOVXBNIQ-UHFFFAOYSA-N 156.909 -1.394 50 10 AAGE OCc1cc(F)c(B(O)O)cn1 238720683 UHGAUOFTUSJZTL-UHFFFAOYSA-N 170.936 -1.607 50 10 AAGE COC(=O)NNC(=O)N1CC(O)C1 306519529 CVBDNIHXLWAEDS-UHFFFAOYSA-N 189.171 -1.357 50 10 AAGE NNC(=O)C(=O)NC[C@H]1C[C@H]1CF 1883126954 DQJCKWGDRHJFBR-CRCLSJGQSA-N 189.190 -1.302 50 10 AAGE CN(CC(=O)NN)C[C@@H]1[C@@H]2CCO[C@H]21 1884453085 SPJQWVQZEFGWKM-LKEWCRSYSA-N 199.254 -1.057 50 10 AAGE NCC12CC(C1)[C@@H](C(=O)NN)CO2 1891753821 YNFPSCMQNVREMB-PIJYJLRNSA-N 185.227 -1.270 50 10 AAGE C[C@](N)(CCS(C)(=O)=O)B(O)O 1953514614 IKKYFMDEMYJAON-YFKPBYRVSA-N 195.049 -1.850 50 10 AAGE NC[C@@]12CC[C@@](C(=O)NN)(CO1)C2 1954529793 PXLUKOOHFUYQRZ-YUMQZZPRSA-N 185.227 -1.126 50 10 AAGE N[C@@H]1CC[C@H]1NC(=O)C1(B(O)O)CC1 2241474096 WLEZQTJGBYSXSA-PHDIDXHHSA-N 198.031 -1.401 50 10 AAGE O=C(C#CB(O)O)N1CCO[C@H]2C[C@@H]21 2241476191 NHAYKYJEVQBRBF-BQBZGAKWSA-N 194.983 -1.999 50 10 AAGE C=C(CS(=O)(=O)N(C)O)B(O)O 2241481608 ULPCLTBIDLWFIR-UHFFFAOYSA-N 195.005 -1.795 50 10 AAGE COc1cccc(B(O)O)c1C(N)=O 2241495541 KKBAWYUQNXOUJC-UHFFFAOYSA-N 194.983 -1.526 50 10 AAGE C[C@H](O)CC(=O)NCCC#CB(O)O 2241910911 XXPSGYSGEWNMEW-ZETCQYMHSA-N 199.015 -1.721 50 10 AAGE C[C@@H](NC(=O)NN)C(=O)N(C)C 42576283 NKJXZGANQIEYCF-SCSAIBSYSA-N 174.204 -1.364 50 10 AAGE O=C1N=CC=C[C@H]1B(O)O 211596101 PECBZXJWNKNHRH-SCSAIBSYSA-N 138.919 -1.003 50 10 AAGE NNC(=O)c1coc(N)n1 238562690 SDVXCZKGTXCHNP-UHFFFAOYSA-N 142.118 -1.140 50 10 AAGE NNC(=O)C[C@@H]1COC(=O)C1 306482439 GLWKKVYALRMCKK-BYPYZUCNSA-N 158.157 -1.071 50 10 AAGE OB(O)c1ccsn1 306706711 MDXHZTOQQXONRB-UHFFFAOYSA-N 128.949 -1.177 50 10 AAGE C[C@@H]1CC(=O)N[C@H](C(=O)NN)C1 306738002 ABXFNKMVPMVLMF-WHFBIAKZSA-N 171.200 -1.109 50 10 AAGE NNC(=O)C1C[C@@H](O)C(O)[C@H](O)C1 306993892 LZUWSBBZPIKWMQ-WATOWXBHSA-N 190.199 -2.531 50 10 AAGE O[C@H]1[C@H](Cl)[C@@H]2O[C@@H]2[C@H](O)[C@@H]2O[C@@H]21 307470919 WFGOXUXPFAZWNB-STBREBJPSA-N 192.598 -1.136 50 10 AAGE CN(CC(=O)NN)c1cnccn1 307530078 MAMWGOSYWTVWBX-UHFFFAOYSA-N 181.199 -1.097 50 10 AAGE CN(CC[S@](C)=O)C(=O)NN 307656081 PMMVRMISRSBHQP-NSHDSACASA-N 179.245 -1.120 50 10 AAGE CC(=O)Nc1cncc(B(O)O)c1 307697226 GCFOJLZETURFGL-UHFFFAOYSA-N 179.972 -1.280 50 10 AAGE O=C(C[C@H]1CCOC1)NCB(O)O 701961290 UUEMAPUBZGHLEA-ZCFIWIBFSA-N 187.004 -1.459 50 10 AAGE C[C@H]1C[C@H](C(=O)NCB(O)O)CO1 702028839 HPGGONVLOAYLOF-WDSKDSINSA-N 187.004 -1.460 50 10 AAGE CN(C)NC(=O)[C@H]1CO[C@@H](CN)C1 713837994 PMSRXWGTZKNUBI-RNFRBKRXSA-N 187.243 -1.057 50 10 AAGE C=CCn1cc(B(O)O)ccc1=O 1882116135 TUHFTZCCPFSOLP-UHFFFAOYSA-N 178.984 -1.286 50 10 AAGE C[C@@H](C(=O)NN)N1[C@@H]2COC[C@H]1C2 1883760626 GYLRXJMUJPTCEC-LYFYHCNISA-N 185.227 -1.162 50 10 AAGE O=C(CCO)N1CC[C@@H](B(O)O)C1 1891518258 YQXUGKJABIGPAA-ZCFIWIBFSA-N 187.004 -1.556 50 10 AAGE CN(CC(=O)NN)Cc1nnn(C)n1 1894760172 IYIOBPHYOZGFKJ-UHFFFAOYSA-N 199.218 -2.368 50 10 AAGE C[C@@H]1CC[C@@H]([C@@H](N)C(=O)NN)O1 1953709387 YBCDVCFGIKWHNC-NGJCXOISSA-N 173.216 -1.129 50 10 AAGE C#CCN=c1ncc(B(O)O)c[nH]1 2209387602 KGSUJKYGCCNUMH-UHFFFAOYSA-N 176.972 -2.377 50 10 AAGE O=C(C#CB(O)O)N1CCCCCO1 2241467989 FNFGDOPEADDLMX-UHFFFAOYSA-N 196.999 -1.054 50 10 AAGE C#CC#CCNC(=O)C1(B(O)O)CC1 2241473852 RCUJPPRRCASQNM-UHFFFAOYSA-N 190.995 -1.254 50 10 AAGE O=C(Nc1nn[nH]n1)[C@@H]1C[C@@H]1B(O)O 2241495824 MZERGKLNGMJIDX-GBXIJSLDSA-N 196.963 -1.999 50 10 AAGE O=C(NCCC#CB(O)O)[C@H]1C[C@H]1F 2241909215 WHPIXBAZZSTEGS-NKWVEPMBSA-N 198.990 -1.134 50 10 AAGE OC[C@H]1O[C@@H](O)[C@@H](Cl)[C@@H](O)[C@@H]1O 3870781 SNGNCYILSHZBLM-AIECOIEWSA-N 198.602 -1.975 50 10 AAGE COC[C@H]1CCN(CC(=O)NN)C1 81120958 HTKWWGYUMQPCGP-ZETCQYMHSA-N 187.243 -1.055 50 10 AAGE NC(=O)c1cccc(F)c1B(O)O 196182875 CGDCKDDYXWPCGH-UHFFFAOYSA-N 182.947 -1.396 50 10 AAGE Nc1cc(B(O)O)cc(N)n1 206086594 GXTNTZJHHOSOCS-UHFFFAOYSA-N 152.950 -2.074 50 10 AAGE N#C[C@H](O)[C@@H](N)CO 217405516 FYRPWEWOPQMSFW-IMJSIDKUSA-N 116.120 -1.810 50 10 AAGE CN1N=C(C(=O)NN)CC1=O 238325327 GEAJSINDJXTPTQ-UHFFFAOYSA-N 156.145 -1.806 50 10 AAGE Cc1nccc(CN)c1B(O)O 238489761 MKLZDBDCFFZFED-UHFFFAOYSA-N 165.989 -1.471 50 10 AAGE CC[C@H](O)C(=O)NNC(C)=O 307293107 OMPNAOGNKYKAOB-YFKPBYRVSA-N 160.173 -1.075 50 10 AAGE NN=CC(=O)NCC(=O)NN 396060752 SIPBJLOWTZHQNU-UHFFFAOYSA-N 159.149 -2.963 50 10 AAGE C#CCOCC(=O)NNC 1880057399 NLOIEBHPUIQWSF-UHFFFAOYSA-N 142.158 -1.113 50 10 AAGE C=C(C)C(=O)NCB(O)O 1953170419 LTSMPXRSFMROAO-UHFFFAOYSA-N 142.951 -1.309 50 10 AAGE N#CNC(=O)c1ncccc1B(O)O 2241474959 NXFASQSFHLNZLI-UHFFFAOYSA-N 190.955 -2.028 50 10 AAGE CCC1(NC(=O)C#CB(O)O)CNC1 2241479527 ZTLQWRGHQOULSJ-UHFFFAOYSA-N 196.015 -2.130 50 10 AAGE O=C(NC1CC1)c1coc(B(O)O)c1 2241481432 SLAFUSPFAJBJIZ-UHFFFAOYSA-N 194.983 -1.148 50 10 AAGE C#C[C@@H](C)NC(=O)[C@H]1C[C@@H]1B(O)O 2241496945 XNRGQFWVNGRACX-VQVTYTSYSA-N 181.000 -1.013 50 10 AAGE CO/C=N/NC(=O)[C@H]1CCC(=O)N1 34449744 MGZUKNHTMRSPGT-XMRNDYPQSA-N 185.183 -1.029 50 10 AAGE CCN(CCOC)CC(=O)NN 58862470 IKJBYWXKADXVGF-UHFFFAOYSA-N 175.232 -1.055 50 10 AAGE CNCCN(C)[C@H](C)CC(=O)NN 69801838 RFSPFDWPRCTTIM-SSDOTTSWSA-N 188.275 -1.094 50 10 AAGE O=C(CS)OC(=O)[C@@H](O)CO 113591332 SSMCNYSQIOJABC-VKHMYHEASA-N 180.181 -1.661 50 10 AAGE NNC(=O)C(=O)NO 138909456 HXHKSDXFNKJKTB-UHFFFAOYSA-N 119.080 -2.518 50 10 AAGE CS(=O)(=O)CC(=O)N=C=O 145214113 XEJGWPNPBOVPED-UHFFFAOYSA-N 163.154 -1.107 50 10 AAGE NNC(=O)C(=O)NCc1cccnn1 236215615 QNGVKBMSDBYHDL-UHFFFAOYSA-N 195.182 -1.917 50 10 AAGE CC(C)NNC(=O)[C@@H](N)[C@H](C)O 238196981 SIDGJGKJWHMEIW-WDSKDSINSA-N 175.232 -1.276 50 10 AAGE OB(O)c1n[nH]c2c1COCC2 238658271 QCCVLUXITSNNFV-UHFFFAOYSA-N 167.961 -1.838 50 10 AAGE CN1C[C@@H](NC(=O)NN)C(=O)N1 306660774 NGETUKNVVFISKF-GSVOUGTGSA-N 173.176 -2.496 50 10 AAGE CNC(=O)Nc1cc(B(O)O)ccn1 405156684 XGYFYJWRWQARIK-UHFFFAOYSA-N 194.987 -1.487 50 10 AAGE CNNC(=O)[C@@H]1CCC(=O)NC1 575557536 GGZNBJBKDHQBED-RXMQYKEDSA-N 171.200 -1.237 50 10 AAGE NNC(=O)[C@H]1CSC(=O)N1 575567642 VYXDIUWUZXCVRA-UWTATZPHSA-N 161.186 -1.199 50 10 AAGE CCOCCn1cc(B(O)O)cn1 694487544 NEFMRCSBPWUUTI-UHFFFAOYSA-N 184.004 -1.401 50 10 AAGE CNNC(=O)CCSCC(N)=O 704609828 XNGGUPAQUZMASM-UHFFFAOYSA-N 191.256 -1.154 50 10 AAGE NNC(=O)N1C[C@@H](CO)[C@H](CO)C1 704800297 CEBKIPDQOAISFL-WDSKDSINSA-N 189.215 -1.898 50 10 AAGE CO[C@H]1C[C@@H]1NC(=O)NN 1880065850 ZSOVYDSPAHLRAN-IMJSIDKUSA-N 145.162 -1.053 50 10 AAGE C[C@H](O)[C@H]1CCN1CC(=O)NN 1880869669 ZFWGWQPMBBGNRB-NTSWFWBYSA-N 173.216 -1.569 50 10 AAGE NNC(=O)C(=O)N1CC=CC[C@H]1CO 1884400016 OATBUTPEVQLMCG-LURJTMIESA-N 199.210 -1.874 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H]2C[C@H](O)[C@H]2C1 1931412485 JEVUDIYIMUOKIR-KVPKETBZSA-N 199.254 -1.323 50 10 AAGE NNC(=O)CN1C[C@H]2CO[C@@H](C2)C1 1932136704 YAGDMCCKXRURPW-BQBZGAKWSA-N 185.227 -1.303 50 10 AAGE NNC(=O)NC1CN(C2COC2)C1 1954036468 DGTXDYHNDMXXQQ-UHFFFAOYSA-N 186.215 -1.758 50 10 AAGE CNNC(=O)[C@@H]1CO[C@@H]2COC[C@H]21 1954357620 OZPIEGGWXRNQIA-RRKCRQDMSA-N 186.211 -1.102 50 10 AAGE CN(CC1(F)CC1)C(=O)C#CB(O)O 2241468010 FVRRQCUCYJDGRS-UHFFFAOYSA-N 198.990 -1.038 50 10 AAGE Cc1cc(B(O)O)ccc1C(=O)NN 2241478891 MYNZYDHKINLTAF-UHFFFAOYSA-N 193.999 -1.722 50 10 AAGE O=C(NC1CC1)c1cc(B(O)O)co1 2241752396 QNSAFKFHWGWEBD-UHFFFAOYSA-N 194.983 -1.148 50 10 AAGE N[C@@H](C(=O)O)[C@H](O)CCl 5132001 CETUIFTXYGHITB-PWNYCUMCSA-N 153.565 -1.002 50 10 AAGE in-vitro CCCNC(=O)CNC(=O)NN 36781345 IWTHKFUWGAUVMA-UHFFFAOYSA-N 174.204 -1.315 50 10 AAGE COC(=O)/C(C#N)=C(/N)CC(N)=O 75576199 QMCAKTQROCYYDG-SNAWJCMRSA-N 183.167 -1.229 50 10 AAGE C=NNC(=O)NC(N)=O 104645255 CANTVTZSTGQSSJ-UHFFFAOYSA-N 130.107 -1.020 50 10 