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223.703 2.499 20 30 BEEDMN C=C1O[C@H](CC)C(=O)C1OCCCCC#N ZINC001205671907 967761259 /nfs/dbraw/zinc/76/12/59/967761259.db2.gz GDMPFFIHADJAFH-SNVBAGLBSA-N 0 1 223.272 2.306 20 30 BEEDMN C#C[C@H]1CCCN(C(=O)c2ccc(F)cc2O)C1 ZINC000709606783 967951016 /nfs/dbraw/zinc/95/10/16/967951016.db2.gz HVUMFNFTYJRKCG-JTQLQIEISA-N 0 1 247.269 2.017 20 30 BEEDMN Cc1nnc(-c2ccc(O)cc2F)c(C#N)c1C ZINC001206030522 967996449 /nfs/dbraw/zinc/99/64/49/967996449.db2.gz ZOFRTOISXLGZAW-UHFFFAOYSA-N 0 1 243.241 2.477 20 30 BEEDMN Cc1cnc(-c2ccc(O)cc2F)c(C#N)n1 ZINC001206037425 968003051 /nfs/dbraw/zinc/00/30/51/968003051.db2.gz HYYQDSGIDWYITP-UHFFFAOYSA-N 0 1 229.214 2.168 20 30 BEEDMN CC(=O)CC(C)=Nc1cc2ccccc2[n+]([O-])c1 ZINC001163739748 968107534 /nfs/dbraw/zinc/10/75/34/968107534.db2.gz YBTKIMZUYBLIGM-YFHOEESVSA-N 0 1 242.278 2.378 20 30 BEEDMN C#CC[N@@H+](CC(=O)[O-])C[C@@H]1CCCC[C@@H]1CC ZINC000401467383 968302648 /nfs/dbraw/zinc/30/26/48/968302648.db2.gz YRKMRNBZHJKZTJ-STQMWFEESA-N 0 1 237.343 2.223 20 30 BEEDMN C#CC[N@@H+](CC(=O)[O-])C[C@@H]1CCCC[C@H]1CC ZINC000401467381 968302946 /nfs/dbraw/zinc/30/29/46/968302946.db2.gz YRKMRNBZHJKZTJ-OLZOCXBDSA-N 0 1 237.343 2.223 20 30 BEEDMN CCN(CCC#N)c1cc(Cl)nc2nc[nH]c21 ZINC001166591361 968340557 /nfs/dbraw/zinc/34/05/57/968340557.db2.gz BACXZKMIHYKPBA-UHFFFAOYSA-N 0 1 249.705 2.351 20 30 BEEDMN CC(C)c1nnc(Nc2ccnc(C#N)c2)o1 ZINC001206589205 968402497 /nfs/dbraw/zinc/40/24/97/968402497.db2.gz GIBUHQCBDXTSGV-UHFFFAOYSA-N 0 1 229.243 2.203 20 30 BEEDMN CCCC[C@@H](O)CN(CCC)CCC#N ZINC001252087323 968509236 /nfs/dbraw/zinc/50/92/36/968509236.db2.gz ANDVUTFFFYUAJN-GFCCVEGCSA-N 0 1 212.337 2.163 20 30 BEEDMN Cn1cc(CN2CCC[C@@H](CC#N)C2)cc1C#N ZINC001207106310 968634936 /nfs/dbraw/zinc/63/49/36/968634936.db2.gz JJADDRQVOVIDEZ-LBPRGKRZSA-N 0 1 242.326 2.022 20 30 BEEDMN Cn1cc(CN2CCC(C)(F)CC2)cc1C#N ZINC001207103644 968635569 /nfs/dbraw/zinc/63/55/69/968635569.db2.gz ZOZZRNSSEMYHOB-UHFFFAOYSA-N 0 1 235.306 2.221 20 30 BEEDMN N#CCCN(Cc1cc[nH]c(=O)c1)C1CCCC1 ZINC001207122354 968642957 /nfs/dbraw/zinc/64/29/57/968642957.db2.gz LIFSKEIQGBUKHR-UHFFFAOYSA-N 0 1 245.326 2.445 20 30 BEEDMN C=C[C@](C)(O)CNc1nc(C)ccc1C ZINC001252544017 968780657 /nfs/dbraw/zinc/78/06/57/968780657.db2.gz XTTFMGGFHMBLPL-LBPRGKRZSA-N 0 1 206.289 2.047 20 30 BEEDMN N#CCC1CN(CCc2ccc(F)cc2)C1 