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-0.001 10 0 EBAEMN CC[C@@H]1CN(C(=O)NCC(=O)NCC2CC2)CCN1C[C@H](C)O ZINC000248491621 380291996 /nfs/dbraw/zinc/29/19/96/380291996.db2.gz NZZPFHMMDGTTLP-GXTWGEPZSA-N 0 1 326.441 -0.001 10 0 EBAEMN C[C@H](CNC(=O)CN(C)c1ncnc2[nH]cnc21)N1CCOCC1 ZINC000130100314 381045888 /nfs/dbraw/zinc/04/58/88/381045888.db2.gz ATTOYVRMOYWVQL-LLVKDONJSA-N 0 1 333.396 -0.374 10 0 EBAEMN CO[C@@H]1C[C@@H](CO)N(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1 ZINC000284664594 381627897 /nfs/dbraw/zinc/62/78/97/381627897.db2.gz QJSAYORHRHLQMH-YNEHKIRRSA-N 0 1 334.372 -0.275 10 0 EBAEMN CC[C@H](C)[C@@H](N)C(=O)OCCOCn1cnc2c1nc(N)[nH]c2=O ZINC000138121246 381863240 /nfs/dbraw/zinc/86/32/40/381863240.db2.gz DYTMGBXTNHPPNK-DTWKUNHWSA-N 0 1 338.368 -0.408 10 0 EBAEMN C[C@@H]1C[N@@H+](C2CCN(Cc3cn(C)c(=O)n(C)c3=O)CC2)CCO1 ZINC000092079741 381874690 /nfs/dbraw/zinc/87/46/90/381874690.db2.gz DNWFYQCUMWBUQU-CYBMUJFWSA-N 0 1 336.436 -0.231 10 0 EBAEMN C[C@H]1CN(C(=O)NC[C@H]2CN(C)CCO2)CCN1CC(C)(C)O ZINC000249083472 382164096 /nfs/dbraw/zinc/16/40/96/382164096.db2.gz DLIUPXIUGISLAI-KBPBESRZSA-N 0 1 328.457 -0.196 10 0 EBAEMN CC(=O)N1CCN(C(=O)[C@H](C)N2CC[C@@H]3OCCN(C)[C@@H]3C2)CC1 ZINC000328911086 155196217 /nfs/dbraw/zinc/19/62/17/155196217.db2.gz NXSMUQXBOJKTAZ-IMJJTQAJSA-N 0 1 338.452 -0.530 10 0 EBAEMN O=C([C@H]1CCCCN1C[C@H](O)CN1CCCC1=O)N1CCOCC1 ZINC000329496690 155229255 /nfs/dbraw/zinc/22/92/55/155229255.db2.gz XICCYVJMOYMZGV-LSDHHAIUSA-N 0 1 339.436 -0.317 10 0 EBAEMN Cc1nc([C@@H](NC(=O)Cn2ncn(C)c2=O)c2ccccc2)n[nH]1 ZINC000179476106 154125598 /nfs/dbraw/zinc/12/55/98/154125598.db2.gz SHPNWFHXHUNVDD-ZDUSSCGKSA-N 0 1 327.348 -0.086 10 0 EBAEMN NC(=O)CC[C@H](N)C(=O)N1CCN(Cc2cccc(F)c2)C(=O)C1 ZINC000193269847 154158653 /nfs/dbraw/zinc/15/86/53/154158653.db2.gz KRPGFLXKHCBVAW-ZDUSSCGKSA-N 0 1 336.367 -0.411 10 0 EBAEMN C[C@@H]1CN(CC(=O)N2CCC[C@@H](C(N)=O)C2)CCN1CC(C)(C)O ZINC000249404445 154191208 /nfs/dbraw/zinc/19/12/08/154191208.db2.gz UCRARCDAQWGBGN-ZIAGYGMSSA-N 0 1 340.468 -0.513 10 0 EBAEMN C[C@H]1CN(CC(C)(C)O)CCN1CC(=O)N1CCC[C@@H](C(N)=O)C1 ZINC000249356823 154192063 /nfs/dbraw/zinc/19/20/63/154192063.db2.gz LDGAWTUGEKQYQC-UONOGXRCSA-N 0 1 340.468 -0.513 10 0 EBAEMN CC[C@@H]1CN(CC(=O)NCC(=O)N2CCCC2)CCN1C[C@H](C)O ZINC000252321482 