AAGE COCC(=O)NN/C(N)=C/C#N 209855006 MNPLIOBHVYZLTP-GORDUTHDSA-N 170.172 -1.423 50 10 AAGE C[C@H](C(=O)NN)N1CC[C@@](C)(O)C1 235190187 FIXUBZLSZLYTPZ-HTRCEHHLSA-N 187.243 -1.179 50 10 AAGE CO[C@@H](C)C(=O)NNC=O 306475292 QWIMFEPLPOBUMD-BYPYZUCNSA-N 146.146 -1.202 50 10 AAGE C/C(=N\NC(N)=O)c1n[nH][nH]c1=O 306746843 DNIGCZZPWIYVEF-FARCUNLSSA-N 184.159 -1.510 50 10 AAGE O[C@H](CCl)[C@H]1OC[C@@H](O)[C@H]1O 307272646 UTWZPOKVDCHNES-KVTDHHQDSA-N 182.603 -1.293 50 10 AAGE C[C@H]1CN(CCC(=O)NN)C[C@H]1O 307589657 AVPXVNPTNKTVSN-NKWVEPMBSA-N 187.243 -1.321 50 10 AAGE CCOCC(=O)NNC(=O)C(N)=O 379369009 ZUKFOCVIDTYRME-UHFFFAOYSA-N 189.171 -2.344 50 10 AAGE NC(=O)NNC(=O)c1cnc(O)[nH]1 575450957 ANCVWBSDCKUCAZ-UHFFFAOYSA-N 185.143 -1.572 50 10 AAGE C[C@H]1COC[C@H]1NC(=O)C(=O)NN 575485368 NQVDNPVUFBXBAU-CRCLSJGQSA-N 187.199 -1.873 50 10 AAGE Cc1oncc1C(=O)NCB(O)O 701961954 ZQTIVTFHEBFUIU-UHFFFAOYSA-N 183.960 -1.275 50 10 AAGE NNC(=O)CCN1C[C@H]2C[C@H]2C1=O 715706371 ZNXJSZZWMLZAOX-PHDIDXHHSA-N 183.211 -1.155 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2C[C@@]2(CO)C1 1899623120 UNOYXMNUMRBIJR-XRGYYRRGSA-N 199.210 -2.183 50 10 AAGE CN(C)NC(=O)[C@@H]1CCNO1 1932846292 USSCJJAVDNMSKD-YFKPBYRVSA-N 159.189 -1.127 50 10 AAGE COC[C@H](N)[C@H](O)C#N 1952793936 MYDIZXNGUIEGTI-CRCLSJGQSA-N 130.147 -1.155 50 10 AAGE CO[C@H](C)[C@H](N)CC(=O)NN 1953299961 JFZHCUFDWJCWIM-RFZPGFLSSA-N 161.205 -1.271 50 10 AAGE O=C(C#CB(O)O)NC1(CO)CNC1 2241469084 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PQLKBZUFHYXESH-DMTCNVIQSA-N 162.168 -1.531 50 10 AAGE NNC(=O)N1C[C@H](O)C(F)(F)C1 1931821768 ZBLUBWZWOXYTRA-VKHMYHEASA-N 181.142 -1.119 50 10 AAGE O[C@@H](CCl)CN1C[C@@H](O)[C@H](O)C1 1934316379 OBNCKRPKADTZHT-RRKCRQDMSA-N 195.646 -1.377 50 10 AAGE Cn1cc([C@@H](N)C(=O)NN)nn1 1953375122 GESWSADKGSEPPR-SCSAIBSYSA-N 170.176 -2.195 50 10 AAGE C[C@]1(CO)C=CCN1C(=O)C(=O)NN 2209891726 VXOBEZHYXWUOKJ-MRVPVSSYSA-N 199.210 -1.874 50 10 AAGE C#C[C@H](C)Nc1ncc(B(O)O)cn1 2210061168 RBNKLVJMIRZBEJ-LURJTMIESA-N 190.999 -1.410 50 10 AAGE CNNC(=O)[C@H](C)CO 2241248432 YYMYIQCMARRTPD-SCSAIBSYSA-N 132.163 -1.135 50 10 AAGE N#CC(C#N)=C1C(=O)NC(=O)NC1=O 14944562 ROKDPRGNTRBMOO-UHFFFAOYSA-N 190.118 -1.304 50 10 AAGE OCC(CO)(CO)NCCCCl 58854644 WLHRNRGYYPDIMR-UHFFFAOYSA-N 197.662 -1.079 50 10 AAGE NNC(=O)CCN1CCC[C@H]1CO 82470205 AQSAABMNPPQHHF-ZETCQYMHSA-N 187.243 -1.177 50 10 AAGE CC(=O)N/N=C(/C(C)=O)C(N)=O 238145191 ZHHPQHSSDRKOAJ-UITAMQMPSA-N 171.156 -1.447 50 10 AAGE OB(O)c1ccn(C2CC2)n1 238650894 JUMSZWUOAQVBSY-UHFFFAOYSA-N 151.962 -1.102 50 10 AAGE OC[C@H](O)[C@@H](O)[C@@H](Cl)CO 238710431 KWMWIVMWKJNWIY-YUPRTTJUSA-N 170.592 -1.700 50 10 AAGE COC(=O)c1ccc(B(O)O)c(O)c1 306625848 HDGBPECWZJUKKF-UHFFFAOYSA-N 195.967 -1.141 50 10 AAGE N#CC1=C[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O 307625373 SQZYGIJVCRCCSR-VZFHVOOUSA-N 171.152 -2.106 50 10 AAGE COCC(=O)NN[C@H](C)C(=O)OC 379392242 RLGGXGPAUKAOSS-RXMQYKEDSA-N 190.199 -1.185 50 10 AAGE CCOCCCn1cc(B(O)O)cn1 694534320 CWDLILLXNLVLSK-UHFFFAOYSA-N 198.031 -1.011 50 10 AAGE NC[C@@H]1CC(C(=O)NN)=NO1 1333634695 BLBZDVILQQUASF-VKHMYHEASA-N 158.161 -1.920 50 10 AAGE COCC1(O)CC(C(=O)NN)C1 1892557349 OCTDVPDEKZJJPH-UHFFFAOYSA-N 174.200 -1.236 50 10 AAGE CN(C(=O)NN)C1COC1 1915647694 UAXZWSOLPIAYFD-UHFFFAOYSA-N 145.162 -1.100 50 10 AAGE NNC(=O)[C@@H]1[C@H]2CCCN[C@H]21 1931111388 GGJCKSYQXJOQLM-HSUXUTPPSA-N 155.201 -1.026 50 10 AAGE C[C@H]1C[C@]1(CN)C(=O)NN 1935439071 RXEYRKFGTYCADT-UJURSFKZSA-N 143.190 -1.039 50 10 AAGE C[C@H]1CN(C(=O)C#CB(O)O)[C@H]1C 2241468895 WPKBJWHQWIHSSR-BQBZGAKWSA-N 181.000 -1.131 50 10 AAGE CN(O)C(=O)c1coc(B(O)O)c1 2241471767 MJZWOWXFBIDPNU-UHFFFAOYSA-N 184.944 -1.579 50 10 AAGE COC(=O)c1nn(C)c(B(O)O)c1C 2241492094 ALQBTUCQZXHZNF-UHFFFAOYSA-N 197.987 -1.805 50 10 AAGE O=C(O)C#CCNC(=O)C#CB(O)O 2241583790 DJKGMPGDCMFSLG-UHFFFAOYSA-N 194.939 -2.794 50 10 AAGE Cc1nn(C)c(C(=O)NO)c1B(O)O 2241583831 FDKVZLVGCOOXLW-UHFFFAOYSA-N 198.975 -2.473 50 10 AAGE NNC(=O)/C=C\C=C/C(=O)NN 143390815 ODXKSNWISLHFPE-CCAGOZQPSA-N 170.172 -1.921 50 10 AAGE CC(=O)c1c[nH]cc(B(O)O)c1=O 206093695 CJWKJNAVLWTPLK-UHFFFAOYSA-N 180.956 -1.743 50 10 AAGE COC(=O)c1ncc(B(O)O)cc1C 238355268 XLFJNBMENHGVSC-UHFFFAOYSA-N 194.983 -1.144 50 10 AAGE NNC(=O)N1CC[C@@H](CC(N)=O)C1 690741252 UQFUCMHBHDHKJE-YFKPBYRVSA-N 186.215 -1.233 50 10 AAGE N[C@]1(B(O)O)[C@H]2[C@@H]3C[C@@H]4[C@H]([C@H]23)[C@@H]41 1881644058 JHMQKRGXJAWQCK-CMGPJRFPSA-N 165.001 -1.162 50 10 AAGE CN1C(=O)NCC12CN(C(=O)NN)C2 1884975138 GPLGXFUKPCSJDD-UHFFFAOYSA-N 199.214 -1.721 50 10 AAGE CN(CC(=O)NN)[C@@H]1CN2CC[C@H]1C2 1955296118 RRLTVEGQDRNZLW-JGVFFNPUSA-N 198.270 -1.388 50 10 AAGE C=C(C)CN=c1ncc(B(O)O)c[nH]1 2210059715 BSJLIXBMHCCODH-UHFFFAOYSA-N 193.015 -1.434 50 10 AAGE OB(O)c1ccc(NC2CNC2)nc1 2210059898 DJOIORFAVRUIJC-UHFFFAOYSA-N 193.015 -1.855 50 10 AAGE C#C[C@H](NC(=O)C#CB(O)O)C1CC1 2241469009 YPMRHJDGZPFZJQ-QMMMGPOBSA-N 190.995 -1.470 50 10 AAGE C#CCN(CCC)C(=O)C#CB(O)O 2241475653 BWOGUSBMPOBARD-UHFFFAOYSA-N 193.011 -1.126 50 10 AAGE CC1=CCN(C(=O)C#CB(O)O)C1 2241479070 QTVPJVYREDCUIG-UHFFFAOYSA-N 178.984 -1.210 50 10 AAGE NCC(=O)NNCc1c[nH]cn1 39136855 ODEXLRNDFXOTJO-UHFFFAOYSA-N 169.188 -1.511 50 10 AAGE COC(=O)CS(=O)(=O)N=C=O 157724097 VBPYXEDCBRUFAO-UHFFFAOYSA-N 179.153 -1.175 50 10 AAGE C[C@H](O)[C@H]1CCN(CC(=O)NN)C1 159485095 NEAMEWTVPSIXQM-BQBZGAKWSA-N 187.243 -1.321 50 10 AAGE COC(=O)c1cc(B(O)O)c[nH]1 206164437 MBBQSFNMAITXKM-UHFFFAOYSA-N 168.945 -1.519 50 10 AAGE NNC(=O)[C@H]1CCC[C@H]1NC(N)=O 238556564 XBWHVEXADAFBAO-CRCLSJGQSA-N 186.215 -1.187 50 10 AAGE NC(=O)NN[C@H]1N=CN=C1C(N)=O 306228427 FPDDCPHSMLBIIK-SCSAIBSYSA-N 184.159 -2.546 50 10 AAGE CCNNC(=O)[C@@H]1COCCN1 306496704 FCKRGABMVUFTIJ-LURJTMIESA-N 173.216 -1.385 50 10 AAGE NNC(=O)c1nnsc1N 307694290 WBAHMZVUISUCRJ-UHFFFAOYSA-N 159.174 -1.276 50 10 AAGE C[C@@H](O)[C@@H]1CCCN1CC(=O)NN 1883278842 OGDWUHHVACHPOP-RQJHMYQMSA-N 187.243 -1.179 50 10 AAGE NNC(=O)[C@@H]1CN[C@H]2C[C@H]21 1923215715 GIKOVJFYGLEFGF-LMVFSUKVSA-N 141.174 -1.416 50 10 AAGE CO[C@H]1CNC[C@@H](C(=O)NN)C1 1934671852 QLWPRYKVXHNCKV-NTSWFWBYSA-N 173.216 -1.399 50 10 AAGE CN(CCF)c1ncc(B(O)O)cn1 1956956838 DZHVFRISDPEVLB-UHFFFAOYSA-N 198.994 -1.438 50 10 AAGE O=C(c1cc(B(O)O)n[nH]1)N1CCC1 2241474866 MISJOMLGJBJNBE-UHFFFAOYSA-N 194.987 -2.065 50 10 AAGE Cc1nc(C)n(CC(=O)NN)n1 58851774 QFSDRIPBGLCJJP-UHFFFAOYSA-N 169.188 -1.115 50 10 AAGE C[C@@H](C(=O)NN)N1CC[C@H](O)C1 82471127 NEXCQCLHJBHROB-WDSKDSINSA-N 173.216 -1.569 50 10 AAGE NNC(=O)NCCC[C@@H](N)C(=O)O 217917264 LPUBHSFTABCRSV-SCSAIBSYSA-N 190.203 -1.649 50 10 AAGE OB(O)c1cnc2ncoc2c1 238656737 WUGFSZDUVJJMKV-UHFFFAOYSA-N 163.929 -1.097 50 10 AAGE NNC(=O)C(=O)N[C@H]1C[C@@H]1C1CC1 717085381 SIWDSIJIFAPSHQ-RITPCOANSA-N 183.211 -1.109 50 10 AAGE C=CN=C(CCC(=O)NN)NN 1615166863 SMLMGAGWLZNLAD-UHFFFAOYSA-N 171.204 -1.238 50 10 AAGE COCCOC[C@@H](N)[C@H](O)C#N 1952813524 HVYRQEAOMOLDPP-RNFRBKRXSA-N 174.200 -1.139 50 10 AAGE CCN(C(=O)NN)[C@H]1CCNC1=O 1954036754 JWGULXYIMRMMEZ-YFKPBYRVSA-N 186.215 -1.220 50 10 AAGE CCOc1c(B(O)O)cnn1C 2059940065 FBOLVDWKFULYJR-UHFFFAOYSA-N 169.977 -1.501 50 10 AAGE NNC(=O)c1cc(B(O)O)co1 2241758867 ZPQWBFKVHGPVOQ-UHFFFAOYSA-N 169.933 -2.437 50 10 AAGE NC[C@H]1CC[C@H](C(=O)NN)O1 87047521 DXVDVAQASGWTTB-RFZPGFLSSA-N 159.189 -1.517 50 10 AAGE O=Cc1cc(B(O)O)c[nH]c1=O 206094452 POKNHCZIRBRLBL-UHFFFAOYSA-N 166.929 -2.133 50 10 AAGE CC(=O)c1ncc(B(O)O)cc1N 238157672 AVYPMXWGKVVIJJ-UHFFFAOYSA-N 179.972 -1.454 50 10 AAGE COc1ncc(B(O)O)cc1O 238397789 