ZINC001207511885 968809633 /nfs/dbraw/zinc/80/96/33/968809633.db2.gz SZTDUYDAKMUUSR-UHFFFAOYSA-N 0 1 218.275 2.214 20 30 BEEDMN C=C[C@](C)(O)CNCc1c(F)ccc(F)c1F ZINC001252570802 968819825 /nfs/dbraw/zinc/81/98/25/968819825.db2.gz BOEJXRIZFXXLKB-LBPRGKRZSA-N 0 1 245.244 2.131 20 30 BEEDMN COc1cccc(CCCN2CC(CC#N)C2)c1 ZINC001207554823 968820974 /nfs/dbraw/zinc/82/09/74/968820974.db2.gz OEPKULIPBDGBQX-UHFFFAOYSA-N 0 1 244.338 2.473 20 30 BEEDMN C=CCCN(C)c1nc(Cl)nc2[nH]cnc21 ZINC000829246271 968826260 /nfs/dbraw/zinc/82/62/60/968826260.db2.gz JWGDYNKZPCRDTI-UHFFFAOYSA-N 0 1 237.694 2.019 20 30 BEEDMN C#CCCCNc1nc(Cl)nc2[nH]c(C)nc21 ZINC001155010750 968850863 /nfs/dbraw/zinc/85/08/63/968850863.db2.gz RIXGGTCOYRKYLC-UHFFFAOYSA-N 0 1 249.705 2.092 20 30 BEEDMN C[C@H](CC(C)(C)C#N)NCC1(C#N)CCOCC1 ZINC001207773515 968882127 /nfs/dbraw/zinc/88/21/27/968882127.db2.gz FGYOZURBVZLIKP-GFCCVEGCSA-N 0 1 249.358 2.225 20 30 BEEDMN C=CCC[C@@H](O)CNCc1cn(C2CCC2)cn1 ZINC001252622571 968882395 /nfs/dbraw/zinc/88/23/95/968882395.db2.gz WVAJMOJXMBCUBI-CQSZACIVSA-N 0 1 249.358 2.025 20 30 BEEDMN CCCCN(CCC#N)C[C@H](O)CCC ZINC001252784403 968961856 /nfs/dbraw/zinc/96/18/56/968961856.db2.gz ZEIJRAIQVOHABK-GFCCVEGCSA-N 0 1 212.337 2.163 20 30 BEEDMN CCOc1cccnc1N=C(C)CC(C)=O ZINC001155892768 969114874 /nfs/dbraw/zinc/11/48/74/969114874.db2.gz STDIMZZUQWTFGG-HJWRWDBZSA-N 0 1 220.272 2.385 20 30 BEEDMN CC(=O)C=C(C)Nc1nc(C)nc(C)c1C ZINC001155892127 969116598 /nfs/dbraw/zinc/11/65/98/969116598.db2.gz IAUPDBUBWCVDSC-SREVYHEPSA-N 0 1 219.288 2.307 20 30 BEEDMN CCOc1ccc(N=C(C)CC(C)=O)nc1 ZINC001155890301 969117020 /nfs/dbraw/zinc/11/70/20/969117020.db2.gz JZDQPUVOXILWPF-CLFYSBASSA-N 0 1 220.272 2.385 20 30 BEEDMN N#Cc1cc(-c2ccc3[nH]nnc3c2)cnc1F ZINC001241942669 969150233 /nfs/dbraw/zinc/15/02/33/969150233.db2.gz ZEFBQPYRLLAVGO-UHFFFAOYSA-N 0 1 239.213 2.031 20 30 BEEDMN N#Cc1cc(-c2ccc3nn[nH]c3c2)cnc1F ZINC001241942669 969150240 /nfs/dbraw/zinc/15/02/40/969150240.db2.gz ZEFBQPYRLLAVGO-UHFFFAOYSA-N 0 1 239.213 2.031 20 30 BEEDMN N#Cc1ncc(F)cc1-c1ccc2nn[nH]c2c1 ZINC001241940500 969151495 /nfs/dbraw/zinc/15/14/95/969151495.db2.gz IFZKTFQMFJHOJB-UHFFFAOYSA-N 0 1 239.213 2.031 20 30 BEEDMN N#Cc1ncc(F)cc1-c1ccc2[nH]nnc2c1 ZINC001241940500 969151501 /nfs/dbraw/zinc/15/15/01/969151501.db2.gz IFZKTFQMFJHOJB-UHFFFAOYSA-N 0 1 239.213 2.031 20 30 BEEDMN