smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc(-c2nn[nH]n2)cc1 ZINC000821615912 945746878 /nfs/dbraw/zinc/74/68/78/945746878.db2.gz UKHDYNYBXNNURL-UHFFFAOYSA-N 2 1 388.475 3.382 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(-c2nn[nH]n2)c1 ZINC000824579463 946827187 /nfs/dbraw/zinc/82/71/87/946827187.db2.gz ZMDJQVQURABFNI-PKOBYXMFSA-N 2 1 376.508 3.430 20 0 GGADMP CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1cnc(-c3cccs3)s1)C2 ZINC000922386629 1126134675 /nfs/dbraw/zinc/13/46/75/1126134675.db2.gz HHTQXMAYAIPDQR-RRIFGTCXSA-N 2 1 377.579 3.441 20 0 GGADMP CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@@H]([NH2+]Cc1cnc(-c3cccs3)s1)C2 ZINC001550421871 1126206414 /nfs/dbraw/zinc/20/64/14/1126206414.db2.gz HHTQXMAYAIPDQR-HIRMHNASSA-N 2 1 377.579 3.441 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)CCc1nc2ccccc2s1 ZINC000058223734 205170890 /nfs/dbraw/zinc/17/08/90/205170890.db2.gz ZVZDMWIYLJOOKM-QGZVFWFLSA-N 2 1 388.581 3.103 20 0 GGADMP C[N@H+]1CC=C(C[NH2+]Cc2cc(Cl)ccc2I)CC1 ZINC000405234289 565585690 /nfs/dbraw/zinc/58/56/90/565585690.db2.gz XMUILKCUSZBAHB-UHFFFAOYSA-N 2 1 376.669 3.296 20 0 GGADMP C[N@@H+]1CC=C(C[NH2+]Cc2cc(Cl)ccc2I)CC1 ZINC000405234289 565585692 /nfs/dbraw/zinc/58/56/92/565585692.db2.gz XMUILKCUSZBAHB-UHFFFAOYSA-N 2 1 376.669 3.296 20 0 GGADMP C[N@H+](CCCO)C1CCN(c2cc[nH+]c3ccc(Br)cc32)CC1 ZINC000115519953 564195517 /nfs/dbraw/zinc/19/55/17/564195517.db2.gz LCUZAURQELRKPR-UHFFFAOYSA-N 2 1 378.314 3.280 20 0 GGADMP C[N@@H+](CCCO)C1CCN(c2cc[nH+]c3ccc(Br)cc32)CC1 ZINC000115519953 564195523 /nfs/dbraw/zinc/19/55/23/564195523.db2.gz LCUZAURQELRKPR-UHFFFAOYSA-N 2 1 378.314 3.280 20 0 GGADMP C[N@@H+](CCC(=O)Nc1ccc(Br)cc1F)C[C@@H]1CCC[NH+](C)C1 ZINC000118841295 564247414 /nfs/dbraw/zinc/24/74/14/564247414.db2.gz GLGKHMXOEGUZAH-CYBMUJFWSA-N 2 1 386.309 3.190 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc(Br)cc1F)C[C@@H]1CCC[N@H+](C)C1 ZINC000118841295 564247417 /nfs/dbraw/zinc/24/74/17/564247417.db2.gz GLGKHMXOEGUZAH-CYBMUJFWSA-N 2 1 386.309 3.190 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc(Br)cc1F)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841295 564247419 /nfs/dbraw/zinc/24/74/19/564247419.db2.gz GLGKHMXOEGUZAH-CYBMUJFWSA-N 2 1 386.309 3.190 20 0 GGADMP C[NH+](C)CCCC1CC[NH+](CC(=O)Nc2ccc(Br)cc2)CC1 ZINC000123436238 564449099 /nfs/dbraw/zinc/44/90/99/564449099.db2.gz VXBBLXPOQNUCIU-UHFFFAOYSA-N 2 1 382.346 3.441 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000124345827 564479552 /nfs/dbraw/zinc/47/95/52/564479552.db2.gz OVTGMQAJYGFMKI-LJQANCHMSA-N 2 1 380.374 3.300 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC[N@@H+]1C ZINC000127481000 564585670 /nfs/dbraw/zinc/58/56/70/564585670.db2.gz