CRCYPIQIRUETBY-UHFFFAOYSA-N 168.945 -1.524 50 10 AAGE N#CC1=CC(=O)N(CC(=O)O)C1=O 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N[C@H]1C[C@@H]1NC(=O)[C@H]1C[C@@H](B(O)O)C1 2241475425 XKVAKBBMOAWJSY-VZFHVOOUSA-N 198.031 -1.545 50 10 AAGE CO[C@@H]1C[C@@H]1CNC(=O)C#CB(O)O 2241479362 WQKWYZWVZCNDTM-RNFRBKRXSA-N 196.999 -1.847 50 10 AAGE O=C([C@H]1C[C@@H]1B(O)O)N1CCOCC1 2241495559 KQXMDMIVJADUCV-BQBZGAKWSA-N 199.015 -1.292 50 10 AAGE CC(C)N(CC(N)=O)C(=O)NN 42440741 MWJCNJGHDSOTAN-UHFFFAOYSA-N 174.204 -1.235 50 10 AAGE C[C@@H]1COCCN1CC(=O)NN 82467538 VKZLCUMSFPMOQQ-ZCFIWIBFSA-N 173.216 -1.303 50 10 AAGE N#C/C(C(=O)O)=C(\N)CC(N)=O 106765815 NDFKZNWOJRIMHX-ONEGZZNKSA-N 169.140 -1.317 50 10 AAGE CN(C)NC(=O)COC1(C)CNC1 168763256 UVTGVTBGKJOXSJ-UHFFFAOYSA-N 187.243 -1.042 50 10 AAGE OB(O)CCCOCCCB(O)O 198963361 VXCAJHWPXPFZSC-UHFFFAOYSA-N 189.813 -1.271 50 10 AAGE CC(=O)/C(C(N)=O)=C(/N)C#N 225622635 AUXQVFGVGVDLMK-PLNGDYQASA-N 153.141 -1.203 50 10 AAGE N#CCc1cccc(NN)c1B(O)O 306881163 LOUIPDBFRACTHF-UHFFFAOYSA-N 190.999 -1.282 50 10 AAGE NNc1cccc(S)c1B(O)O 307105464 ISVMDRJEQBAMGY-UHFFFAOYSA-N 184.029 -1.059 50 10 AAGE NC(=O)C(=O)NN=C1COC1 307472120 AGNHQIYLOOUUBO-UHFFFAOYSA-N 157.129 -2.026 50 10 AAGE NNC(=O)CN1C[C@H]2COC[C@H]2C1 718159130 IINQGJGSMHVWDK-KNVOCYPGSA-N 185.227 -1.446 50 10 AAGE NNC(=O)N1C[C@@H]2C[C@@]2(CO)C1 1881521130 IMOWECIYCBXLAS-FSPLSTOPSA-N 171.200 -1.116 50 10 AAGE CCCn1cc(B(O)O)ccc1=O 1882115217 JEVFUYYSGIPDEK-UHFFFAOYSA-N 181.000 -1.062 50 10 AAGE C[C@H]1[C@@H](O)CN1[C@H](C)CC(=O)NN 1882447058 OFILUOLWWHFEOP-VQVTYTSYSA-N 187.243 -1.180 50 10 AAGE C[C@H](CC(=O)NN)N1CC=C[C@@H]1CO 1884398276 BWMHPQRMVMWLNR-HTQZYQBOSA-N 199.254 -1.012 50 10 AAGE O=C(C#CB(O)O)N[C@H]1C[C@H](F)C1 1893583126 OZIHWRXGIMVAAI-IZLXSQMJSA-N 184.963 -1.382 50 10 AAGE O=C(NCC=CB(O)O)c1ncc[nH]1 1895574604 PCUDLBKNUQURHV-UHFFFAOYSA-N 194.987 -1.292 50 10 AAGE C[C@@H](CC(=O)NN)N1CC[C@H]1CO 1929740818 MPUGBTLVCUDAQS-BQBZGAKWSA-N 187.243 -1.179 50 10 AAGE CO[C@H]1COC[C@H]1CNC(=O)NN 1933426293 DPNMPBJAFCKJOB-RITPCOANSA-N 189.215 -1.179 50 10 AAGE O=C(CO)NCC#CB(O)O 2241562759 SVIWOHXQDQRALH-UHFFFAOYSA-N 156.934 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196.999 -2.159 50 10 AAGE Cn1nc([C@H](N)[C@H](O)C#N)ccc1=O 1953021871 QEIXGIQGFTVLBA-SVRRBLITSA-N 194.194 -1.335 50 10 AAGE CN(C)NC(=O)c1c[nH]c(=O)cn1 1953832407 YDXKSQOXYGXASR-UHFFFAOYSA-N 182.183 -1.024 50 10 AAGE NNC(=O)N1C[C@H](O)[C@H]2COC[C@@H]21 1954367769 XSTQNVBWFOWYLW-ZLUOBGJFSA-N 187.199 -1.739 50 10 AAGE CC(C)CONC(=O)C#CB(O)O 2241467844 BUNPOEQHKHERIQ-UHFFFAOYSA-N 184.988 -1.294 50 10 AAGE CON(C)C(=O)c1n[nH]cc1B(O)O 2241481491 SWHQSPLRCZCANK-UHFFFAOYSA-N 198.975 -2.277 50 10 AAGE O=C(CO)NCCC#CB(O)O 2241910631 SEKDVFRUAJDJAV-UHFFFAOYSA-N 170.961 -2.500 50 10 AAGE COC(=O)[C@H](C)NNC(N)=O 39058240 AVCUTBXGRGTRTC-VKHMYHEASA-N 161.161 -1.279 50 10 AAGE C[C@@H](N)C(=O)NNC(=O)C1CC1 49805014 CFLUDKXVCXNJEB-SCSAIBSYSA-N 171.200 -1.109 50 10 AAGE N#CCN(CC#N)CCC(=O)NN 58839514 NKQAGWQAGIRXQW-UHFFFAOYSA-N 181.199 -1.284 50 10 AAGE CN(C)CCNCC(=O)NN 58853436 GMDMVHDWVISZJI-UHFFFAOYSA-N 160.221 -1.873 50 10 AAGE NNC(=O)[C@@H]1Cc2nc[nH]c2CN1 86233460 METTYDIIIXIRJI-YFKPBYRVSA-N 181.199 -1.586 50 10 AAGE NNC(=O)CN1CC[C@H](N)C1 203221016 QPDPTBXUKXURBI-YFKPBYRVSA-N 158.205 -1.991 50 10 AAGE COC(=O)/C(C#N)=C1\NCC(=O)N1 210608651 IIUYXCNZPYPQOI-GQCTYLIASA-N 181.151 -1.386 50 10 AAGE N#Cc1cc(N)c(B(O)O)cn1 238612391 QQIITBXTMVLEMR-UHFFFAOYSA-N 162.945 -1.785 50 10 AAGE CN1CC[C@@H](C[C@H](N)C(=O)NN)C1 258975542 IRLFOQNQOAPYKG-BQBZGAKWSA-N 186.259 -1.355 50 10 AAGE CC(=O)NNC(=O)c1c[nH]c(=O)[nH]1 306751940 IBXIBNYZBJWKPV-UHFFFAOYSA-N 184.155 -1.516 50 10 AAGE CC(=O)NNC(=O)N[C@@H](C)CO 307013565 RMDDWEHYDIDMDO-BYPYZUCNSA-N 175.188 -1.283 50 10 AAGE CN(C)NC(=O)C1(CN)COC1 1881068627 HHBYOBLISZVXRL-UHFFFAOYSA-N 173.216 -1.446 50 10 AAGE CN1C[C@@H]2C[C@H]1CN2CC(=O)NN 1882782851 WSAANBGZKJUWCO-BQBZGAKWSA-N 184.243 -1.635 50 10 AAGE NNC(=O)CCN1C[C@H]2C[C@H](O)[C@H]1C2 1884633127 BHVUWWUGCDKFEF-PRJMDXOYSA-N 199.254 -1.179 50 10 AAGE O=C(NNCCO)c1ccncn1 1929832896 AEQHFMSNOQCMKJ-UHFFFAOYSA-N 182.183 -1.297 50 10 AAGE C[C@@H](N)COCC(=O)NN 1953173807 PVHDJXCGHIBDPO-SCSAIBSYSA-N 147.178 -1.660 50 10 AAGE CN(C)NC(=O)CC[C@H](O)CN 1953357028 UZGRBWWTCLESEA-LURJTMIESA-N 175.232 -1.321 50 10 AAGE CCN1CCC[C@@](N)(B(O)O)C1 1953484268 VRYPVPWHIQWRGT-ZETCQYMHSA-N 172.037 -1.188 50 10 AAGE CNNC(=O)[C@H]1Cc2nncn2C1 1953873639 MUCUMGUZFLXDIB-YFKPBYRVSA-N 181.199 -1.299 50 10 AAGE C[C@@H](C(=O)NN)N1CC(F)(CO)C1 1954084107 ADPVAYJSGZWQCK-YFKPBYRVSA-N 191.206 -1.619 50 10 AAGE N#CC1(O)CCN(C(=O)CNO)CC1 1956032352 PYTFAZCIECYVAH-UHFFFAOYSA-N 199.210 -1.158 50 10 AAGE C[C@@H](CN1CC=C[C@H](O)C1)C(=O)NN 1956307674 SKSZNOQRQZJYML-YUMQZZPRSA-N 199.254 -1.155 50 10 AAGE Cn1nc(B(O)O)c(C(=O)O)n1 2209013351 JBRGEJHWHCTSTQ-UHFFFAOYSA-N 170.921 -2.807 50 10 AAGE CO[C@H]1CC[C@H]1C(=O)NCB(O)O 2209288733 NFMFHFBUKBPFKB-RITPCOANSA-N 187.004 -1.460 50 10 AAGE CC[S@](=O)NCCC#CB(O)O 2241903238 IHERPIOPHNAZLT-LBPRGKRZSA-N 189.045 -1.335 50 10 AAGE O=C(NCB(O)O)[C@H]1C[C@H]1C(=O)O 2242200550 CYAUEGNGVOOKRC-IUYQGCFVSA-N 186.960 -2.165 50 10 AAGE C[C@@H](N)C#CC(=O)NN 2297010904 ZICFQLRYSFONNK-SCSAIBSYSA-N 127.147 -1.673 50 10 AAGE CN(C)NC(=O)[C@@H]1COC[C@@H]1N 147314121 JWEZUOQUVALVIL-RITPCOANSA-N 173.216 -1.447 50 10 AAGE COC(=O)c1ccncc1B(O)O 169969278 JXUFTTGMXYTBLS-UHFFFAOYSA-N 180.956 -1.452 50 10 AAGE OB(O)c1ccn2nnnc2c1 170000828 VKRGHPBWUIXFJH-UHFFFAOYSA-N 163.933 -2.196 50 10 AAGE OB(O)c1cnc2nocc2c1 238656827 GXOLYPGHKDKOLI-UHFFFAOYSA-N 163.929 -1.097 50 10 AAGE CON[C@@H](C)C(=O)NNC(C)=O 307995848 WGLNICQCUAOJPN-BYPYZUCNSA-N 175.188 -1.307 50 10 AAGE CC(=O)N1CC(C)(C(=O)NN)C1 698506817 WCARDHZFQNHIOA-UHFFFAOYSA-N 171.200 -1.155 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2CCC[C@H]21 706905179 RXRIVRHKRYIUFI-NTSWFWBYSA-N 183.211 -1.013 50 10 AAGE CN(CCCF)C(=O)C(=O)NN 716685524 MMGCDQQQIVXJCK-UHFFFAOYSA-N 177.179 -1.206 50 10 AAGE OB(O)c1n[nH]cc1Cl 1879952778 QTAXXIRIJVHECF-UHFFFAOYSA-N 146.342 -1.257 50 10 AAGE NNC(=O)C(=O)NC[C@@H]1C[C@H]1Cl 1881368083 ZSZGWIMGGCTPAO-IUYQGCFVSA-N 191.618 -1.280 50 10 AAGE NNC(=O)C(=O)N[C@@H]1[C@H]2CCO[C@H]21 1881744690 GOBIAPBVRRWQEW-UOWFLXDJSA-N 185.183 -2.120 50 10 AAGE NNC(=O)N1CC[C@H](O)C[C@H]1CO 1883941771 GETDVMXLFZADHA-WDSKDSINSA-N 189.215 -1.613 50 10 AAGE O=C(NCC=CB(O)O)[C@H]1CCCO1 1892923504 GVEBGKACNPKXAC-SSDOTTSWSA-N 199.015 -1.150 50 10 AAGE C[C@]1(NC(=O)C#CB(O)O)CCNC1 1893357317 FGPLCUJDJDTHGJ-QMMMGPOBSA-N 196.015 -2.130 50 10 AAGE COC[C@@H](C)Cn1cc(B(O)O)cn1 1896851668 QFZHVUIWOUWGFC-ZETCQYMHSA-N 198.031 -1.155 50 10 AAGE NNC(=O)[C@@H]1CCOC[C@@H]1N 1953242706 NPVVIXUWTCBWJG-UHNVWZDZSA-N 159.189 -1.660 50 10 AAGE CN1CCN(C(=O)C(=O)NN)CC1 24869228 OVERGYQUZISQEP-UHFFFAOYSA-N 186.215 -2.250 50 10 AAGE Cc1ccc(=O)n(CCC(=O)NN)n1 69625260 OLWSYJMFKDKGMM-UHFFFAOYSA-N 196.210 -1.068 50 10 AAGE NNC(=O)CCN1CCC(N)CC1 82470840 NMDGBZBMMHWPIH-UHFFFAOYSA-N 186.259 -1.211 50 10 AAGE CN[C@@H]1COC[C@@H]1C(=O)NN 85381706 LRUBVBLWLGVKGT-CRCLSJGQSA-N 159.189 -1.789 50 10 AAGE NC(=O)N/N=C/C=N/NC(N)=O 101917872 WJUXATYHPMEDRO-FACPPWRESA-N 172.148 -1.705 50 10 AAGE OB(O)c1cc(Cl)ncn1 199487348 LYIKZFHVDSRWBC-UHFFFAOYSA-N 158.353 -1.190 50 10 AAGE N#C[C@@H](O)[C@H](O)C(N)=O 211864206 XXKAGQXXAQMDNJ-GBXIJSLDSA-N 130.103 -2.283 50 10 AAGE CCNC(=O)CSCC(=O)NN 300750055 GGNFRYJBIYLNDP-UHFFFAOYSA-N 191.256 -1.154 50 10 AAGE NNC(=O)CCN1CCN2CC[C@H]1C2 307431515 LNRBESMULWCMAX-QMMMGPOBSA-N 198.270 -1.244 50 