C=C[C@H](O)CNCc1c(F)ccc(C)c1Cl ZINC001253598772 969290763 /nfs/dbraw/zinc/29/07/63/969290763.db2.gz XWPMDOSVEOSCAE-VIFPVBQESA-N 0 1 243.709 2.424 20 30 BEEDMN C=C[C@@H](O)CNCc1c(F)ccc(Cl)c1F ZINC001253598224 969291026 /nfs/dbraw/zinc/29/10/26/969291026.db2.gz QLESYPWETSIHMP-SSDOTTSWSA-N 0 1 247.672 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/nfs/dbraw/zinc/32/97/33/976329733.db2.gz YSOOCHNTIJKNRD-UHFFFAOYSA-N 0 1 231.343 2.057 20 30 BEEDMN Cc1cc(F)c(C#N)c(NCCN2CC=CC2)c1 ZINC001334153959 976336491 /nfs/dbraw/zinc/33/64/91/976336491.db2.gz GRJCQMNBXMJUOV-UHFFFAOYSA-N 0 1 245.301 2.290 20 30 BEEDMN C#Cc1ccc(Nc2ccc3nccn3c2)cn1 ZINC001174279175 976428407 /nfs/dbraw/zinc/42/84/07/976428407.db2.gz VNVGGTPTIAXNIR-UHFFFAOYSA-N 0 1 234.262 2.454 20 30 BEEDMN C#CCN(Cc1ccc(OC)c(O)c1)C(C)C ZINC001334332084 976451367 /nfs/dbraw/zinc/45/13/67/976451367.db2.gz IFTWFCBETYDAFL-UHFFFAOYSA-N 0 1 233.311 2.244 20 30 BEEDMN N#Cc1ccncc1Nc1ccc2nccn2c1 ZINC001174277373 976503751 /nfs/dbraw/zinc/50/37/51/976503751.db2.gz SBYVGKHEBNTVMN-UHFFFAOYSA-N 0 1 235.250 2.345 20 30 BEEDMN Cc1ncn(-c2ccc(Cl)c(C#N)c2)c1N ZINC001174402866 976593942 /nfs/dbraw/zinc/59/39/42/976593942.db2.gz YQCXPIDNOVQRQF-UHFFFAOYSA-N 0 1 232.674 2.288 20 30 BEEDMN CC#C[C@@H](CC)Oc1nnc2c[nH]ccc1-2 ZINC001228993990 976622114 /nfs/dbraw/zinc/62/21/14/976622114.db2.gz 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238.375 2.285 20 30 BEEDMN C=C[C@@H](CCC)Oc1nncc2n[nH]cc21 ZINC001230901979 977373080 /nfs/dbraw/zinc/37/30/80/977373080.db2.gz WKLXXANAXKMQQQ-QMMMGPOBSA-N 0 1 218.260 2.086 20 30 BEEDMN C[C@@H](CS)Oc1cc2[nH]ncc2c(F)c1 ZINC001230935798 977395860 /nfs/dbraw/zinc/39/58/60/977395860.db2.gz STUKATCUUVQHAP-LURJTMIESA-N 0 1 226.276 2.399 20 30 BEEDMN C=CCN1CC[C@H]1CN(C)C(=O)/C(C)=C\CC ZINC001230988298 977420840 /nfs/dbraw/zinc/42/08/40/977420840.db2.gz GCJVFSKACSZDBN-OTAKNEKHSA-N 0 1 236.359 2.061 20 30 BEEDMN C#C[C@@H](CC)Oc1nc2[nH]ccc(C)c-2n1 ZINC001231055613 977450895 /nfs/dbraw/zinc/45/08/95/977450895.db2.gz CHJJUMJHXVIHMG-VIFPVBQESA-N 0 1 215.256 2.057 20 30 BEEDMN C#C[C@H](Oc1nc2[nH]ccc(C)c-2n1)C(C)C ZINC001231063377 977453742 /nfs/dbraw/zinc/45/37/42/977453742.db2.gz HTKMSEGELNSHTH-JTQLQIEISA-N 0 1 229.283 2.303 20 30 BEEDMN CC#C[C@@H](CC)Oc1nc2[nH]ccc(C)c-2n1 ZINC001231063290 977455305 /nfs/dbraw/zinc/45/53/05/977455305.db2.gz FHWQXXBHAQBSMY-SNVBAGLBSA-N 