154194333 /nfs/dbraw/zinc/19/43/33/154194333.db2.gz APHQQZXEHDJMTM-LSDHHAIUSA-N 0 1 340.468 -0.498 10 0 EBAEMN C[NH2+]CC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1[O-] ZINC000262665248 154242327 /nfs/dbraw/zinc/24/23/27/154242327.db2.gz OIWLEINKMLVZDX-UHFFFAOYSA-N 0 1 329.378 -0.429 10 0 EBAEMN CN(C)CCS(=O)(=O)NC1CC([N@H+](CC(=O)[O-])CC2CC2)C1 ZINC000263491409 154258764 /nfs/dbraw/zinc/25/87/64/154258764.db2.gz OWTKGOBPTRTOMH-UHFFFAOYSA-N 0 1 333.454 -0.205 10 0 EBAEMN Cc1cccc(=O)n1C[C@](C)(O)C(=O)N1CCO[C@H]2CCN(C)C[C@H]21 ZINC000284923585 154876567 /nfs/dbraw/zinc/87/65/67/154876567.db2.gz IRUPUGVITPWRBA-VKJFTORMSA-N 0 1 349.431 -0.161 10 0 EBAEMN CN(C(=O)[C@@H](N)CCC(N)=O)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000193251747 419798907 /nfs/dbraw/zinc/79/89/07/419798907.db2.gz UGLHGEWEIIIPCH-WCQYABFASA-N 0 1 336.367 -0.018 10 0 EBAEMN C[C@@H]1CN(S(=O)(=O)N2CCNC[C@@H]2c2cnn(C)c2)C[C@@H](C)O1 ZINC000181697166 297051326 /nfs/dbraw/zinc/05/13/26/297051326.db2.gz MNYNOSYXGUASIC-YRGRVCCFSA-N 0 1 343.453 -0.280 10 0 EBAEMN CN1CCN(C)[C@@H](CNC(=O)N2CCO[C@@H](Cn3cccn3)C2)C1 ZINC000332823183 545846584 /nfs/dbraw/zinc/84/65/84/545846584.db2.gz FLTFVOSIZVAFKI-LSDHHAIUSA-N 0 1 336.440 -0.461 10 0 EBAEMN CC(C)N1CCO[C@H](CN2CCN(Cn3ncn(C)c3=O)CC2)C1 ZINC000132820949 584607239 /nfs/dbraw/zinc/60/72/39/584607239.db2.gz GSNTYDNPQZBLLL-OAHLLOKOSA-N 0 1 338.456 -0.734 10 0 EBAEMN CCCN(CC(=O)Nc1cnn(C)c1)C[C@@H]1COC[C@@H](O)[C@H]1O ZINC000643585933 375914758 /nfs/dbraw/zinc/91/47/58/375914758.db2.gz DSCKMMHFYDFXRP-KYOSRNDESA-N 0 1 326.397 -0.561 10 0 EBAEMN CO[C@H]1C[C@@H](CN(C)S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)N(C)C1 ZINC000408025469 376284929 /nfs/dbraw/zinc/28/49/29/376284929.db2.gz BYYOEBCEUXJQLI-MQYQWHSLSA-N 0 1 335.470 -0.009 10 0 EBAEMN O[C@H](CN1CCOCC1)CN1CCOC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000408044226 376296089 /nfs/dbraw/zinc/29/60/89/376296089.db2.gz NAGFMHHOVAFXLX-VQHPVUNQSA-N 0 1 328.453 -0.069 10 0 EBAEMN CC(=O)NC1CN(C(=O)NC[C@H](C(C)C)N2CCN(C)CC2)C1 ZINC000189760582 379794293 /nfs/dbraw/zinc/79/42/93/379794293.db2.gz KFIGSMHRCCWDMA-OAHLLOKOSA-N 0 1 325.457 -0.212 10 0 EBAEMN CN1CCN(c2ccc(CNC(=O)C3=NNC(=O)CC3)cn2)CC1 ZINC000073420531 381603778 /nfs/dbraw/zinc/60/37/78/381603778.db2.gz IMEMBYQMUSHIKE-UHFFFAOYSA-N 