10 AAGE OC[C@@H]1O[C@H](CCl)[C@@H](O)[C@H]1O 307490157 AFEGDRDJPMKARR-MOJAZDJTSA-N 182.603 -1.293 50 10 AAGE O=CC1=C=[N+](CC23CC(CO2)C3)NN1 885612483 HNDYGJHNQZSAOM-UHFFFAOYSA-N 194.214 -1.047 50 10 AAGE CN1CC[C@@H](C[N+]2=C=C(C=O)NN2)C1 885687849 GXMRLQKAMSFECT-MRVPVSSYSA-N 195.246 -1.274 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2[C@H](O)C[C@H]2C1 1878211763 IQKLLYGZLMMHBI-KVQBGUIXSA-N 199.210 -2.185 50 10 AAGE NNC(=O)N1C[C@@H](F)[C@@H](CO)C1 1880610552 REDMWEZAWWTSST-RFZPGFLSSA-N 177.179 -1.168 50 10 AAGE NNC(=O)CN1C[C@H]2COCC[C@H]21 1883242718 CICICQARAHNSBO-NKWVEPMBSA-N 185.227 -1.303 50 10 AAGE C[C@@H](NC(=O)NN)[C@H]1COCCO1 1954462326 AQHSFAVEQDOWJD-PHDIDXHHSA-N 189.215 -1.037 50 10 AAGE C#C[C@H]1CCN(C(=O)C#CB(O)O)C1 2241468445 OLAFGBONSWRZPU-QMMMGPOBSA-N 190.995 -1.517 50 10 AAGE CC#CCCCNC(=O)C#CB(O)O 2241479316 VXVHCLZWNOVAFE-UHFFFAOYSA-N 193.011 -1.079 50 10 AAGE NNC(=O)C(=O)N1CCN2CC[C@H]1C2 306714725 XFXDUPYGQZGDHF-LURJTMIESA-N 198.226 -2.107 50 10 AAGE C[C@@H](CCO)NC(=O)NNC(N)=O 308256315 KVTJGFMTIFCYSG-BYPYZUCNSA-N 190.203 -1.360 50 10 AAGE C[C@H]1CN(C(=O)C(=O)NN)[C@H]1C 606252570 QMJVKSFUMMDREN-WHFBIAKZSA-N 171.200 -1.157 50 10 AAGE CN(CC(=O)NN)CC1CN(C)C1 692720818 WSFJYUCXNSDLBE-UHFFFAOYSA-N 186.259 -1.530 50 10 AAGE NNC(=O)C(=O)N1CC[C@H](CF)C1 711429596 HQNVDSITKSPWIZ-RXMQYKEDSA-N 189.190 -1.206 50 10 AAGE C[N+]1=C=C(C(=O)NCB(O)O)NN1 885449120 ATHXMWYCYPRLEE-UHFFFAOYSA-O 184.972 -3.667 50 10 AAGE CN(CC(=O)O)C1=C(C#N)C#CNN1 885589641 UNEJHKZUIBZOSD-UHFFFAOYSA-N 192.178 -1.193 50 10 AAGE Cc1nc(C)c(B(O)O)o1 1879929317 FWWAXWADMJCALO-UHFFFAOYSA-N 140.935 -1.029 50 10 AAGE NNC(=O)CCN1C[C@H](O)C2(CC2)C1 1930235690 PPRRQSNAVDOITP-ZETCQYMHSA-N 199.254 -1.177 50 10 AAGE CN1CCN(C[C@@H](N)[C@@H](O)C#N)CC1 1952796986 XLYLINZBBMUADX-BDAKNGLRSA-N 198.270 -1.554 50 10 AAGE COCc1cc(B(O)O)ccn1 1962712884 TXHOTQZRVOQOHC-UHFFFAOYSA-N 166.973 -1.092 50 10 AAGE C[C@H](CO)Nc1ncc(B(O)O)cn1 2210061263 SFNBRJCTMMSNQU-RXMQYKEDSA-N 197.003 -2.051 50 10 AAGE CCC(CO)(CO)C(=O)NN(C)C 2241244746 DBEMVAFBNFOUFP-UHFFFAOYSA-N 190.243 -1.040 50 10 AAGE N#CCN(CC#N)C(=O)C#CB(O)O 2241478393 DJOXSQBBFJNLRK-UHFFFAOYSA-N 190.955 -2.122 50 10 AAGE O=C(C#CB(O)O)NC[C@H]1CCCN1 2241479470 YSKMOWOXZJEQIA-SSDOTTSWSA-N 196.015 -2.130 50 10 AAGE NNC(=O)c1nnc(NN)nc1NN 16927025 PUZVQZHWPNOSEL-UHFFFAOYSA-N 199.178 -2.954 50 10 AAGE COCC(=O)NNC(N)=S 146888593 WAIMSQWCBQAFPA-UHFFFAOYSA-N 163.202 -1.503 50 10 AAGE O[C@@H]1[C@@H](O)[C@H](O)O[C@@H](CCl)[C@@H]1O 200950186 QMWDIHPSUCUMFU-FQJSGBEDSA-N 198.602 -1.975 50 10 AAGE O=S(=O)(CCl)NCB(O)O 205324720 DYDOICABPAYWAK-UHFFFAOYSA-N 187.413 -1.886 50 10 AAGE in-vitro NNC(=O)C(=O)N[C@H]1CCSC1 231381902 AIIAHCZDXSVNNH-BYPYZUCNSA-N 189.240 -1.402 50 10 AAGE NCc1cncc(B(O)O)c1Cl 238570741 IGGAJZVPCOQSSB-UHFFFAOYSA-N 186.407 -1.127 50 10 AAGE NNC(=O)C(=O)NC[C@@H]1CC12CC2 697513663 ADCFMWYJFMEGTF-YFKPBYRVSA-N 183.211 -1.107 50 10 AAGE CNS(=O)(=O)NCB(O)O 706477510 MSQWKWLVYKPZRH-UHFFFAOYSA-N 167.983 -2.948 50 10 AAGE N#CC1=C(N2CC(CO)C2)NC#CN1 885557944 CWGADRSPYXHOLR-UHFFFAOYSA-N 190.206 -1.286 50 10 AAGE NC[C@]1(C(=O)NN)CC1(F)F 1880425093 WUSPRWVCBMYRBO-BYPYZUCNSA-N 165.143 -1.040 50 10 AAGE C[C@H](CC(N)=O)N(C)CC(=O)NN 1931395867 JFAXZDSFKCOABO-RXMQYKEDSA-N 188.231 -1.828 50 10 AAGE NC(=NO)c1ccc(B(O)O)o1 1951325216 AOANCJAJRHUUCT-UHFFFAOYSA-N 169.933 -1.946 50 10 AAGE NNC(=O)[C@]12CCNC[C@H]1C2 1951339320 IDNVPLMVWYNNLE-VDTYLAMSSA-N 155.201 -1.024 50 10 AAGE N#C[C@@H](O)C[C@H](O)CO 1951518643 PXHSPDBSGURILY-WHFBIAKZSA-N 131.131 -1.386 50 10 AAGE Cc1cc(B(O)O)sc1CNC=O 2241554458 CPEDHLRAANZTMQ-UHFFFAOYSA-N 199.040 -1.018 50 10 AAGE NNC(=O)C[C@@H]1CCCS1(=O)=O 213624368 CCLQFPAZTLUELY-YFKPBYRVSA-N 192.240 -1.056 50 10 AAGE OB(O)c1cnc(O)cc1O 238635540 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C[C@H]1COC[C@H]1C(=O)NNCCO 1929837162 VQLJIWDRVNRCPV-NKWVEPMBSA-N 188.227 -1.118 50 10 AAGE OB(O)c1ccn2ccnc2n1 1931776161 UVVBXVBGQQOVIY-UHFFFAOYSA-N 162.945 -1.591 50 10 AAGE NNC(=O)CN1CC(F)(CO)C1 1953711578 RNUBUDSORGLFMA-UHFFFAOYSA-N 177.179 -2.008 50 10 AAGE N[C@H]1CCN(C(=O)C#CB(O)O)C1 2241468965 XUCBLYIQTCKBEB-LURJTMIESA-N 181.988 -2.439 50 10 AAGE NC(=O)[C@H](O)CNC(=O)C#CB(O)O 2241475925 IEZAFYXEMYBLNJ-SCSAIBSYSA-N 199.959 -4.036 50 10 AAGE Cn1nccc1NC(=O)C#CB(O)O 2241476487 TZGNUABTFCCRQB-UHFFFAOYSA-N 192.971 -1.626 50 10 AAGE CN(O)C(=O)c1ccc(B(O)O)cc1 219401481 XVBRRZMZXIDKFC-UHFFFAOYSA-N 194.983 -1.172 50 10 AAGE CC(=O)N/N=C/[C@H](O)CO 238145516 UHCNQERPHHUVDK-KDXUVAGDSA-N 146.146 -1.539 50 10 AAGE CNC(=O)C1(C(=O)NNC=O)CC1 306934158 FAHYYKVRTFTKBJ-UHFFFAOYSA-N 185.183 -1.710 50 10 AAGE CC(C)C[C@H]1NC(=O)CN[B-]1(O)O 306991905 VVSLFCWCYOSACZ-ZCFIWIBFSA-N 187.028 -1.417 50 10 AAGE CC[S@@](C)(=O)=NC(=O)C(=O)NN 307336290 HHAKPLJAJZYNEL-GFCCVEGCSA-N 193.228 -1.379 50 10 AAGE NNC(=O)CSCCC(N)=O 399172119 OQAMWWWZIZSZQW-UHFFFAOYSA-N 177.229 -1.415 50 10 AAGE C[C@@H]1C[C@H](C(=O)NCB(O)O)CO1 702028838 HPGGONVLOAYLOF-RITPCOANSA-N 187.004 -1.460 50 10 AAGE C/C=C\[C@@H](O)C(=O)NN(C)C(N)=O 901276821 BMXBXNCFGRNFBW-CLBPYYFESA-N 187.199 -1.035 50 10 AAGE C[C@@H](Cn1cc(B(O)O)cn1)N(C)C 1884944696 ITZGIIWWWVMSBN-ZETCQYMHSA-N 197.047 -1.487 50 10 AAGE CC[C@@H](O)C(=O)NCC#CB(O)O 1888708324 RKIYGPIQZXGNOU-ZCFIWIBFSA-N 184.988 -2.111 50 10 AAGE CN1[C@H](C(=O)O)CC[C@@H]1C(=O)NN 1914777508 ZJJORULLAZODPG-UHNVWZDZSA-N 187.199 -1.476 50 10 AAGE O=C(NNCCO)c1cnc(O)[nH]1 1929831869 JOWFTYPYVJIZAM-UHFFFAOYSA-N 186.171 -1.658 50 10 AAGE NNC(=O)N1CC(OCCO)C1 1932103175 FGELBCVXWGWAQX-UHFFFAOYSA-N 175.188 -1.737 50 10 AAGE NNC(=O)CN1CC(OCCO)C1 1932103667 LBZUVPGUXALAGP-UHFFFAOYSA-N 189.215 -2.331 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@@H]2[C@H]2C[C@H]21 1957163964 BGWUCMROBGRUTP-VWDOSNQTSA-N 195.222 -1.157 50 10 AAGE CN1CC2(CCN2C(=O)NN)C1 2209086328 ANNYAZUYKFJOAP-UHFFFAOYSA-N 170.216 -1.040 50 10 AAGE C#C[C@@H](C)Oc1ncc(B(O)O)cn1 2210060163 GXZRHNFACNGOIB-ZCFIWIBFSA-N 191.983 -1.443 50 10 AAGE CCn1cc(C(=O)NN)nc1B(O)O 2241468403 NODQQVFUKNSGMK-UHFFFAOYSA-N 197.991 -2.814 50 10 AAGE O=C(C#CB(O)O)N[C@H]1CCOC1 2241468617 RFPASOMSIVDLJX-LURJTMIESA-N 182.972 -2.093 50 10 AAGE O=C(C#CB(O)O)NC1[C@@H]2CNC[C@@H]12 2241479102 RJCYAIFTGXVESM-PHDIDXHHSA-N 193.999 -2.664 50 10 AAGE CCONC(=O)[C@H]1C[C@H]1B(O)O 2241479157 SIZKUGSKPYWEJO-CRCLSJGQSA-N 172.977 -1.083 50 10 AAGE C[C@H](C(=O)NNC=O)S(C)(=O)=O 307389922 AGZIRAULMNDAQO-SCSAIBSYSA-N 194.212 -1.803 50 10 AAGE N#Cc1cnn(CC(=O)NN)c1 307403734 CDTAIEQAACYPST-UHFFFAOYSA-N 165.156 -1.255 50 10 AAGE CCC(=O)NCCNC(=O)NN 393118076 DELWESDCGNWRKF-UHFFFAOYSA-N 174.204 -1.315 50 10 AAGE CN(CC(=O)NN)C[C@H]1CCOC1 398961528 ZJNDZNBUNOFIHH-SSDOTTSWSA-N 187.243 -1.055 50 10 AAGE CN(N)C(=O)[C@@H]1CCC(=O)NC1 575556955 FEANWBZWTJSTSY-RXMQYKEDSA-N 171.200 -1.155 50 10 AAGE C[C@@H]1C[C@@H](O)CCN1CC(=O)NN 606258766 OXAZUDASYKRXJJ-RQJHMYQMSA-N 187.243 -1.179 50 10 AAGE C[C@@H]1COC[C@H]1C(=O)NCB(O)O 705214785 GFXOSFDCHQHGFX-PHDIDXHHSA-N 187.004 -1.603 50 10 AAGE NNC(=O)N[C@H]1C[C@H](C(N)=O)C1 1329054726 LRYVBQZPOJFFFM-JPYJGEKTSA-N 172.188 -1.577 50 10 AAGE C[C@@]1(O)CCN(C(=O)NN)C[C@@H]1O 1877552587 ZHNQZLBTQBQXFK-CAHLUQPWSA-N 189.215 -1.613 50 10 AAGE C[C@@H](C(=O)NN)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1885716568 WUSLFPWQGCPPIB-RULNZFCNSA-N 199.254 -1.465 50 10 AAGE NNC(=O)[C@@H]1C[C@@H]1CN1CC[C@@H]1CO 1929741540 QXWDLOKKXNMSTF-BWZBUEFSSA-N 199.254 -1.321 50 10 AAGE CN(C)C[C@@H](N)[C@@H](O)C#N 1952793722 MIKKIMJMARBMCB-RITPCOANSA-N 143.190 -1.240 50 10 AAGE