0 1 229.283 2.447 20 30 BEEDMN Cc1cc(-n2ccc(C#N)c2N)cc2cn[nH]c21 ZINC001175518311 977500100 /nfs/dbraw/zinc/50/01/00/977500100.db2.gz OEUCXOUGIBSCHH-UHFFFAOYSA-N 0 1 237.266 2.116 20 30 BEEDMN C[C@@H]1CSCCN(Cc2cncc(C#N)c2)C1 ZINC000721599113 977518585 /nfs/dbraw/zinc/51/85/85/977518585.db2.gz YYLSTVSVVHCGDN-NSHDSACASA-N 0 1 247.367 2.138 20 30 BEEDMN COc1cc(NC2=CCCN(C)C2)ccc1C#N ZINC001175579940 977593953 /nfs/dbraw/zinc/59/39/53/977593953.db2.gz ILFQKPGWJWMXHV-UHFFFAOYSA-N 0 1 243.310 2.198 20 30 BEEDMN CN1CCC=C(Nc2cc(F)ccc2C#N)C1 ZINC001175580020 977597715 /nfs/dbraw/zinc/59/77/15/977597715.db2.gz UMFPXVSCJFCRTJ-UHFFFAOYSA-N 0 1 231.274 2.329 20 30 BEEDMN Cc1[nH]nc2cc(Nc3ccnc(C#N)c3)ccc12 ZINC001175659258 977637529 /nfs/dbraw/zinc/63/75/29/977637529.db2.gz IXOUYYQXWUFHSV-UHFFFAOYSA-N 0 1 249.277 2.304 20 30 BEEDMN Cn1cncc1Nc1cc(F)cc(C#N)c1 ZINC001175683408 977653169 /nfs/dbraw/zinc/65/31/69/977653169.db2.gz NLCOEEDWSCFZBU-UHFFFAOYSA-N 0 1 216.219 2.174 20 30 BEEDMN C=CCN(C)Cc1ccc(OCC)nc1 ZINC001231654898 977667954 /nfs/dbraw/zinc/66/79/54/977667954.db2.gz VKDAMPSYYDNJCY-UHFFFAOYSA-N 0 1 206.289 2.098 20 30 BEEDMN C#CCN(CC#C)Cc1c(C)cc(C)cc1O ZINC001231850561 977770377 /nfs/dbraw/zinc/77/03/77/977770377.db2.gz RUJNOCDWLQRAML-UHFFFAOYSA-N 0 1 227.307 2.077 20 30 BEEDMN Cc1cc(F)ncc1CN1CCC(S)CC1 ZINC001231983343 977824601 /nfs/dbraw/zinc/82/46/01/977824601.db2.gz UIYDYMXNHSVZMT-UHFFFAOYSA-N 0 1 240.347 2.423 20 30 BEEDMN C#CC[N@@H+]1CCC[C@H](Nc2ccc(CC)cn2)C1 ZINC001336726960 977885365 /nfs/dbraw/zinc/88/53/65/977885365.db2.gz SPECESSPSQPIOM-AWEZNQCLSA-N 0 1 243.354 2.154 20 30 BEEDMN C#CCN1CCC[C@H](Nc2ccc(CC)cn2)C1 ZINC001336726960 977885371 /nfs/dbraw/zinc/88/53/71/977885371.db2.gz SPECESSPSQPIOM-AWEZNQCLSA-N 0 1 243.354 2.154 20 30 BEEDMN COc1cc(C#N)c(F)cc1Nc1ncc[nH]1 ZINC001176085560 977887727 /nfs/dbraw/zinc/88/77/27/977887727.db2.gz KVROCZSHVFCKPF-UHFFFAOYSA-N 0 1 232.218 2.173 20 30 BEEDMN COc1ccc(CN2CCCC2)c(C#N)c1 ZINC000260805553 977891639 /nfs/dbraw/zinc/89/16/39/977891639.db2.gz MHVRJFMQGWSIPL-UHFFFAOYSA-N 0 1 216.284 2.163 20 30 BEEDMN N#Cc1ccc(N=C2CCOCC2)s1 ZINC001176142054 977928909 /nfs/dbraw/zinc/92/89/09/977928909.db2.gz SCLKUUZDUYEPEO-UHFFFAOYSA-N 0 1 206.270 2.336 20 30 BEEDMN N#Cc1cccc(C#N)c1N=C1CCOCC1 ZINC001176142241 977925205 /nfs/dbraw/zinc/92/52/05/977925205.db2.gz BJCGRGFMEQVVMD-UHFFFAOYSA-N 