CWPUTIQYUZDUCO-KXBFYZLASA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC[N@H+]1C ZINC000127481000 564585671 /nfs/dbraw/zinc/58/56/71/564585671.db2.gz CWPUTIQYUZDUCO-KXBFYZLASA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)c2cccc(Br)c21 ZINC000128136455 564608187 /nfs/dbraw/zinc/60/81/87/564608187.db2.gz XKMJGUANRHPDIV-KEYYUXOJSA-N 2 1 394.357 3.174 20 0 GGADMP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1cccc(Br)c1 ZINC000128169474 564609318 /nfs/dbraw/zinc/60/93/18/564609318.db2.gz DORSDYZETQQNBX-RDJZCZTQSA-N 2 1 382.346 3.077 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCCN2CCC[N@@H+](C)CC2)cc1Br ZINC000128236093 564611516 /nfs/dbraw/zinc/61/15/16/564611516.db2.gz GOXNRJVYUVXSAR-HNNXBMFYSA-N 2 1 384.362 3.136 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000130472614 564682936 /nfs/dbraw/zinc/68/29/36/564682936.db2.gz HKNCPGAGCKHTGZ-ZDUSSCGKSA-N 2 1 379.302 3.303 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000130472614 564682939 /nfs/dbraw/zinc/68/29/39/564682939.db2.gz HKNCPGAGCKHTGZ-ZDUSSCGKSA-N 2 1 379.302 3.303 20 0 GGADMP C[C@H](Cn1cc(Br)cn1)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000132338620 564740402 /nfs/dbraw/zinc/74/04/02/564740402.db2.gz NGQQDOGQUHXPBO-OAHLLOKOSA-N 2 1 377.330 3.288 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3ccccc3Br)CC[C@@H]21 ZINC000139914876 564870298 /nfs/dbraw/zinc/87/02/98/564870298.db2.gz FWAZLEPUTIDJEE-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CCC(=O)Nc3ccccc3Br)CC[C@@H]21 ZINC000139914876 564870300 /nfs/dbraw/zinc/87/03/00/564870300.db2.gz FWAZLEPUTIDJEE-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CCC(=O)Nc3ccccc3Br)CC[C@@H]21 ZINC000139914876 564870302 /nfs/dbraw/zinc/87/03/02/564870302.db2.gz FWAZLEPUTIDJEE-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP COCCC[C@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(Br)cc1 ZINC000151364076 564915783 /nfs/dbraw/zinc/91/57/83/564915783.db2.gz LMCDWDDFTNXYRG-IBGZPJMESA-N 2 1 399.373 3.353 20 0 GGADMP NC(=O)[C@H]1CCCN1C1CC[NH+](Cc2sc3ccccc3c2Cl)CC1 ZINC000104067661 564953085 /nfs/dbraw/zinc/95/30/85/564953085.db2.gz HVTFOPQMTUEIAZ-OAHLLOKOSA-N 2 1 377.941 3.469 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)C[N@@H+](C)[C@@H]2CCSC2)c2cccs2)CC1 ZINC000153289801 564989971 /nfs/dbraw/zinc/98/99/71/564989971.db2.gz CDVWTTXIVRGLHM-SJORKVTESA-N 2 1 381.611 3.075 20 0 GGADMP COc1ccc(Br)cc1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000110234843 565037647 /nfs/dbraw/zinc/03/76/47/565037647.db2.gz CSPNMTCOMNBJOQ-UHFFFAOYSA-N 2 1 397.357 3.392 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H]2CCc3cc(Br)ccc32)CC1 ZINC000154459480 565039831 /nfs/dbraw/zinc/03/98/31/565039831.db2.gz