CN1N=C([C@@H](N)[C@@H](O)C#N)CCC1=O 1952977543 ZIDNVUZNQLDION-POYBYMJQSA-N 196.210 -1.194 50 10 AAGE N[C@@]1(B(O)O)CCNC(=O)C1 1953248659 QFLKIRLBUCWCGX-YFKPBYRVSA-N 157.966 -2.394 50 10 AAGE NNC(=O)CCN1CCO[C@H]2C[C@H]21 1954052403 IZAWOHUROGJUNS-RQJHMYQMSA-N 185.227 -1.161 50 10 AAGE CN(CC(=O)NN)CC1[C@H]2COC[C@H]12 1957269335 JPYDKCBSGGLADQ-HTQZYQBOSA-N 199.254 -1.200 50 10 AAGE COc1cc(B(O)O)cnc1C=O 2081148955 OSTQLGYJQZMQDF-UHFFFAOYSA-N 180.956 -1.418 50 10 AAGE COC1(CNC(=O)C#CB(O)O)CC1 2241468386 NHKWGZBARABBEP-UHFFFAOYSA-N 196.999 -1.703 50 10 AAGE O=C(N1CC=CCN1)C1(B(O)O)CC1 2241478221 ALVOADUKBILDBO-UHFFFAOYSA-N 196.015 -1.104 50 10 AAGE C=C[C@H](CO)NC(=O)C1(B(O)O)CC1 2241479841 BGASOTQGQDNSFF-ZCFIWIBFSA-N 199.015 -1.344 50 10 AAGE C[C@@H](O)CNC(=O)[C@H]1C[C@@H]1B(O)O 2241496395 SDFDFNTZDYZDSX-SRQIZXRXSA-N 187.004 -1.654 50 10 AAGE O=CN=c1nc(B(O)O)[nH]s1 2241557803 BVLUMKVFFJODOM-UHFFFAOYSA-N 172.962 -2.792 50 10 AAGE CCNNC(=O)C(=O)O 104724898 VEQNQYFIQPJMPF-UHFFFAOYSA-N 132.119 -1.288 50 10 AAGE CCc1nnc(B(O)O)s1 169994510 ZYOBWEUSKPZXQU-UHFFFAOYSA-N 157.991 -1.220 50 10 AAGE OCc1cccc(B(O)O)c1CO 204734109 SVPKFBZNKMDWPS-UHFFFAOYSA-N 181.984 -1.649 50 10 AAGE CCOC(=O)CN(N)C(N)=O 225412880 CAHDPEMXFOYKNA-UHFFFAOYSA-N 161.161 -1.196 50 10 AAGE NC(=O)NN=C(/C=N/O)/C=N/O 238588095 MFJQSYNIQFOMQH-LWBLAMGCSA-N 173.132 -1.069 50 10 AAGE N#Cc1nc(C(=O)O)ccc1B(O)O 238621611 ZIZREDLDUNQLFB-UHFFFAOYSA-N 191.939 -1.669 50 10 AAGE O=Cc1cc(F)ncc1B(O)O 238634538 MCLDMMNUKHTOOG-UHFFFAOYSA-N 168.920 -1.287 50 10 AAGE NNC(=O)CCN1CC2(COC2)C1 697131959 FESGWVCHLVKXJU-UHFFFAOYSA-N 185.227 -1.301 50 10 AAGE CN1N=C=C(C2=C=C(C=O)N(C)N2)N1 885573028 NSBALGGIRPZGSC-UHFFFAOYSA-N 191.194 -1.079 50 10 AAGE NNC(=O)[C@@H]1CCC2(CNC2)O1 1881582930 RDQDPXCCMMCXLS-YFKPBYRVSA-N 171.200 -1.503 50 10 AAGE NNC(=O)CN1CCC=C[C@H]1CO 1882404016 SNKZGFVCCVEPFG-ZETCQYMHSA-N 185.227 -1.401 50 10 AAGE NNC(=O)CN1[C@H]2CC[C@@H](C2)[C@@H]1CO 1885165604 CPUVLLRHMVTGNQ-FXQIFTODSA-N 199.254 -1.179 50 10 AAGE CCOCC1CN(CC(=O)NN)C1 1954861503 BRHHHMRZFWYZKF-UHFFFAOYSA-N 187.243 -1.055 50 10 AAGE C[C@@H](CN)Nc1ncccc1B(O)O 2210068209 NYEKKJIFWLLGLZ-LURJTMIESA-N 195.031 -1.480 50 10 AAGE COC1CN(C(=O)[C@H]2C[C@H]2B(O)O)C1 2241481581 WNCRAXXQRWAWIH-NKWVEPMBSA-N 199.015 -1.294 50 10 AAGE NNC(=O)N[C@@H]1COC2(COC2)C1 2241844924 SOJNQWFCRPLCAT-YFKPBYRVSA-N 187.199 -1.283 50 10 AAGE C[C@H]1CCC(=O)N1CC(=O)NN 39409047 AUJSDFHQOMZHBD-YFKPBYRVSA-N 171.200 -1.013 50 10 AAGE CN(CCCC(=O)NN)CC(N)=O 82467311 GHYOKKMCDIOGKX-UHFFFAOYSA-N 188.231 -1.826 50 10 AAGE NNC(=O)COC1COC1 98059729 ZBOQUUCWRWSOMZ-UHFFFAOYSA-N 146.146 -1.608 50 10 AAGE CC(C)C1(O)CN(CC(=O)NN)C1 306662500 PSOJKORRCQCEAY-UHFFFAOYSA-N 187.243 -1.321 50 10 AAGE Cn1ccnc1C(=O)NNC(N)=O 307410666 FMIWFEFXVXEPDQ-UHFFFAOYSA-N 183.171 -1.267 50 10 AAGE CO[C@@H](C)n1ccc(B(O)O)n1 953036029 GQXXDNBUMOMYDH-YFKPBYRVSA-N 169.977 -1.272 50 10 AAGE NNC(=O)[C@H](N)CCF 1879950868 GXHKDYCRCRLAIL-GSVOUGTGSA-N 135.142 -1.337 50 10 AAGE NNC(=O)CN1CC[C@@H]1CO 1929740461 IYRYXASMXHOLGE-RXMQYKEDSA-N 159.189 -1.957 50 10 AAGE C[C@@H]1CC[C@@H]([C@H](N)C(=O)NN)O1 1953709389 YBCDVCFGIKWHNC-SRQIZXRXSA-N 173.216 -1.129 50 10 AAGE Cc1oc(B(O)O)cc1C(=O)N(C)O 2241472328 QNENJFORQZITAM-UHFFFAOYSA-N 198.971 -1.271 50 10 AAGE C#C[C@H](CO)NC(=O)[C@H]1C[C@@H]1B(O)O 2241481077 RAEKZSQKGGGJCD-VQVTYTSYSA-N 196.999 -2.040 50 10 AAGE Cn1ncc(C(=O)NN)cc1=O 168490020 PXFUQACFOVCSKG-UHFFFAOYSA-N 168.156 -1.616 50 10 AAGE Cn1c(B(O)O)cnc1Cl 238535136 MUVKSWUFEUJYNY-UHFFFAOYSA-N 160.369 -1.247 50 10 AAGE O=[N+]([O-])c1nc(B(O)O)ccc1O 238624269 IZNKBLAIZWMFLD-UHFFFAOYSA-N 183.916 -1.625 50 10 AAGE O=Cc1c(CO)cncc1B(O)O 238729359 NJQSSCZDDMJVSV-UHFFFAOYSA-N 180.956 -1.934 50 10 AAGE NNC(=O)[C@H]1OCC[C@H]1N 575579040 WWXUXKKJKFGNHZ-DMTCNVIQSA-N 145.162 -1.908 50 10 AAGE Cn1nnc(C(=O)N=C=O)n1 575584416 AHNCVCPMOHUSKW-UHFFFAOYSA-N 153.101 -1.314 50 10 AAGE CN1C#C[C-](C2=C=C(C=O)N(C)N2)N1 885558611 VWZHKTNASNJRPY-UHFFFAOYSA-N 189.198 -1.055 50 10 AAGE CN(C)NC(=O)C1=C=NN(C)[C-]1CN 885854122 WHPFGOJPFWALCQ-UHFFFAOYSA-N 196.234 -1.474 50 10 AAGE NNC(=O)CN(CCO)C1COC1 1915539324 SHOGDXZXGKQIPC-UHFFFAOYSA-N 189.215 -2.331 50 10 AAGE NNC(=O)CCN1CC(CO)C1 1929742087 GMBZPGJILJHIGV-UHFFFAOYSA-N 173.216 -1.710 50 10 AAGE O=C1CC[C@H](C(=O)NNCCO)N1 1929831534 DEOYPPCNQGGQQZ-RXMQYKEDSA-N 187.199 -2.122 50 10 AAGE N#CNC(=O)c1cc(B(O)O)cs1 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-1.252 50 10 AAGE Cc1nnc(C(=O)NN)c(O)n1 306997841 AEKHWIHGNDLCHU-UHFFFAOYSA-N 169.144 -1.511 50 10 AAGE NNc1ccc(B(O)O)c(C(=O)O)c1 307355908 WRGKHLCEVSOESF-UHFFFAOYSA-N 195.971 -1.650 50 10 AAGE COc1cccc(NN)c1B(O)O 307671059 RQXQYTIVZSMCHX-UHFFFAOYSA-N 181.988 -1.339 50 10 AAGE CCOC(=O)/C(C#N)=C(/N)NCCO 308259181 FVRKSNQEXDIKAG-SREVYHEPSA-N 199.210 -1.175 50 10 AAGE CC(=O)N(C)CC(=O)N(C)N 707536514 ZQKCZQQJUMWNIB-UHFFFAOYSA-N 159.189 -1.203 50 10 AAGE Cc1nnc(NNC(=O)[C@H](C)O)n1C 1329065882 AVWUCMGAMKDQKR-BYPYZUCNSA-N 199.214 -1.053 50 10 AAGE NNC(=O)N1C[C@H](O)[C@H](O)[C@H]1CO 1883963134 CQLIXDFLLDEQFT-MROZADKFSA-N 191.187 -3.032 50 10 AAGE C[C@H](Cn1cc(B(O)O)cn1)N(C)C 1884944695 ITZGIIWWWVMSBN-SSDOTTSWSA-N 197.047 -1.487 50 10 AAGE CN(C)NC(=O)CCNCCCO 1891641854 FAROJGPVOJJQGC-UHFFFAOYSA-N 189.259 -1.059 50 10 AAGE CC(C)NCB(O)O 1923427144 KOBZCZQMCJFGNO-UHFFFAOYSA-N 116.957 -1.004 50 10 AAGE NC[C@H](C(=O)NN)C1CCOCC1 1930481506 VGMPMGINWJDDBS-ZETCQYMHSA-N 187.243 -1.022 50 10 AAGE C[C@H]1C[C@@]1(CN)C(=O)NN 1935439070 RXEYRKFGTYCADT-NJGYIYPDSA-N 143.190 -1.039 50 10 AAGE CN(CC(=O)NN)Cc1cnn(C)n1 1956952632 JVVYVCOXKJSZTK-UHFFFAOYSA-N 198.230 -1.763 50 10 AAGE Cc1cc(=O)n(CC(=O)NN)c(=O)[nH]1 144236046 RJDNHNSOFJEXQZ-UHFFFAOYSA-N 198.182 -2.165 50 10 AAGE Nc1cccnc1B(O)O 203562115 LIJKNJYADARDNG-UHFFFAOYSA-N 137.935 -1.656 50 10 AAGE NNC(=O)[C@H](O)CCO 238556147 BPWOPQJLYWXIHI-GSVOUGTGSA-N 134.135 -2.280 50 10 AAGE CCOC(=O)c1cncnc1B(O)O 382743735 NPLJRBIWLCBFFQ-UHFFFAOYSA-N 195.971 -1.667 50 10 AAGE C[C@@]1(C(=O)NCB(O)O)CCOC1 687412781 DFKFDLVBLKIPMG-SSDOTTSWSA-N 187.004 -1.459 50 10 AAGE COC[C@@H](OC)C(=O)NNC(N)=O 700865564 JOPWTZROHMJFLX-SCSAIBSYSA-N 191.187 -1.653 50 10 AAGE CN(C)NC(=O)CON 708681783 POCXNZRFHVHRRW-UHFFFAOYSA-N 133.151 -1.531 50 10 AAGE CCOC(=O)c1cc(B(O)O)c[nH]1 714243569 RWSIVZUCJMRRJC-UHFFFAOYSA-N 182.972 -1.129 50 10 AAGE C[C@@H](CN1C#[N+]C(=C=N)N1)C(=O)NN 885670885 KUNYZKGNEKYHNP-YFKPBYRVSA-O 195.206 -1.187 50 10 AAGE CN(N)C(=O)NCS(C)(=O)=O 1880501627 NSRMKCIOYFFMSP-UHFFFAOYSA-N 181.217 -1.496 50 10 AAGE NNC(=O)[C@H]1CCC[C@H](CO)O1 1881254655 IPWCREDYSCBYEH-PHDIDXHHSA-N 174.200 -1.094 50 10 AAGE CN1CC(Cn2ccc(B(O)O)n2)C1 1897111347 KOHJOLWVFXWEBO-UHFFFAOYSA-N 195.031 -1.876 50 10 AAGE CN(C)[S@@](C)(=O)=NCC(=O)NN 1953388863 NSAFMIKPAAIZAD-LBPRGKRZSA-N 194.260 -1.449 50 10 AAGE C[C@H]1C(CNC(=O)C(=O)NN)[C@@H]1C 1954567693 OPKYKNGRHPQRKE-RFZPGFLSSA-N 185.227 -1.006 50 10 AAGE CC[C@H]1C[C@@H]1NC(=O)C#CB(O)O 2241468801 VDQYUISQIVHAAC-BQBZGAKWSA-N 181.000 -1.084 50 10 AAGE O=C(C#CB(O)O)N1CCC[C@H](F)C1 2241468853 VURXCSCPEXIART-ZETCQYMHSA-N 198.990 -1.038 50 10 AAGE NCCCCCNC(=O)C#CB(O)O 2241476000 JQHPLFNYHQIOGY-UHFFFAOYSA-N 198.031 -1.753 50 10 AAGE C=CCN(OC)C(=O)C#CB(O)O 2241793476 QBDOCXPFCJEHLC-UHFFFAOYSA-N 182.972 -1.422 50 10 AAGE C[C@H](Cn1cncn1)C(=O)NN 58839446 GBOSWUCVYMCPFP-RXMQYKEDSA-N 169.188 -1.096 50 10 AAGE CC(C)[C@@H](C(=O)NN)N(C)CCO 82468854 TXUDWRWVWMGCJH-ZETCQYMHSA-N 189.259 -1.075 50 10 AAGE CN1CCN(CC(=O)NN)C1=O 82471507 AVLMMKJKTDBMLH-UHFFFAOYSA-N 172.188 -1.656 50 10 AAGE