0 1 225.251 2.146 20 30 BEEDMN C=CCC[C@@H](C)NCc1nc(C(F)F)no1 ZINC001336837450 977994725 /nfs/dbraw/zinc/99/47/25/977994725.db2.gz USPYJJZDDPGVIO-SSDOTTSWSA-N 0 1 231.246 2.452 20 30 BEEDMN C=CCN(C)Cc1ccc(OCC)nc1C ZINC001232312240 977998154 /nfs/dbraw/zinc/99/81/54/977998154.db2.gz BRIUTRYIMYVGPU-UHFFFAOYSA-N 0 1 220.316 2.407 20 30 BEEDMN C#CCN(C[C@H]1COc2ccccc2O1)C(C)C ZINC001176373359 978059209 /nfs/dbraw/zinc/05/92/09/978059209.db2.gz PSOUPCCQAVPUKE-ZDUSSCGKSA-N 0 1 245.322 2.170 20 30 BEEDMN N#C[C@H]1CCCN(Cc2[nH]nc3c2CCC3)CC1 ZINC001232429704 978073154 /nfs/dbraw/zinc/07/31/54/978073154.db2.gz ZCGHVWIHTMORQR-NSHDSACASA-N 0 1 244.342 2.024 20 30 BEEDMN C=CC(C)(C)NC(=O)Cc1[nH]nc2ccccc21 ZINC001336957383 978081133 /nfs/dbraw/zinc/08/11/33/978081133.db2.gz XDRDQPYQGGUGDB-UHFFFAOYSA-N 0 1 243.310 2.186 20 30 BEEDMN FCc1cccc(CN2CCC(S)CC2)n1 ZINC001232536279 978165199 /nfs/dbraw/zinc/16/51/99/978165199.db2.gz ALQRTXJOEWYLSL-UHFFFAOYSA-N 0 1 240.347 2.445 20 30 BEEDMN C=C(C)CCC(=O)Nc1cc(N(C)C)ccn1 ZINC001337164300 978193404 /nfs/dbraw/zinc/19/34/04/978193404.db2.gz CTGNUGKQLRUZBB-UHFFFAOYSA-N 0 1 233.315 2.442 20 30 BEEDMN C[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(C#N)ccc1[O-] ZINC001232673562 978229284 /nfs/dbraw/zinc/22/92/84/978229284.db2.gz JFCURHFJEFPZTE-SKDRFNHKSA-N 0 1 234.274 2.196 20 30 BEEDMN N#Cc1ccc([O-])c(C[N@H+]2CCC[C@@H]3C[C@@H]32)c1 ZINC001232678227 978244769 /nfs/dbraw/zinc/24/47/69/978244769.db2.gz RALRXKBBYWIDJP-YPMHNXCESA-N 0 1 228.295 2.248 20 30 BEEDMN C[C@]1(CF)CCN(Cc2cccc(C#N)n2)C1 ZINC001232922800 978335675 /nfs/dbraw/zinc/33/56/75/978335675.db2.gz UVTOCFMTBFWVJD-CYBMUJFWSA-N 0 1 233.290 2.135 20 30 BEEDMN CC/C=C(\F)C(=O)Nc1cc(C#N)ccc1O ZINC001598128351 978415846 /nfs/dbraw/zinc/41/58/46/978415846.db2.gz PJOHDFDDXOKNAI-OQFOIZHKSA-N 0 1 234.230 2.466 20 30 BEEDMN N#C[C@@H]1CCCN1Cc1ccc(F)c(F)c1O ZINC001233074715 978458919 /nfs/dbraw/zinc/45/89/19/978458919.db2.gz UKQZRBYNMFGLET-VIFPVBQESA-N 0 1 238.237 2.158 20 30 BEEDMN C[C@@H](C#N)N(C)Cc1ccc(F)c(F)c1O ZINC001233078611 978466267 /nfs/dbraw/zinc/46/62/67/978466267.db2.gz AKSUTTFHIFGDDF-ZETCQYMHSA-N 0 1 226.226 2.014 20 30 BEEDMN CCN(CCC#N)Cc1n[nH]c2cc(F)ccc21 ZINC001233125390 978472259 /nfs/dbraw/zinc/47/22/59/978472259.db2.gz VERCXAGWSGEVLG-UHFFFAOYSA-N 0 1 246.289 2.438 20 30 BEEDMN N#C[C@H]1CCN(Cc2n[nH]c3cc(F)ccc32)C1 