SRQJRMNGBTXPOJ-IBGZPJMESA-N 2 1 380.374 3.444 20 0 GGADMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cncc(Br)c1 ZINC000183765546 565094125 /nfs/dbraw/zinc/09/41/25/565094125.db2.gz AMPVYTHXDOVZCJ-LJQANCHMSA-N 2 1 390.325 3.091 20 0 GGADMP C[C@@H](C(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1)c1cccc(Br)c1 ZINC000292388077 565114067 /nfs/dbraw/zinc/11/40/67/565114067.db2.gz RIMBSNNDTQFNOE-OAHLLOKOSA-N 2 1 396.373 3.037 20 0 GGADMP C[C@@H](C(=O)N(C)CCN(C)C1CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000292388077 565114069 /nfs/dbraw/zinc/11/40/69/565114069.db2.gz RIMBSNNDTQFNOE-OAHLLOKOSA-N 2 1 396.373 3.037 20 0 GGADMP CC[NH+]1CCC([N@H+](C)CCC(=O)Nc2ccc(Br)cc2F)CC1 ZINC000157430493 565132825 /nfs/dbraw/zinc/13/28/25/565132825.db2.gz ATRVCGKXIFHZBO-UHFFFAOYSA-N 2 1 386.309 3.333 20 0 GGADMP CC[NH+]1CCC([N@@H+](C)CCC(=O)Nc2ccc(Br)cc2F)CC1 ZINC000157430493 565132831 /nfs/dbraw/zinc/13/28/31/565132831.db2.gz ATRVCGKXIFHZBO-UHFFFAOYSA-N 2 1 386.309 3.333 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1Br ZINC000157602557 565137811 /nfs/dbraw/zinc/13/78/11/565137811.db2.gz KHXLWHLSVYDBLA-HNNXBMFYSA-N 2 1 397.361 3.329 20 0 GGADMP C[N@H+]1CCC[C@@]2(CCN(Cc3nnc(-c4ccccc4Br)o3)C2)C1 ZINC000292925076 565140804 /nfs/dbraw/zinc/14/08/04/565140804.db2.gz INOSTTTZZKNRMO-GOSISDBHSA-N 2 1 391.313 3.417 20 0 GGADMP C[N@H+]1CCC[C@]2(CC[NH+](CCC(=O)Nc3ccc(Br)cc3F)C2)C1 ZINC000293112799 565150425 /nfs/dbraw/zinc/15/04/25/565150425.db2.gz YOXKSMRQRWDUCV-SFHVURJKSA-N 2 1 398.320 3.335 20 0 GGADMP C[NH+]1CCC[C@]2(CC[N@H+](CCC(=O)Nc3ccc(Br)cc3F)C2)C1 ZINC000293112799 565150428 /nfs/dbraw/zinc/15/04/28/565150428.db2.gz YOXKSMRQRWDUCV-SFHVURJKSA-N 2 1 398.320 3.335 20 0 GGADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCC(=O)Nc3ccc(Br)cc3F)C2)C1 ZINC000293112799 565150432 /nfs/dbraw/zinc/15/04/32/565150432.db2.gz YOXKSMRQRWDUCV-SFHVURJKSA-N 2 1 398.320 3.335 20 0 GGADMP CSCc1cnc(C[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)s1 ZINC000293522594 565172232 /nfs/dbraw/zinc/17/22/32/565172232.db2.gz IRIWEFUNGSLDPB-UHFFFAOYSA-N 2 1 377.579 3.253 20 0 GGADMP C[C@H]1C[N@H+](CCCc2ccccc2Br)CC[C@H]1N1CC[NH+](C)CC1 ZINC000371697393 565205252 /nfs/dbraw/zinc/20/52/52/565205252.db2.gz VWOREGZSTATGFK-FXAWDEMLSA-N 2 1 394.401 3.340 20 0 GGADMP C[C@H]1C[N@@H+](CCCc2ccccc2Br)CC[C@H]1N1CC[NH+](C)CC1 ZINC000371697393 565205257 /nfs/dbraw/zinc/20/52/57/565205257.db2.gz VWOREGZSTATGFK-FXAWDEMLSA-N 2 1 394.401 3.340 20 0 GGADMP C[C@@H]1C[N@H+](CCCc2ccccc2Br)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000371697395 565205924 /nfs/dbraw/zinc/20/59/24/565205924.db2.gz VWOREGZSTATGFK-XLIONFOSSA-N 2 1 394.401 3.340 20 0 GGADMP