CC[Si](O)(O)O 196282228 KEYRRLATNFZVGW-UHFFFAOYSA-N 108.169 -1.078 50 10 AAGE OCCNc1cccnc1B(O)O 204251146 FBHVTJJQYNLDGO-UHFFFAOYSA-N 181.988 -1.834 50 10 AAGE CC(C)(CNC(=O)NN)C(N)=O 230408063 SPRGPFRHMHYNEH-UHFFFAOYSA-N 174.204 -1.329 50 10 AAGE NNC(=O)NCCc1ncno1 231840918 YXLXXYYZWDOELM-UHFFFAOYSA-N 171.160 -1.215 50 10 AAGE NC(=O)c1cncc(B(O)O)c1 238640603 RPPPWDFRSINFPP-UHFFFAOYSA-N 165.945 -2.140 50 10 AAGE CC(=O)NNS(=O)(=O)N1CCC1 307604403 WASWOGLHCWYVOO-UHFFFAOYSA-N 193.228 -1.422 50 10 AAGE COC(=O)NNC(=O)N[C@H](C)CO 308145448 AECDMNXSNZKLLE-SCSAIBSYSA-N 191.187 -1.063 50 10 AAGE NC(=O)NNC(=O)c1nn[nH]n1 575465126 WQRXLGKKPWTRDR-UHFFFAOYSA-N 171.120 -2.487 50 10 AAGE NC(=O)NNC(=O)[C@@]12COC[C@@H]1C2 575519971 AZAPTUYMABEFHZ-FFWSUHOLSA-N 185.183 -1.278 50 10 AAGE NN=C(N)c1cc(C(=O)NN)ccn1 642771876 MOFIONAUPKUZOV-UHFFFAOYSA-N 194.198 -1.736 50 10 AAGE CN(CC(=O)NN)Cc1nnnn1C 707401405 RTIHYRRFZBEBHH-UHFFFAOYSA-N 199.218 -2.368 50 10 AAGE NNC(=O)C(=O)N1C[C@H]2COC[C@H]21 1882697302 GOXZBPHJLNGTOK-CRCLSJGQSA-N 185.183 -2.167 50 10 AAGE O=C(NCB(O)O)c1cnco1 1929823388 JEXYWVIQNAEEAT-UHFFFAOYSA-N 169.933 -1.584 50 10 AAGE CC(CO)(CO)[C@@H](N)[C@@H](O)C#N 1952957671 BJZLFOGGHJXWFP-WDSKDSINSA-N 174.200 -1.811 50 10 AAGE NNC(=O)[C@H]1CC[C@@H]1CN1CC(O)C1 2209906053 FJCFXLXNIVQYEB-SVRRBLITSA-N 199.254 -1.321 50 10 AAGE C[C@@H](CO)Nc1ncccc1B(O)O 2210068261 OXLQNKXBPQWEIA-LURJTMIESA-N 196.015 -1.446 50 10 AAGE CN(CCN)c1ncc(B(O)O)cn1 2210068624 WJYIJLWJBGMGJK-UHFFFAOYSA-N 196.019 -2.449 50 10 AAGE O=C(C#CB(O)O)N1CC[C@H]1CF 2241478852 MFWAROCVPQRDDC-LURJTMIESA-N 184.963 -1.428 50 10 AAGE Cn1ncc(C(=O)NN)c1B(O)O 2241481935 XIUYLVWEGWALQL-UHFFFAOYSA-N 183.964 -3.297 50 10 AAGE C[C@H](C(=O)O)N(C)C(=O)C#CB(O)O 2241584140 JVRRYVCDYODORS-RXMQYKEDSA-N 198.971 -2.067 50 10 AAGE NNC(=O)[C@@](O)(NN)C(F)(F)F 20156998 TXCWKGMKKWOSJD-REOHCLBHSA-N 188.109 -2.310 50 10 AAGE C[C@]1(O)CCCN(CC(=O)NN)C1 157536180 CFCZKXXAGOFDIJ-QMMMGPOBSA-N 187.243 -1.177 50 10 AAGE CN(C=O)Cc1cccc(B(O)O)c1 208608217 VTWUXTLEDMCYTQ-UHFFFAOYSA-N 193.011 -1.045 50 10 AAGE COc1ccc(B(O)O)c(C#N)n1 238429643 VNOVVWRUOHHKOD-UHFFFAOYSA-N 177.956 -1.358 50 10 AAGE C[C@]1(CO)CCN(CC(=O)NN)C1 307046885 YZYGHKIUMADKPY-QMMMGPOBSA-N 187.243 -1.319 50 10 AAGE [C-]#[N+][C@@]12O[C@@H]1[C@](O)([C@@H](C)O)[C@H]1O[C@H]12 307100298 GVXPCFBDZAWTNL-CEWDUOPYSA-N 183.163 -1.106 50 10 AAGE N#CC1=C[C@H](O)[C@@H](O)[C@@H](O)C1 307405095 JPADHRXNLSKNGS-LYFYHCNISA-N 155.153 -1.077 50 10 AAGE O=[N+]([O-])c1cccc(O)c1B(O)O 307424591 DOFJRTIPTXQJIH-UHFFFAOYSA-N 182.928 -1.020 50 10 AAGE NNc1ccc(B(O)O)c(O)c1 307652910 ONDVDQIAAGDXHR-UHFFFAOYSA-N 167.961 -1.642 50 10 AAGE N[C@@H]1CNN[C@@H]1Cl 585663005 ICHFHKGIMZPYIE-GBXIJSLDSA-N 121.571 -1.014 50 10 AAGE O=C(CCl)N[C@@H]1C(=O)OC[C@H]1O 675078902 BBUFMJHMKSFHLZ-WUJLRWPWSA-N 193.586 -1.372 50 10 AAGE CC[C@@H](C(=O)NN)N1C#CNN1 885308611 QQQOAHZXWFZQLH-YFKPBYRVSA-N 169.188 -2.002 50 10 AAGE CN(NC(=O)CCO)S(C)(=O)=O 1888562412 URQSTPWLFXAFTE-UHFFFAOYSA-N 196.228 -1.709 50 10 AAGE C=CC(=O)Nc1ncccc1B(O)O 1913676208 IGQHBXHFBACOJX-UHFFFAOYSA-N 191.983 -1.114 50 10 AAGE C[C@@]1(O)CON(CCC(=O)NN)C1 1930292160 VVCPVMKTRHONON-ZETCQYMHSA-N 189.215 -1.635 50 10 AAGE C#CCC(=O)N[C@H](CB(O)O)C(=O)O 1955592656 RZPCGYUOGTVLHK-RXMQYKEDSA-N 198.971 -1.948 50 10 AAGE CC1CN(c2ncncc2B(O)O)C1 1956963635 QTAKKSGVRHNNIV-UHFFFAOYSA-N 193.015 -1.388 50 10 AAGE CCn1ncc(B(O)O)c1OC 2059968922 SWFPWPIUDHHGPL-UHFFFAOYSA-N 169.977 -1.409 50 10 AAGE NC(=O)NN[C@H]1CC=NN1C(N)=O 167357902 KOFXPGOWCLOPSR-GSVOUGTGSA-N 186.175 -1.744 50 10 AAGE C[C@H](B(O)O)N1CC[C@H](N)C1=O 195831844 LNNSDUKNRSVWPP-UHNVWZDZSA-N 171.993 -2.054 50 10 AAGE ON/N=C/c1cccc(B(O)O)c1 200994810 ATWHUABUXNZVSN-WEVVVXLNSA-N 179.972 -1.321 50 10 AAGE C[C@@H](CC(=O)NN)N1CC[C@@H](O)C1 216476859 QZEWQUBOVMXGKP-NKWVEPMBSA-N 187.243 -1.179 50 10 AAGE Cn1nnc2cc(B(O)O)ccc21 231404635 PINIDCIFYIQGGX-UHFFFAOYSA-N 176.972 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NNC(=O)N1CC[C@H](O)[C@H](O)CC1 2241587177 JTLPUPNMMHNJNU-OLQVQODUSA-N 189.215 -1.613 50 10 AAGE Cc1nc(C(=O)NN)no1 70601482 CUCHTJXXEGMOHH-UHFFFAOYSA-N 142.118 -1.018 50 10 AAGE NNC(=O)CCCON 139841210 IBBWJTXJDYWPLX-UHFFFAOYSA-N 133.151 -1.353 50 10 AAGE Nc1cncc(B(O)O)n1 196314874 RYMVCLFBGNUYSG-UHFFFAOYSA-N 138.923 -2.261 50 10 AAGE in-vitro CC(C)[C@H](N)C(=O)N(C)CB(O)O 207104899 HIVUNYKYSIKGIF-LURJTMIESA-N 188.036 -1.560 50 10 AAGE C[C@@H](O)[C@@H](O)/C=C/C=NNC(N)=O 308000145 SWKXUMHVDGLSRT-GQHALTOZSA-N 187.199 -1.062 50 10 AAGE C[C@H]1COC[C@@H]1N(C)CC(=O)NN 688148901 VSWRGSKDKGKMES-BQBZGAKWSA-N 187.243 -1.057 50 10 AAGE Cn1ncc(CN)c1C(=O)NN 719251548 WQYZCVQBCINBCU-UHFFFAOYSA-N 169.188 -1.518 50 10 AAGE C[C@@H](COCC(=O)NN)N(C)C 1880639097 FMPCWIIEOLMRBC-LURJTMIESA-N 175.232 -1.057 50 10 AAGE CN(C)CC(=O)NCC#CB(O)O 1883733652 XNABMEJURRWCRV-UHFFFAOYSA-N 184.004 -2.320 50 10 AAGE NNC(=O)CCN1C[C@@H]2C[C@H](C1)O2 1883764998 RBAQCOPVFAHDMO-KNVOCYPGSA-N 185.227 -1.161 50 10 AAGE C[C@@H](C(=O)NN)N1CC2(CC[C@H]2O)C1 1885318371 MSPNENDYJXHHIR-NKWVEPMBSA-N 199.254 -1.179 50 10 AAGE NNC(=O)CCN1CCC=C[C@@H]1CO 1885807426 CLQYIUUAZZSORK-MRVPVSSYSA-N 199.254 -1.011 50 10 AAGE NC[C@]12C[C@H](C1)[C@H](C(=O)NN)CO2 1891766362 YNFPSCMQNVREMB-JKMUOGBPSA-N 185.227 -1.270 50 10 AAGE NNC(=O)C(=O)N1C[C@H](O)C12CCC2 1900923134 VODZNWXWTDXGCH-YFKPBYRVSA-N 199.210 -1.898 50 10 AAGE OB(O)CNCc1cncnc1 1923810716 NMQPFQAWALJIEO-UHFFFAOYSA-N 166.977 -1.422 50 10 AAGE NNC(=O)C(=O)N1C[C@H](O)[C@@H](F)C1 1929911938 BRZPTQWNOQJTEV-IMJSIDKUSA-N 191.162 -2.483 50 10 AAGE NNC(=O)C(=O)N[C@H]1C[C@@H]2OCC[C@H]12 1931663978 ZCQNEBNDSKFBDE-SRQIZXRXSA-N 199.210 -1.730 50 10 AAGE C[C@@H](NC(=O)NNCCO)C(=O)O 1935201916 SYOQDIDTQVRVFG-SCSAIBSYSA-N 191.187 -1.744 50 10 AAGE O=C(NNCCO)c1cc(O)ncn1 1956395100 WQYICXYAOITCLI-UHFFFAOYSA-N 198.182 -1.591 50 10 AAGE NCCONC(=O)C1(B(O)O)CC1 2241478281 BIMJPDOLAMEQMX-UHFFFAOYSA-N 187.992 -2.000 50 10 AAGE N[C@@]12C[C@H]1CN(C(=O)C#CB(O)O)C2 2241479219 UDYOOCZASFBNNI-POYBYMJQSA-N 193.999 -2.439 50 10 AAGE O=C(NO)c1ccoc1B(O)O 2241583612 ARYGFNBGJMUFJZ-UHFFFAOYSA-N 170.917 -1.922 50 10 AAGE C[C@H]1CN(CC(=O)NN)CCO1 82466153 BJMICTPVJLCMOV-LURJTMIESA-N 173.216 -1.303 50 10 AAGE C[C@@](O)(C#N)CC(=O)NN 140203579 MTZZVNDROXPBIM-YFKPBYRVSA-N 143.146 -1.359 50 10 AAGE CO[C@H]1CN[C@@H](C(=O)NN(C)C)C1 147239890 DQCBPCPPFPTUBB-RNFRBKRXSA-N 187.243 -1.044 50 10 AAGE CCCOc1ncc(B(O)O)cn1 198019931 ZLKBIZWGWWVVJF-UHFFFAOYSA-N 181.988 -1.055 50 10 AAGE NNC(=O)N[C@H]1CONC1=O 307210891 NCJTWNOZZIXCGX-REOHCLBHSA-N 160.133 -2.411 50 10 AAGE O=[N+]([O-])c1ccc(B(O)O)c(O)c1 307297639 UTTKALATZMTKCT-UHFFFAOYSA-N 182.928 -1.020 50 10 AAGE O[C@H]1OC[C@H](Cl)[C@H](O)[C@H]1O 307543518 AGEHHWLQJBQEJJ-KLVWXMOXSA-N 168.576 -1.336 50 10 AAGE N[C@H](CO)C(=O)NN=Cc1ncc[nH]1 308254478 BHCRYFQQEFOZMR-RXMQYKEDSA-N 197.198 -1.821 50 10 AAGE CC(=NNC(N)=O)c1no[nH]c1=N 383479666 VGJUWGZZNWCYTC-UHFFFAOYSA-N 184.159 -1.126 50 10 AAGE CN(C)NC(=O)[C@]12CNC[C@@H]1CCO2 705033347 AFJQZSSGXKVBNU-CBAPKCEASA-N 199.254 -1.042 50 10 AAGE CN(CC(N)=O)C1=C=C=C(C#N)NN1 885573117 GSUJFODKPDNOPO-UHFFFAOYSA-N 191.194 -1.486 50 10 AAGE COC(=O)NNC(=O)CO 1334123692 KYIVEELBRBQZIB-UHFFFAOYSA-N 148.118 -1.634 50 10 AAGE C[C@H](C(=O)NN)N1C[C@@H](O)[C@H](F)C1 1929912932 MTVYMMZHYJKXGL-HSUXUTPPSA-N 191.206 -1.621 50 10 AAGE NNC(=O)N1C[C@@H]2OCCO[C@@H]2C1 1930254188 SFZIZWIOBAPLDU-OLQVQODUSA-N 187.199 -1.331 50 10 AAGE Cc1nc(CN(C)CC(=O)NN)no1 1955516463 ROMTWOXEDQBZQN-UHFFFAOYSA-N 199.214 -1.200 50 10 AAGE CN(C)NC(=O)c1cc(B(O)O)n[nH]1 