ZINC001233123216 978473626 /nfs/dbraw/zinc/47/36/26/978473626.db2.gz JKYIYXWKDJXHAB-SECBINFHSA-N 0 1 244.273 2.047 20 30 BEEDMN C[C@@H]1C[N@@H+](Cc2ccc(C#N)cc2[O-])C[C@@H]1F ZINC001233383471 978594587 /nfs/dbraw/zinc/59/45/87/978594587.db2.gz JFGGQJMUYKIKHU-SKDRFNHKSA-N 0 1 234.274 2.054 20 30 BEEDMN CCC[N@@H+](CCOC)Cc1ccc(C#N)cc1[O-] ZINC001233383602 978594694 /nfs/dbraw/zinc/59/46/94/978594694.db2.gz OCEDUTYPGGSSCG-UHFFFAOYSA-N 0 1 248.326 2.122 20 30 BEEDMN N#Cc1ccc(C[N@H+]2CCC3(CC3)C2)c([O-])c1 ZINC001233384245 978596009 /nfs/dbraw/zinc/59/60/09/978596009.db2.gz NTHRVGPEACFLRM-UHFFFAOYSA-N 0 1 228.295 2.250 20 30 BEEDMN CCOc1ccc(C#N)cc1NCc1cnc[nH]1 ZINC001178901032 978641549 /nfs/dbraw/zinc/64/15/49/978641549.db2.gz LETOCELAOUYMEE-UHFFFAOYSA-N 0 1 242.282 2.292 20 30 BEEDMN Cc1[nH+]c(NCCCCC#N)ccc1C(=O)[O-] ZINC001600715753 978722625 /nfs/dbraw/zinc/72/26/25/978722625.db2.gz BLENEUSXHWYPBB-UHFFFAOYSA-N 0 1 233.271 2.194 20 30 BEEDMN C[N@H+]1CC[C@@H](Oc2ccc(Cl)c(C#N)c2)C1 ZINC001233921995 978729973 /nfs/dbraw/zinc/72/99/73/978729973.db2.gz XKFIECCQOIXYNU-LLVKDONJSA-N 0 1 236.702 2.295 20 30 BEEDMN N#C[C@@H]1CC[C@H]([N@@H+]2CC[C@@]3(C(=O)[O-])CCC[C@@H]23)C1 ZINC001601059499 978762348 /nfs/dbraw/zinc/76/23/48/978762348.db2.gz GEAUQNHZDFEMGH-CZXHOFHRSA-N 0 1 248.326 2.008 20 30 BEEDMN CC(=NNc1ccc(C)cn1)c1ccnc(C)n1 ZINC001339006838 978771218 /nfs/dbraw/zinc/77/12/18/978771218.db2.gz LLVRPAREZGJKDL-UHFFFAOYSA-N 0 1 241.298 2.325 20 30 BEEDMN CC(=N[N-]c1ccc(C)c[nH+]1)c1ccnc(C)n1 ZINC001339006838 978771224 /nfs/dbraw/zinc/77/12/24/978771224.db2.gz LLVRPAREZGJKDL-UHFFFAOYSA-N 0 1 241.298 2.325 20 30 BEEDMN C#C[C@H](CCCC)Oc1nc(F)nc2nc[nH]c21 ZINC001234690057 978897993 /nfs/dbraw/zinc/89/79/93/978897993.db2.gz MTAKHCBTOCCOPN-MRVPVSSYSA-N 0 1 248.261 2.063 20 30 BEEDMN C[C@@H](Oc1ccccc1C=NO)c1cncnc1 ZINC001234819672 978904224 /nfs/dbraw/zinc/90/42/24/978904224.db2.gz NPHRAJZAODKOLQ-SNVBAGLBSA-N 0 1 243.266 2.425 20 30 BEEDMN C[C@@H](Oc1ccccc1C=NO)c1cnccn1 ZINC001234819893 978906676 /nfs/dbraw/zinc/90/66/76/978906676.db2.gz QCTHSFLXZYPYRI-SNVBAGLBSA-N 0 1 243.266 2.425 20 30 BEEDMN N#CCc1ccccc1CN1CCC(C#N)CC1 ZINC001235512542 979058079 /nfs/dbraw/zinc/05/80/79/979058079.db2.gz SDQPOEDQKVQJFW-UHFFFAOYSA-N 0 1 239.322 2.488 20 30 BEEDMN N#CCc1ccccc1CN1CC[C@]12CCOC2 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