C[C@@H]1C[N@@H+](CCCc2ccccc2Br)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000371697395 565205927 /nfs/dbraw/zinc/20/59/27/565205927.db2.gz VWOREGZSTATGFK-XLIONFOSSA-N 2 1 394.401 3.340 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(Br)cn1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185766554 565220243 /nfs/dbraw/zinc/22/02/43/565220243.db2.gz ZEUKJEXKOPMISD-KGLIPLIRSA-N 2 1 395.345 3.025 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(Br)cn1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766554 565220247 /nfs/dbraw/zinc/22/02/47/565220247.db2.gz ZEUKJEXKOPMISD-KGLIPLIRSA-N 2 1 395.345 3.025 20 0 GGADMP C[NH+]1CCC(N2CCC([NH2+]Cc3cccc(F)c3Br)CC2)CC1 ZINC000294910513 565235594 /nfs/dbraw/zinc/23/55/94/565235594.db2.gz CCZNNXBADNNILY-UHFFFAOYSA-N 2 1 384.337 3.236 20 0 GGADMP C[C@H](N[C@@H]1CC[N@@H+](CCN2CCOCC2)C1)c1cc(Cl)sc1Cl ZINC000372780002 565254567 /nfs/dbraw/zinc/25/45/67/565254567.db2.gz JCDHGJICXANCBV-QWHCGFSZSA-N 2 1 378.369 3.112 20 0 GGADMP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cccc(F)c2Br)C1 ZINC000295485758 565269100 /nfs/dbraw/zinc/26/91/00/565269100.db2.gz SIJAYWOGUKEERD-KRWDZBQOSA-N 2 1 393.300 3.445 20 0 GGADMP O[C@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc(F)c2Br)C1 ZINC000295485758 565269105 /nfs/dbraw/zinc/26/91/05/565269105.db2.gz SIJAYWOGUKEERD-KRWDZBQOSA-N 2 1 393.300 3.445 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3cncc(Br)c3)c2)CCO1 ZINC000186605680 565272005 /nfs/dbraw/zinc/27/20/05/565272005.db2.gz JXZVNEKJRVPALQ-OAHLLOKOSA-N 2 1 390.325 3.355 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3cncc(Br)c3)c2)CCO1 ZINC000186605680 565272010 /nfs/dbraw/zinc/27/20/10/565272010.db2.gz JXZVNEKJRVPALQ-OAHLLOKOSA-N 2 1 390.325 3.355 20 0 GGADMP C[NH+]1CCC(O)(C[NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)CC1 ZINC000272302581 565283739 /nfs/dbraw/zinc/28/37/39/565283739.db2.gz DMLHJLJQMVEKJS-QGZVFWFLSA-N 2 1 379.298 3.178 20 0 GGADMP CCS(=O)(=O)c1c(Cl)cccc1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000187101748 565309843 /nfs/dbraw/zinc/30/98/43/565309843.db2.gz AXLVCXWSRGAKJC-UHFFFAOYSA-N 2 1 380.941 3.485 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)nc12 ZINC000273433601 565319906 /nfs/dbraw/zinc/31/99/06/565319906.db2.gz LKTWBOSGRWNOGX-JJRVBVJISA-N 3 1 379.346 3.266 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3C[C@@H](C)N(C)C[C@@H]3C)nc12 ZINC000273433601 565319910 /nfs/dbraw/zinc/31/99/10/565319910.db2.gz LKTWBOSGRWNOGX-JJRVBVJISA-N 3 1 379.346 3.266 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)nc12 ZINC000273433602 565320904 /nfs/dbraw/zinc/32/09/04/565320904.db2.gz LKTWBOSGRWNOGX-JKIFEVAISA-N 2 1 379.346 3.266 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)nc12 ZINC000273442463 