2241478222 AMOOTZIHLIGBAQ-UHFFFAOYSA-N 197.991 -2.704 50 10 AAGE CN(C)C1CN(C(=O)C#CB(O)O)C1 2241479501 ZHOFIEREBGHEJE-UHFFFAOYSA-N 196.015 -2.226 50 10 AAGE C[C@@H]1CN(CC(=O)NN)CC[C@@H]1O 127605212 ALXXMWQCIOXTEF-RQJHMYQMSA-N 187.243 -1.321 50 10 AAGE NNC(=O)CC[C@H](O)CC(=O)NN 196117113 AMHXSLVBLRKNPK-BYPYZUCNSA-N 190.203 -2.503 50 10 AAGE COC(=O)NNC(=O)NC(N)=O 238314865 FJSGFUWBLYFNIJ-UHFFFAOYSA-N 176.132 -1.365 50 10 AAGE Cn1cc(/C=N/NC(=O)CO)cn1 306176204 JFCWUZYMBQOVBZ-KRXBUXKQSA-N 182.183 -1.138 50 10 AAGE C[C@@H](NC(=O)NNC(N)=O)C(N)=O 306187545 AAMNNIDJILIAQN-UWTATZPHSA-N 189.175 -2.257 50 10 AAGE NNc1cc(C=O)cc(B(O)O)c1 306605636 QBZDYDVHTDNBQW-UHFFFAOYSA-N 179.972 -1.536 50 10 AAGE C=C(C#N)C[C@H](O)[C@H](O)[C@@H](O)CO 308192553 KMVUDXPMQMKZOL-FXQIFTODSA-N 187.195 -1.469 50 10 AAGE N#C[C@H]1CCN(CC(=O)NN)C1 606250968 TXOHWWMBAWJUSQ-ZCFIWIBFSA-N 168.200 -1.178 50 10 AAGE CCOC(C)(C)C(=O)NCB(O)O 702016968 CNJJOHRAKNPBAO-UHFFFAOYSA-N 189.020 -1.070 50 10 AAGE O=C1CCC[C@H]1n1cc(B(O)O)cn1 716784406 QDWMMVNDZCVUFR-SSDOTTSWSA-N 193.999 -1.143 50 10 AAGE O=C(NCC=CB(O)O)C1COC1 1883502452 SFIPMGZCURAQCA-UHFFFAOYSA-N 184.988 -1.683 50 10 AAGE NNC(=O)[C@@H]1CN2CCN1CC2 1934628608 URHCNZOGLBQLSH-LURJTMIESA-N 170.216 -2.024 50 10 AAGE C[C@H](O)[C@H](N)[C@@H](O)C#N 1952796174 VBCDNPYVVBRROZ-YUPRTTJUSA-N 130.147 -1.421 50 10 AAGE Cn1cc([C@H](N)[C@H](O)C#N)nn1 1952952769 PBBXMSUCMYVIJU-RITPCOANSA-N 167.172 -1.301 50 10 AAGE CN(c1ncncc1B(O)O)C1CC1 1956963927 RGWAZLRYFACBKI-UHFFFAOYSA-N 193.015 -1.245 50 10 AAGE C[C@H]1C[C@H]1Oc1ncncc1B(O)O 1956971309 WNFRTKNPDDOFKC-CAHLUQPWSA-N 193.999 -1.056 50 10 AAGE C[C@H](CO)Nc1cc(B(O)O)ccn1 2210061406 TVTZUNUFUUEGMI-ZCFIWIBFSA-N 196.015 -1.446 50 10 AAGE O=C(C#CB(O)O)NC1CC(F)C1 2241468474 OZIHWRXGIMVAAI-UHFFFAOYSA-N 184.963 -1.382 50 10 AAGE CNC[C@@H](C)NC(=O)C#CB(O)O 2241478951 OEHXHYCSHOKEGX-ZCFIWIBFSA-N 184.004 -2.274 50 10 AAGE O=C(C#CB(O)O)N[C@@H](CO)C1CC1 2241479043 QJEQOPULFRRQBJ-ZETCQYMHSA-N 196.999 -2.111 50 10 AAGE CC(=O)NNC(=O)CN(C)O 2242398427 QBBIZKSVZNBIAY-UHFFFAOYSA-N 161.161 -1.525 50 10 AAGE O=C1NCC2=C(N1)C(=O)OC2=O 100205020 HEMYFTMKAVMYIG-UHFFFAOYSA-N 168.108 -1.363 50 10 AAGE COCCNCC(=O)NN(C)C 147314867 YECBNQGDNFXSPW-UHFFFAOYSA-N 175.232 -1.185 50 10 AAGE NNC(=O)CN1CC[C@](O)(CO)C1 307525958 HIQDSFVACBZRDF-SSDOTTSWSA-N 189.215 -2.595 50 10 AAGE C[C@H](NC(N)=O)C(=O)NCB(O)O 706512362 UJWRDCOFXAVZIO-VKHMYHEASA-N 188.980 -2.829 50 10 AAGE CC1=C=C(CNC(=O)C(=O)NN)ON1 885890129 ZMVVPPXNLQZQJN-UHFFFAOYSA-N 198.182 -1.986 50 10 AAGE N[C@@]1(B(O)O)C2C[C@@H]3C1[C@@H]3C2 1916937472 CWEDDDLIAXZOMU-QEEGBHKWSA-N 152.990 -1.018 50 10 AAGE OB(O)c1ncnn1-c1ccccc1 1956970491 UHPKDTHYPMVFBY-UHFFFAOYSA-N 188.983 -1.053 50 10 AAGE O=C(C#CB(O)O)NCCCO 2241468981 XZNUSADWGGRYQT-UHFFFAOYSA-N 170.961 -2.500 50 10 AAGE CCNC(=O)c1c(B(O)O)nnn1C 2241472963 ANNDYRJOXKQKJT-UHFFFAOYSA-N 197.991 -2.755 50 10 AAGE CON(CC1CC1)C(=O)C#CB(O)O 2242153631 DADCBWRZWRGIQT-UHFFFAOYSA-N 196.999 -1.198 50 10 AAGE CC[C@@H](O)C(=O)NN 32182430 YOYWDQRJJZUVRG-GSVOUGTGSA-N 118.136 -1.253 50 10 AAGE OB(O)c1ccnnc1Cl 238631116 JURVIQRFPBBCKK-UHFFFAOYSA-N 158.353 -1.190 50 10 AAGE NNC(=O)N1CCOC[C@@H](O)C1 306739232 SCDGGNOWTKDQCH-YFKPBYRVSA-N 175.188 -1.737 50 10 AAGE CNCC(=O)NNC(=O)C1CC1 307948197 AKOKMHBNJLAGKA-UHFFFAOYSA-N 171.200 -1.237 50 10 AAGE COC1CN(C[C@@H](C)C(=O)NN)C1 308185929 FNWFNZUGOHDFIF-ZCFIWIBFSA-N 187.243 -1.057 50 10 AAGE NNC(=O)CN1CC[C@H](N2CCC2)C1 702303412 XRQPNJVLTWHSBB-QMMMGPOBSA-N 198.270 -1.244 50 10 AAGE O=C(NCB(O)O)[C-]1C#CSN1 885493175 CRXPIMLIQDESFO-UHFFFAOYSA-N 184.993 -2.141 50 10 AAGE C=C(CN1[C@H]2C[C@@H]1CN(C)C2)B(O)O 1895213406 ZSLVHBFPRUVFEW-DTORHVGOSA-N 196.059 -1.057 50 10 AAGE CN1C[C@@H]2C[C@H](C1)CN2CC(=O)NN 1955513992 OJSBKWARIIWELS-SFYZADRCSA-N 198.270 -1.388 50 10 AAGE COCn1cc(B(O)O)cnc1=O 2209395991 NDKLQRXEKNQIMF-UHFFFAOYSA-N 183.960 -2.473 50 10 AAGE C[C@@H](O)C1(NC(=O)C#CB(O)O)CC1 2241467835 BRXGNQNXZHQHQC-ZCFIWIBFSA-N 196.999 -1.969 50 10 AAGE O=C(C#CB(O)O)NCC1CCC1 2241475999 JQGHVNPXPYTORX-UHFFFAOYSA-N 181.000 -1.082 50 10 AAGE N#CCNC(=O)C#CB(O)O 2241478879 MTFQYCHVQJOHKC-UHFFFAOYSA-N 151.918 -2.358 50 10 AAGE COC[C@@H](N)C(=O)NN(C)C 147258707 KDHOBKQSNRQZMZ-RXMQYKEDSA-N 161.205 -1.447 50 10 AAGE Cc1noc(B(O)O)n1 200988003 RRORPWYKMFLSST-UHFFFAOYSA-N 127.896 -1.942 50 10 AAGE C=C(C#N)C[C@H](O)[C@H](O)C(=O)CO 214277441 OKEYZYDECWWZDQ-XPUUQOCRSA-N 185.179 -1.261 50 10 AAGE O=[N+]([O-])c1cc(F)cnc1B(O)O 238638809 QGWOMMQPCYMFDF-UHFFFAOYSA-N 185.907 -1.191 50 10 AAGE CO[C@H]1C[C@H](C(=O)NN)N(C)C1 307155841 WEWGHEBGPCJNLS-NTSWFWBYSA-N 173.216 -1.305 50 10 AAGE NNC(=O)CC1(N)CC1 307722353 YLSZWYICHZLWJX-UHFFFAOYSA-N 129.163 -1.142 50 10 AAGE COC[C@@H](O)C(=O)NNC(C)=O 308142621 ICXQCXFXJXVZGE-RXMQYKEDSA-N 176.172 -1.839 50 10 AAGE CC(=NNC(N)=O)C(=O)NN 378973198 RSGBJBZGMSNKHG-UHFFFAOYSA-N 159.149 -1.980 50 10 AAGE NC(=S)NNC(=O)Cn1ccnc1 700858775 RQTCEXGQFVRUQK-UHFFFAOYSA-N 199.239 -1.253 50 10 AAGE C[C@H]1CN[C@@H]1C(=O)NN 1934540922 PBYSZRFJYAWQGO-IMJSIDKUSA-N 129.163 -1.416 50 10 AAGE CC[C@@H](O)[C@H](C)NC(=O)C#CB(O)O 2241478553 HVVMPLUNHPIPJO-NKWVEPMBSA-N 199.015 -1.723 50 10 AAGE O=C(N[C@@H]1C[C@@H]1CO)[C@H]1C[C@H]1B(O)O 2241481932 XGAYUUORAGYVJR-XZBKPIIZSA-N 199.015 -1.654 50 10 AAGE NNC(=O)CN(CC(=O)NN)N=O 4428972 DECWURIPUMFHLD-UHFFFAOYSA-N 190.163 -3.050 50 10 AAGE in-vitro N#Cc1ncn(CCCC(=O)NN)n1 82471707 NHVVNPUQDACZHY-UHFFFAOYSA-N 194.198 -1.080 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](O)[C@H](Cl)[C@@H]1O 101185574 CRJLKIILIKSPDH-BSQWINAVSA-N 198.602 -1.975 50 10 AAGE N[C@H](CSCB(O)O)C(=O)O 215852389 UZXPKUFDWMYDBE-GSVOUGTGSA-N 179.006 -1.857 50 10 AAGE NNC(=O)CN1C[C@@H](O)[C@@H](CO)C1 306172604 BGBYKGMZWKSGJC-PHDIDXHHSA-N 189.215 -2.739 50 10 AAGE C[C@@H](C(=O)NN)N1CC(O)C1 307258466 FSQAHHWULLRNSM-BYPYZUCNSA-N 159.189 -1.959 50 10 AAGE CN(C)NC(=O)[C@]1(C)CNCCO1 710704205 SINHMKHSALLALS-QMMMGPOBSA-N 187.243 -1.042 50 10 AAGE CNNC(=O)[C-]1C#CSN1 885259032 CGROZAPNRQZWET-UHFFFAOYSA-N 156.190 -1.019 50 10 AAGE NNC(=O)N[C@H]1[C@H]2OCC[C@@H]21 1880147377 DOIMSZMMYDDCDB-WDCZJNDASA-N 157.173 -1.053 50 10 AAGE N=c1cc(B(O)O)c(F)c[nH]1 1880251779 GOEUVLUWRSRAIP-UHFFFAOYSA-N 155.925 -1.687 50 10 AAGE C[C@@H]1[C@H](O)CN1CC(=O)NN 1880270997 DUIIWAVQIPWFEZ-RFZPGFLSSA-N 159.189 -1.959 50 10 AAGE C[C@]1(O)CON(C(=O)C(=O)NN)C1 1930291476 MDYAJGVMRSONNP-ZCFIWIBFSA-N 189.171 -2.499 50 10 AAGE NNC(=O)[C@]1(CF)CCNC1 1966771559 NYAVYJLMHRASHF-LURJTMIESA-N 161.180 -1.075 50 10 AAGE Cn1nnc(B(O)O)c1C(=O)NN 2241473081 CKCWBYVBGJTTON-UHFFFAOYSA-N 184.952 -3.902 50 10 AAGE C[C@@H](O)CNC(=O)C1(B(O)O)CC1 2241473818 QPVZKHYACWMFRX-RXMQYKEDSA-N 187.004 -1.510 50 10 AAGE N[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2B(O)O)C1 2241480204 FYXURJISPYYXNO-VQVTYTSYSA-N 198.031 -1.591 50 10 AAGE C#CC(=O)Nc1cccc(B(O)O)n1 2241562684 ROYWLCZMQDIGEV-UHFFFAOYSA-N 189.967 -1.667 50 10 AAGE NNC(=O)C(=O)N1C[C@@H]2C[C@H](C1)[C@@H]2O 2241833006 LJEDBITUVSMVGN-FMCRUOTFSA-N 199.210 -2.185 50 10 AAGE O=C(CO)NNC(=O)CO 146064143 PTJATISFXBFIKT-UHFFFAOYSA-N 148.118 -2.882 50 10 AAGE OCC/C=C\B(O)O 201022960 XSUJWDLJOMBWKI-IWQZZHSRSA-N 115.925 -1.063 50 10 AAGE OB(O)c1ccc(-n2cncn2)nc1 204316667 MQUZJZBBAURAIB-UHFFFAOYSA-N 189.971 -1.658 50 10 AAGE CCc1ccc(B(O)O)c(N)n1 238345917 DZEXOBIDSUWOMI-UHFFFAOYSA-N 165.989 -1.094 50 10 AAGE Cc1cc(B(O)O)cnc1CC(=O)O 238454305 MAKDALPQXKHTBX-UHFFFAOYSA-N 194.983 -1.303 50 10 AAGE N=C1N/C(=N/N)N[C@H](Cl)N1 238552413 RBRSVVMYGOUDPQ-PVQJCKRUSA-N 