0 1 330.392 -0.284 10 0 EBAEMN CN(C[C@H]1CN(C(=O)[C@@H]2CCCN2C)CCO1)c1nccn(C)c1=O ZINC000333011137 381878100 /nfs/dbraw/zinc/87/81/00/381878100.db2.gz FXBIXPYZEBDNAO-KBPBESRZSA-N 0 1 349.435 -0.462 10 0 EBAEMN O=C([C@H]1CCCN1C[C@H](O)CN1CCOCC1)N1CCSCC1 ZINC000069246541 382034431 /nfs/dbraw/zinc/03/44/31/382034431.db2.gz RNXNRSGSVIRHQG-HUUCEWRRSA-N 0 1 343.493 -0.281 10 0 EBAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CN(CC(=O)N2CCc3ccccc32)C[C@H]1O ZINC000331732155 155394021 /nfs/dbraw/zinc/39/40/21/155394021.db2.gz RORWCUATZHVIRN-HUUCEWRRSA-N 0 1 333.388 -0.363 10 0 EBAEMN CC(=O)N1CCN(C(=O)[C@@H](C)N2CCC[C@@H](n3cncn3)C2)CC1 ZINC000247158496 154186905 /nfs/dbraw/zinc/18/69/05/154186905.db2.gz MFHLYGPOQIXKHT-UKRRQHHQSA-N 0 1 334.424 -0.006 10 0 EBAEMN NC(=O)[C@@H]1CCCN(C(=O)CN2CCC[C@@H](Cn3cncn3)C2)C1 ZINC000247376275 154187378 /nfs/dbraw/zinc/18/73/78/154187378.db2.gz VIQSPSFVZASUAH-ZIAGYGMSSA-N 0 1 334.424 -0.286 10 0 EBAEMN C[C@@H]1CN(CC(C)(C)O)CCN1CC(=O)N1CCC[C@@H](C(N)=O)C1 ZINC000249356826 154191455 /nfs/dbraw/zinc/19/14/55/154191455.db2.gz LDGAWTUGEKQYQC-ZIAGYGMSSA-N 0 1 340.468 -0.513 10 0 EBAEMN C[C@H](O)CN1CCN([C@@H](C)C(=O)N(C)CC(=O)NC2CC2)C[C@H]1C ZINC000252321436 154194096 /nfs/dbraw/zinc/19/40/96/154194096.db2.gz AOMIVJHQXDBOCK-RDBSUJKOSA-N 0 1 340.468 -0.501 10 0 EBAEMN CO[C@@H]1C[C@@H](CO)N(CC(=O)N2CCN(c3cnccn3)CC2)C1 ZINC000344682563 156256151 /nfs/dbraw/zinc/25/61/51/156256151.db2.gz TYJKBTWGZHUWMJ-UONOGXRCSA-N 0 1 335.408 -0.793 10 0 EBAEMN COCCN1CCN(CCNS(=O)(=O)c2cnn(C)c2)C[C@H]1C ZINC000173679167 419105937 /nfs/dbraw/zinc/10/59/37/419105937.db2.gz PSHPKLDLULCQPL-CYBMUJFWSA-N 0 1 345.469 -0.649 10 0 EBAEMN CC(C)N1CCO[C@H](CN2CCN([C@@H](C)c3nnnn3C)CC2)C1 ZINC000189165518 419198533 /nfs/dbraw/zinc/19/85/33/419198533.db2.gz ASVKVXNLYVHGER-LSDHHAIUSA-N 0 1 337.472 -0.002 10 0 EBAEMN CC[C@H](O)CN1CCN(CC(=O)N2CCC[C@@H](C(N)=O)C2)CC1 ZINC000174075838 419769594 /nfs/dbraw/zinc/76/95/94/419769594.db2.gz CDZXJASQHAZQLF-KGLIPLIRSA-N 0 1 326.441 -0.901 10 0 EBAEMN O=C1CCCN1C[C@@H](O)CN1CCC[C@@H](N2CCCS2(=O)=O)C1 ZINC000333021687 545855396 /nfs/dbraw/zinc/85/53/96/545855396.db2.gz JHZUVSAYSWIQLR-KGLIPLIRSA-N 0 1 345.465 -0.530 10 0 EBAEMN CC1(C)NC(=O)N(CCN2C[C@@H](C(N)=O)[C@H](C(F)(F)F)C2)C1=O ZINC000299741631 563963824 /nfs/dbraw/zinc/96/38/24/563963824.db2.gz HAVCJNNSAOSGHJ-HTQZYQBOSA-N 0 1 336.314 -0.088 10 0 EBAEMN O=C(C1CN([C@@H]2CCOC2)C1)N1CCC[C@@](O)(Cn2ccnn2)C1 ZINC000897699989 582707004 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EBAEMN CCN(C1CCN(C(=O)[C@@H]2C[C@H](OC)CN2C)CC1)S(C)(=O)=O ZINC000408034780 376292468 /nfs/dbraw/zinc/29/24/68/376292468.db2.gz HKCCDXSZLOSZFJ-KBPBESRZSA-N 0 1 347.481 -0.022 10 0 EBAEMN CCN(CC)S(=O)(=O)CC(=O)N1CCO[C@@H]2CCN(C)C[C@H]21 ZINC000408042275 376293266 /nfs/dbraw/zinc/29/32/66/376293266.db2.gz RDYBQPJPADVOPL-CHWSQXEVSA-N 0 1 333.454 -0.411 10 0 EBAEMN COCCN1CCCN(C(=O)[C@]2(O)CCCN(C(C)=O)C2)CC1 ZINC000408046740 376296180 /nfs/dbraw/zinc/29/61/80/376296180.db2.gz DDGVSQMZQMDZFF-INIZCTEOSA-N 0 1 327.425 -0.460 10 0 EBAEMN Cc1nc(C)n(C[C@H]2CCCN(CC(=O)N3CCNC(=O)C3)C2)n1 ZINC000105884967 376568648 /nfs/dbraw/zinc/56/86/48/376568648.db2.gz UFTVNZFRGDXZSO-AWEZNQCLSA-N 0 1 334.424 -0.435 10 0 EBAEMN CC(C)N1CCO[C@@H](CN2CCN(C(=O)c3nccnc3N)CC2)C1 ZINC000105868312 376570192 /nfs/dbraw/zinc/57/01/92/376570192.db2.gz RWISNLZZXUSQGW-AWEZNQCLSA-N 0 1 348.451 -0.074 10 0 EBAEMN Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)N1CCO[C@@H](C[NH+](C)C)C1 ZINC000116787006 376707628 /nfs/dbraw/zinc/70/76/28/376707628.db2.gz BARVPESTMXSNHG-ZDUSSCGKSA-N 0 1 347.419 -0.029 10 0 EBAEMN NC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(CN3CCOCC3)CC2)O1 ZINC000408292998 376834998 /nfs/dbraw/zinc/83/49/98/376834998.db2.gz FJPQFCGGLGJSSA-KBPBESRZSA-N 0 1 325.409 -0.410 10 0 EBAEMN CC(C)N1CCO[C@H](CN2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)C1 ZINC000105817904 377108169 /nfs/dbraw/zinc/10/81/69/377108169.db2.gz PLWOVPDLKLTQSV-CABCVRRESA-N 0 1 338.452 -0.482 10 0 EBAEMN Cn1cnc(S(=O)(=O)NCC(=O)N2CCN3CCCC[C@H]3C2)c1 ZINC000151208655 377168282 /nfs/dbraw/zinc/16/82/82/377168282.db2.gz XBEPDWJCELRPGH-LBPRGKRZSA-N 0 1 341.437 -0.605 10 0 EBAEMN C[C@H](O)CN1CCN(c2cc(N3CCN(C)C(=O)C3)ncn2)C[C@H]1C ZINC000274397132 379687104 /nfs/dbraw/zinc/68/71/04/379687104.db2.gz XCSMCDTVCAZLRV-KGLIPLIRSA-N 0 1 348.451 -0.354 10 0 EBAEMN Cc1nc([C@H]2CN(CC(=O)N(C)Cc3cnn(C)c3)CCO2)n[nH]1 ZINC000173671348 379976174 /nfs/dbraw/zinc/97/61/74/379976174.db2.gz SKZSBSKZYWQKHO-CYBMUJFWSA-N 0 1 333.396 -0.121 10 0 EBAEMN 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