565320980 /nfs/dbraw/zinc/32/09/80/565320980.db2.gz NAHZSPBROKDHST-DOTOQJQBSA-N 2 1 377.330 3.164 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)nc12 ZINC000273442465 565321261 /nfs/dbraw/zinc/32/12/61/565321261.db2.gz NAHZSPBROKDHST-NVXWUHKLSA-N 2 1 377.330 3.164 20 0 GGADMP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(Br)ncc1F ZINC000273831452 565339374 /nfs/dbraw/zinc/33/93/74/565339374.db2.gz FXYFPQXHAVGOHF-LBPRGKRZSA-N 2 1 397.292 3.169 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+]Cc1cc(Br)cc(Br)c1N ZINC000274674763 565377424 /nfs/dbraw/zinc/37/74/24/565377424.db2.gz PZGNSZKTHDIANQ-UHFFFAOYSA-N 2 1 388.107 3.089 20 0 GGADMP C[C@@H]([NH2+]CCCCN1CC[NH+](CCO)CC1)c1cc(F)c(Cl)cc1Cl ZINC000168943115 565382024 /nfs/dbraw/zinc/38/20/24/565382024.db2.gz FNGONSXUTBITAU-CQSZACIVSA-N 2 1 392.346 3.173 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C[C@H]1CCc2[nH+]ccn2C1 ZINC000275540215 565416988 /nfs/dbraw/zinc/41/69/88/565416988.db2.gz MPURBMVSOKBHBV-ZIAGYGMSSA-N 2 1 391.313 3.215 20 0 GGADMP CC(C)[NH2+]C1CC[NH+](CCC(=O)Nc2ccc(Br)cc2F)CC1 ZINC000171689669 565444317 /nfs/dbraw/zinc/44/43/17/565444317.db2.gz KTXQAESZIYFRBS-UHFFFAOYSA-N 2 1 386.309 3.379 20 0 GGADMP C[N@@H+]1CCC[C@@H](N2CCN(c3cc[nH+]c4cc(Br)ccc43)CC2)C1 ZINC000301309369 565478002 /nfs/dbraw/zinc/47/80/02/565478002.db2.gz DXPCKKZNCCBQCG-MRXNPFEDSA-N 2 1 389.341 3.214 20 0 GGADMP C[N@H+]1CCC[C@@H](N2CCN(c3cc[nH+]c4cc(Br)ccc43)CC2)C1 ZINC000301309369 565478004 /nfs/dbraw/zinc/47/80/04/565478004.db2.gz DXPCKKZNCCBQCG-MRXNPFEDSA-N 2 1 389.341 3.214 20 0 GGADMP COc1c(Br)cccc1C[N@H+](C)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000377627376 565489790 /nfs/dbraw/zinc/48/97/90/565489790.db2.gz NGZMONWHUOJBLM-QGZVFWFLSA-N 2 1 396.373 3.058 20 0 GGADMP COc1c(Br)cccc1C[N@@H+](C)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000377627376 565489796 /nfs/dbraw/zinc/48/97/96/565489796.db2.gz NGZMONWHUOJBLM-QGZVFWFLSA-N 2 1 396.373 3.058 20 0 GGADMP C[C@@H]1CN(c2cc[nH+]c3cc(Br)ccc32)CC[N@@H+]1CC(C)(C)O ZINC000302501928 565543259 /nfs/dbraw/zinc/54/32/59/565543259.db2.gz PADAGQRYGLTTSN-CYBMUJFWSA-N 2 1 378.314 3.279 20 0 GGADMP C[C@@H]1CN(c2cc[nH+]c3cc(Br)ccc32)CC[N@H+]1CC(C)(C)O ZINC000302501928 565543264 /nfs/dbraw/zinc/54/32/64/565543264.db2.gz PADAGQRYGLTTSN-CYBMUJFWSA-N 2 1 378.314 3.279 20 0 GGADMP C[C@H](NC(=O)C[N@@H+]1CCC[C@@H](C)[C@H]1CC[NH3+])c1ccc(Br)cc1 ZINC000404285061 565582341 /nfs/dbraw/zinc/58/23/41/565582341.db2.gz RNFTZVYHUQJCQJ-JKIFEVAISA-N 2 1 382.346 3.076 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@@H](C)[C@H]1CC[NH3+])c1ccc(Br)cc1 ZINC000404285061 565582345 /nfs/dbraw/zinc/58/23/45/565582345.db2.gz RNFTZVYHUQJCQJ-JKIFEVAISA-N 2 1 382.346 3.076 20 0 