162.584 -1.544 50 10 AAGE O=C1C(CO)=C[C@H](O)[C@@H](O)[C@@H]1Cl 238701882 JUFBJBDOBZYSDT-HBPOCXIASA-N 192.598 -1.183 50 10 AAGE Cn1cnc2c([B-](O)(O)O)nccc21 238856112 UUORQHKALOAOAJ-UHFFFAOYSA-N 193.979 -1.909 50 10 AAGE OC[C@@H]1O[C@H](O)[C@H](O)[C@H](O)[C@H]1Cl 306313000 UDOJFSFHKNQOHC-YJRYQGEOSA-N 198.602 -1.975 50 10 AAGE COC[C@H](C(=O)NN)N1CCC1 379313621 IWXBJUDIDWLWQJ-ZCFIWIBFSA-N 173.216 -1.303 50 10 AAGE CN(C[C@@H](O)CCl)C(CO)CO 388416812 FLOBRXJOPFZUPI-ZETCQYMHSA-N 197.662 -1.129 50 10 AAGE O=C/C(O)=C(/O)[C@H](O)CO 393563487 XWBKCRSHNITEJC-YZRPVEKSSA-N 148.114 -1.134 50 10 AAGE NNC(=O)CN1CC(n2cncn2)C1 707391357 KRDHKAFXRXIKSX-UHFFFAOYSA-N 196.214 -1.875 50 10 AAGE NNC(=O)C(=O)NCCOC1CC1 714968555 AHSDBUGZWHSVHH-UHFFFAOYSA-N 187.199 -1.729 50 10 AAGE CNC(=O)c1ccc(N)cc1B(O)O 1565503776 UBCXKHHWRJXSRM-UHFFFAOYSA-N 193.999 -1.692 50 10 AAGE CCS(=O)(=O)N(C)NC(=O)CN 1888598373 GJBASPUPUBETSH-UHFFFAOYSA-N 195.244 -1.742 50 10 AAGE NNC(=O)NCC[C@@H]1COCCO1 1931783729 QGZONOOGVFBRID-ZCFIWIBFSA-N 189.215 -1.035 50 10 AAGE COC[C@@H]1C[C@H]1NC(=O)C(=O)NN 1954201743 AYLKXYXIBWQWRV-CRCLSJGQSA-N 187.199 -1.873 50 10 AAGE O=C(C#CB(O)O)N1N[C@H]2CC[C@H]1C2 2241467850 BWECEQILYZJWJK-BQBZGAKWSA-N 193.999 -1.730 50 10 AAGE O=C(C#CB(O)O)N[C@@H]1C[C@H]1F 2241468021 FYVRCYAUYDLHMY-RFZPGFLSSA-N 170.936 -1.772 50 10 AAGE CC(=O)NC(=O)C#CB(O)O 2241478899 NGKSMYRLZLHKQM-UHFFFAOYSA-N 154.918 -2.336 50 10 AAGE CN(C)C(=O)c1cocc1B(O)O 2241748752 LGNQSFREOCGCEW-UHFFFAOYSA-N 182.972 -1.339 50 10 AAGE COCC(=O)NCCC#CB(O)O 2241908157 UFDFHRFEPNBYEA-UHFFFAOYSA-N 184.988 -1.846 50 10 AAGE O=C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CCl 5131824 ZHVNVPHMOCWHHO-FSIIMWSLSA-N 198.602 -2.132 50 10 AAGE NNC(=O)C(=O)N1CCSCC1 36948123 NROYYTSWGKPRDP-UHFFFAOYSA-N 189.240 -1.448 50 10 AAGE C[C@H](O)CNC[C@@H](C)C(=O)NN 58837090 YUUJZTVUSKTORE-RITPCOANSA-N 175.232 -1.417 50 10 AAGE CC(=O)NC[C@@H](O)CC(=O)NN 140536343 BJDOQCCNDCFDJD-YFKPBYRVSA-N 175.188 -2.137 50 10 AAGE C[C@H](OC1COC1)C(=O)NN 165765817 KWICUMKBCNAUCF-BYPYZUCNSA-N 160.173 -1.220 50 10 AAGE NC(=O)Nc1ccccc1B(O)O 196638223 PNHBHQHWPPGKRS-UHFFFAOYSA-N 179.972 -1.143 50 10 AAGE COC(=O)c1cc(B(O)O)cnc1N 238338155 JALKUZIAQLBYCY-UHFFFAOYSA-N 195.971 -1.870 50 10 AAGE CC(C=NNC(=N)N)=NNC(N)=O 263606816 RHTWEPBSGTWFMK-UHFFFAOYSA-N 185.191 -1.501 50 10 AAGE NCc1nc2ccc(B(O)O)cc2o1 307040288 IFSHDVHCVVLHKG-UHFFFAOYSA-N 191.983 -1.034 50 10 AAGE CNC(=O)C1(C(=O)NN)CC1 307271087 QXZJIQDEHFRVRQ-UHFFFAOYSA-N 157.173 -1.498 50 10 AAGE C[C@H]1OCCN[C@H]1C(=O)NN 307307827 NIDIHNNXBZHZIE-RFZPGFLSSA-N 159.189 -1.647 50 10 AAGE CC(=O)N/N=C(\N)CC(=O)O 307592795 FZHQJHVUOAQOHN-UHFFFAOYSA-N 159.145 -1.131 50 10 AAGE OB(O)c1cn2c(n1)CCCC2 575465099 NWDKRVVSQPYMQA-UHFFFAOYSA-N 165.989 -1.101 50 10 AAGE C#CC(=O)NCB(O)O 575563900 ZIMHIHADXVULIW-UHFFFAOYSA-N 126.908 -2.252 50 10 AAGE COC[C@H]1CN(C(=O)NN)CCO1 705868970 HCXXTKYORGYJQE-ZCFIWIBFSA-N 189.215 -1.083 50 10 AAGE N#CCCC[C@@H](N)C(=O)NN 709428325 POBSWAXJWZTQGI-RXMQYKEDSA-N 156.189 -1.003 50 10 AAGE NNC(=O)[C@H]1C=CCN1 1879951038 BCPKWKPGIWWVJO-SCSAIBSYSA-N 127.147 -1.496 50 10 AAGE CC(C)(N)C#CC(=O)NN 1880128729 UMWWTAQVDYIKMB-UHFFFAOYSA-N 141.174 -1.283 50 10 AAGE NNC(=O)[C@@H]1C[C@H]1CN1CC[C@@H]1CO 1929741542 QXWDLOKKXNMSTF-XLPZGREQSA-N 199.254 -1.321 50 10 AAGE O=C(O)[C@@H]1C[C@H]1C(=O)NNCCO 1929832776 YKZKYAWJRWDXLT-RFZPGFLSSA-N 188.183 -1.680 50 10 AAGE CCn1cncc1B(O)O 1931529786 ONRRYFSMMTUEPZ-UHFFFAOYSA-N 139.951 -1.417 50 10 AAGE CO[C@H](C)[C@H](C)NC(=O)C(=O)NN 1954534763 ASHLDMYGXBOHDB-CRCLSJGQSA-N 189.215 -1.484 50 10 AAGE C[C@@H](CN)Nc1ccc(B(O)O)cn1 2210059771 CXIDLIOFSOAUCR-LURJTMIESA-N 195.031 -1.480 50 10 AAGE NNC(=O)c1c[nH]ccc1=O 39136531 CAGQRMISNXJBNR-UHFFFAOYSA-N 153.141 -1.022 50 10 AAGE CC[C@H](CO)NC[C@@H](C)C(=O)NN 58852175 PVVFGZPBSULDHN-RNFRBKRXSA-N 189.259 -1.027 50 10 AAGE COC(=O)[C@@H](N)CCB(O)O 170026873 LHKXGHNWQIKZII-BYPYZUCNSA-N 160.966 -1.650 50 10 AAGE O=CC(C=O)=CN[C@@H](CO)C(=O)O 238705798 FKIAIDDDOMVECY-LURJTMIESA-N 187.151 -1.697 50 10 AAGE CCS(=O)(=O)CC(=O)NN 306600142 ZGVHQZDLKYIKAL-UHFFFAOYSA-N 166.202 -1.589 50 10 AAGE NNC(=O)C(=O)NCc1cocn1 307158678 BPDDZEXUWRYFIK-UHFFFAOYSA-N 184.155 -1.719 50 10 AAGE COCC(=O)NN[C@@H]1CCNC1=O 379394364 XCLRMZVXHAKDRK-RXMQYKEDSA-N 187.199 -1.858 50 10 AAGE NNC(=O)CCN1CC(O)(C2CC2)C1 383973205 JIPDKTZKWCCXDC-UHFFFAOYSA-N 199.254 -1.177 50 10 AAGE CN(CC(=O)NN)Cc1cnccn1 704122512 LQOIBULWVYGQPZ-UHFFFAOYSA-N 195.226 -1.102 50 10 AAGE NNC(=O)CN1CCOC[C@@H]1CF 1882475785 BOEKEXNQNQNAFI-LURJTMIESA-N 191.206 -1.353 50 10 AAGE CNC(=O)c1cc(B(O)O)ccc1N 1885668362 MSRADNNZTXQNQE-UHFFFAOYSA-N 193.999 -1.692 50 10 AAGE OB(O)[C@@H]1CCN(C[C@H](O)CF)C1 1891517597 QIFUMPQQCPBLTO-RNFRBKRXSA-N 191.011 -1.135 50 10 AAGE NNC(=O)C(=O)N1CC[C@H]2C[C@]2(O)C1 1956822725 YKBDVSJOXSAPSD-XNCJUZBTSA-N 199.210 -2.040 50 10 AAGE CN(N)C(=O)C(C)(CO)CO 2241246314 PDGJZIDNDHDKNX-UHFFFAOYSA-N 162.189 -1.691 50 10 AAGE C[C@@H]1C[C@@H]1N(C)C(=O)C#CB(O)O 2241476307 PIONYROGKCBWMW-RQJHMYQMSA-N 181.000 -1.131 50 10 AAGE CCN(O)C(=O)c1cc(B(O)O)c[nH]1 2241479283 VQDNUPCCADRGOS-UHFFFAOYSA-N 197.987 -1.454 50 10 AAGE N#CC1(O)CCN(C[C@@H](N)CO)CC1 2241777361 DPKBWJBPZUVYGN-MRVPVSSYSA-N 199.254 -1.344 50 10 AAGE O=C=NS(=O)(=O)N1CCOCC1 84453225 KVTSTPRTIKQRCH-UHFFFAOYSA-N 192.196 -1.101 50 10 AAGE O=C(O)[C@@H](OO)[C@H](OO)C(=O)O 100879196 CVKNOSPZPWFPFV-LWMBPPNESA-N 182.084 -1.128 50 10 AAGE O=C[C@H](O)[C@H](O)[C@@H](Cl)CO 238703798 NIYUURYBBLTWQM-VAYJURFESA-N 168.576 -1.493 50 10 AAGE NC(=O)NN=CCO 307825573 UMQZEIGEFYQAQK-UHFFFAOYSA-N 117.108 -1.367 50 10 AAGE C[C-]1OC(C(=O)NN)=C=C1CO 642816039 RHFNZCCPMXFOAO-UHFFFAOYSA-N 169.160 -1.040 50 10 AAGE O=C1NC(=O)c2cc(B(O)O)ccc21 716783586 GXYHOTUIKSBWCZ-UHFFFAOYSA-N 190.951 -1.750 50 10 AAGE NNC(=O)CN1CC[C@H](O)C12CCC2 1914396815 RQHBNANSZFYRLY-ZETCQYMHSA-N 199.254 -1.034 50 10 AAGE NC[C@@H]1CCN(CC(=O)NN)C1 82468087 NBZQNZNRPAAYRZ-LURJTMIESA-N 172.232 -1.743 50 10 AAGE C#Cc1ccnc(B(O)O)c1 209835574 XNHSYEHEDGOZKN-UHFFFAOYSA-N 146.942 -1.257 50 10 AAGE CC1(C)[C@H](C(=O)NN)[C@H]1C(=O)NN 216139704 CJSONMREASNKSX-IMJSIDKUSA-N 186.215 -1.762 50 10 AAGE Nc1cc([N+](=O)[O-])ccc1B(O)O 224667103 CEJNUUZGRMBXCE-UHFFFAOYSA-N 181.944 -1.143 50 10 AAGE C[C@@H]1CN(CC(=O)NN)C[C@@H]1O 307323738 HDRDSKKVTLFGJE-RITPCOANSA-N 173.216 -1.711 50 10 AAGE CN(CCCCO)C(=O)C(=O)NN 384789945 VHLSUBYBVVMDFO-UHFFFAOYSA-N 189.215 -1.793 50 10 AAGE OB(O)[C@H]1CCNN1 585665594 WSSIHCIFZJXXRF-GSVOUGTGSA-N 115.929 -2.135 50 10 AAGE O=C1C[C@H](C(=O)NCB(O)O)CN1 702027977 BFSWLHIYHDZYIA-BYPYZUCNSA-N 185.976 -2.749 50 10 AAGE Cn1cnc(/C=C/B(O)O)n1 714843409 LCDLFWNKBPRKAX-NSCUHMNNSA-N 152.950 -1.160 50 10 AAGE NC[C@@H]1C[C@@H]1C(=O)NN 715094243 FMQZVGAWTYRYCY-IMJSIDKUSA-N 129.163 -1.429 50 10 AAGE NC[C@@H](CO)NC(=O)F 1879973888 QSEROSRYYUUKTE-VKHMYHEASA-N 136.126 -1.015 50 10 AAGE O=C(F)N[C@H]1CNC[C@@H]1O 1880063875 JJFMQIHKNFOJST-IMJSIDKUSA-N 148.137 -1.002 50 10 AAGE NNC(=O)[C@@H]1NCC[C@H](O)[C@H]1O 1880971819 BVGFLHUCXYMWRU-VPENINKCSA-N 175.188 -2.940 50 10 AAGE NC(=O)c1cc(F)c(B(O)O)cc1O 1888374620 TYIRTRRWDZGQKV-UHFFFAOYSA-N 198.946 -1.690 50 10 AAGE NNC(=O)[C@@H]1[C@@H]2NCCO[C@@H]21 1929947283 UVEDMMJVATUIFM-MROZADKFSA-N 157.173 -2.037 50 10 AAGE NC(=O)c1nscc1B(O)O 2241471355 IVZJJDDBTWJFIZ-UHFFFAOYSA-N 171.974 -2.078 50 10 AAGE O=C1CCN1C(=O)C1CC(B(O)O)C1 2241480940 QCZLIFFMWFWWQF-UHFFFAOYSA-N 196.999 -1.002 50 10 AAGE NC(=O)NC(=O)c1c[nH]nc1B(O)O 2241584838 UMWHNRPCWVDXJQ-UHFFFAOYSA-N 197.947 -3.102 50 10 AAGE