GGADMP Brc1ccc([C@@H]([NH2+]C[C@H]2CCc3[nH+]ccn3C2)c2cncnc2)cc1 ZINC000278910161 565585570 /nfs/dbraw/zinc/58/55/70/565585570.db2.gz GUDNUJKSSYKIFB-AUUYWEPGSA-N 2 1 398.308 3.377 20 0 GGADMP [NH3+]CCCOC1CC[NH+](CCOc2ccc(Cl)cc2Br)CC1 ZINC000317570403 565593866 /nfs/dbraw/zinc/59/38/66/565593866.db2.gz OPHSPZXEUSFUNW-UHFFFAOYSA-N 2 1 391.737 3.311 20 0 GGADMP Cc1nn(C)c(CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1Br ZINC000279134572 565597232 /nfs/dbraw/zinc/59/72/32/565597232.db2.gz NEUSOQVDXOCWFU-QGZVFWFLSA-N 2 1 391.357 3.145 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000174219619 565621099 /nfs/dbraw/zinc/62/10/99/565621099.db2.gz LEGTUEHPKHRJGQ-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000174219619 565621104 /nfs/dbraw/zinc/62/11/04/565621104.db2.gz LEGTUEHPKHRJGQ-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2ccc(Br)c(Cl)c2)CC1 ZINC000192167162 565664706 /nfs/dbraw/zinc/66/47/06/565664706.db2.gz NETSNRYSBNGFEJ-UHFFFAOYSA-N 2 1 388.781 3.466 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000280876106 565701226 /nfs/dbraw/zinc/70/12/26/565701226.db2.gz ZTZSAILADVPPHV-AWEZNQCLSA-N 2 1 392.219 3.296 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CCc3cc(Br)ccc3C2)CC1 ZINC000192844977 565714599 /nfs/dbraw/zinc/71/45/99/565714599.db2.gz QMPFVKSCZWXDHC-UHFFFAOYSA-N 2 1 380.374 3.223 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCc3cc(Br)ccc3C2)CC1 ZINC000192844977 565714603 /nfs/dbraw/zinc/71/46/03/565714603.db2.gz QMPFVKSCZWXDHC-UHFFFAOYSA-N 2 1 380.374 3.223 20 0 GGADMP C[N@@H+]1[C@@H]2CC[C@H]1CC(NCc1ccc(Br)cc1N1CCOCC1)C2 ZINC000193031205 565727000 /nfs/dbraw/zinc/72/70/00/565727000.db2.gz IXFVGGSBJXKWKZ-AYHJJNSGSA-N 2 1 394.357 3.001 20 0 GGADMP C[N@H+]1[C@@H]2CC[C@H]1CC([NH2+]Cc1ccc(Br)cc1N1CCOCC1)C2 ZINC000193031205 565727004 /nfs/dbraw/zinc/72/70/04/565727004.db2.gz IXFVGGSBJXKWKZ-AYHJJNSGSA-N 2 1 394.357 3.001 20 0 GGADMP C[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+]Cc1ccc(Br)cc1N1CCOCC1)C2 ZINC000193031205 565727009 /nfs/dbraw/zinc/72/70/09/565727009.db2.gz IXFVGGSBJXKWKZ-AYHJJNSGSA-N 2 1 394.357 3.001 20 0 GGADMP C[N@@H+]1CCCC12CC[NH+](CCC(=O)Nc1ccc(Br)cc1)CC2 ZINC000411451894 565731363 /nfs/dbraw/zinc/73/13/63/565731363.db2.gz VTWJSNCEMNIWCT-UHFFFAOYSA-N 2 1 380.330 3.338 20 0 GGADMP C[N@H+]1CCCC12CC[NH+](CCC(=O)Nc1ccc(Br)cc1)CC2 ZINC000411451894 565731370 /nfs/dbraw/zinc/73/13/70/565731370.db2.gz VTWJSNCEMNIWCT-UHFFFAOYSA-N 2 1 380.330 3.338 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCc3ccc(Br)cc32)CC1 ZINC000193981765 565786846 /nfs/dbraw/zinc/78/68/46/565786846.db2.gz CKXCMKODDHBDBI-LJQANCHMSA-N 2 1 380.374 3.300 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000194028708 565790790 /nfs/dbraw/zinc/79/07/90/565790790.db2.gz RTTKBKGXPSNGIP-UHFFFAOYSA-N 2 1 380.374 3.312 20 0 GGADMP [NH3+][C@@H]1CCCN(C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000332514614 565841250 /nfs/dbraw/zinc/84/12/50/565841250.db2.gz GIPCEZAJPRODBU-CQSZACIVSA-N 2 1 385.339 3.091 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H](CO)Cc1cc(F)cc(Br)c1 ZINC000414170361 565900601 /nfs/dbraw/zinc/90/06/01/565900601.db2.gz BYNFMUKSACAMEK-ONUSSAAZSA-N 2 1 387.337 3.058 20 0 GGADMP C[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(F)cc(Br)c2)[C@@H]2CCC[C@@H]21 ZINC000414173025 565900680 /nfs/dbraw/zinc/90/06/80/565900680.db2.gz FJOZKAPZEYKVTJ-FCLVOEFKSA-N 2 1 399.348 3.202 20 0 GGADMP C[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(F)cc(Br)c2)[C@@H]2CCC[C@H]21 ZINC000414173027 565900776 /nfs/dbraw/zinc/90/07/76/565900776.db2.gz FJOZKAPZEYKVTJ-GRGSLBFTSA-N 2 1 399.348 3.202 20 0 GGADMP C[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(F)cc(Br)c2)[C@H]2CCC[C@@H]21 ZINC000414173029 565900805 /nfs/dbraw/zinc/90/08/05/565900805.db2.gz FJOZKAPZEYKVTJ-OAOYMFHYSA-N 2 1 399.348 3.202 20 0 GGADMP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000414192571 565902866 /nfs/dbraw/zinc/90/28/66/565902866.db2.gz SLGRMIQANZERQR-WMLDXEAASA-N 2 1 387.977 3.021 20 0 GGADMP C[N@@H+](CCC(=O)Nc1cccc(Br)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000285402532 565905539 /nfs/dbraw/zinc/90/55/39/565905539.db2.gz FGCIEEQJMTYYGC-SJPCQFCGSA-N 2 1 380.330 3.335 20 0 GGADMP C[NH+](CCC(=O)Nc1cccc(Br)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000285402532 565905542 /nfs/dbraw/zinc/90/55/42/565905542.db2.gz FGCIEEQJMTYYGC-SJPCQFCGSA-N 2 1 380.330 3.335 20 0 GGADMP C[NH+](CCC(=O)Nc1cccc(Br)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285402532 565905545 /nfs/dbraw/zinc/90/55/45/565905545.db2.gz FGCIEEQJMTYYGC-SJPCQFCGSA-N 2 1 380.330 3.335 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C1CCN(Cc2cccc(Br)c2)CC1 ZINC000414351240 565913620 /nfs/dbraw/zinc/91/36/20/565913620.db2.gz MWMIVWZLDCMAAW-BEFAXECRSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C1CCN(Cc2cccc(Br)c2)CC1 ZINC000414351240 565913629 /nfs/dbraw/zinc/91/36/29/565913629.db2.gz MWMIVWZLDCMAAW-BEFAXECRSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC[N@@H+]1C ZINC000414356166 565914896 /nfs/dbraw/zinc/91/48/96/565914896.db2.gz YSHXXILUOWRZBU-BEFAXECRSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC[N@H+]1C ZINC000414356166 565914900 /nfs/dbraw/zinc/91/49/00/565914900.db2.gz YSHXXILUOWRZBU-BEFAXECRSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H](NC(=O)CN(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Br)cc1 ZINC000285665278 565921233 /nfs/dbraw/zinc/92/12/33/565921233.db2.gz ZICZHFXPPFIVTD-BXEVVDMOSA-N 2 1 394.357 3.183 20 0 GGADMP CCC(CC)(C[NH3+])C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000236655657 565941251 /nfs/dbraw/zinc/94/12/51/565941251.db2.gz ZEAKQDWLILCDCO-UHFFFAOYSA-N 2 1 396.373 3.295 20 0 GGADMP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cscc2Br)C1 ZINC000286160208 565944694 /nfs/dbraw/zinc/94/46/94/565944694.db2.gz WFOUGICYBYKLTM-INIZCTEOSA-N 2 1 381.339 3.367 20 0 GGADMP O[C@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2cscc2Br)C1 ZINC000286160208 565944696 /nfs/dbraw/zinc/94/46/96/565944696.db2.gz WFOUGICYBYKLTM-INIZCTEOSA-N 2 1 381.339 3.367 20 0 GGADMP COc1cc(CNC[C@H]2CCC[N@H+]2C)cc(Br)c1OC(F)F ZINC000237277960 565955162 /nfs/dbraw/zinc/95/51/62/565955162.db2.gz SZGXPGDGNHLIMD-LLVKDONJSA-N 2 1 379.245 3.243 20 0 GGADMP COC(=O)CC[N@H+](Cc1cccc(Br)c1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414751705 565958672 /nfs/dbraw/zinc/95/86/72/565958672.db2.gz AXSXRKKVXMCGQT-HOCLYGCPSA-N 2 1 383.330 3.202 20 0 GGADMP Cc1cc([C@H]2CCC[N@H+]2C[C@@H]2CCCN(C(=O)C[NH3+])C2)ccc1Br ZINC000414755709 565958987 /nfs/dbraw/zinc/95/89/87/565958987.db2.gz PLAVOQKAVGSLDK-MAUKXSAKSA-N 2 1 394.357 3.092 20 0 GGADMP CCOc1c(Br)cc(C[NH2+]CC(C)(C)[NH3+])cc1Br ZINC000414795950 565961526 /nfs/dbraw/zinc/96/15/26/565961526.db2.gz BEFQQOVMGRJNNM-UHFFFAOYSA-N 2 1 380.124 3.437 20 0 GGADMP C[NH2+]C[C@@H](C)C[NH2+]Cc1cc(Br)cc(Br)c1OC ZINC000414839700 565963490 /nfs/dbraw/zinc/96/34/90/565963490.db2.gz MKCOUFGMGWGZSK-SECBINFHSA-N 2 1 380.124 3.165 20 0 GGADMP COc1cc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc(Br)c1OC(F)F ZINC000414946391 565966633 /nfs/dbraw/zinc/96/66/33/565966633.db2.gz JMJKCTPVRHDFRA-MWLCHTKSSA-N 2 1 379.245 3.289 20 0 GGADMP COc1sc(C[NH+]2CCC([C@H]3OCCC[C@H]3[NH3+])CC2)cc1Br ZINC000415111390 565973449 /nfs/dbraw/zinc/97/34/49/565973449.db2.gz QVGFMFMSEVWIGU-HUUCEWRRSA-N 2 1 389.359 3.238 20 0 GGADMP COc1ccc(Br)cc1C[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000415119288 565974625 /nfs/dbraw/zinc/97/46/25/565974625.db2.gz FFNRXNCTMWPFNV-SJLPKXTDSA-N 2 1 383.330 3.176 20 0 GGADMP CSc1cc(Br)ccc1C[N@H+]1CCC[C@@H](n2cc(C[NH3+])nn2)C1 ZINC000415132718 565975808 /nfs/dbraw/zinc/97/58/08/565975808.db2.gz UKEBTPMXQIKJER-OAHLLOKOSA-N 2 1 396.358 3.058 20 0 GGADMP Clc1ccc(C[N@@H+]2CC3(CC[NH2+]CC3)[C@@H]3COC[C@@H]32)c(Br)c1 ZINC000415135133 565976042 /nfs/dbraw/zinc/97/60/42/565976042.db2.gz FOJPNFAATJVNDH-ZBFHGGJFSA-N 2 1 385.733 3.303 20 0 GGADMP Clc1ccc(C[N@H+]2CC3(CC[NH2+]CC3)[C@@H]3COC[C@@H]32)c(Br)c1 ZINC000415135133 565976045 /nfs/dbraw/zinc/97/60/45/565976045.db2.gz FOJPNFAATJVNDH-ZBFHGGJFSA-N 2 1 385.733 3.303 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212776 566021830 /nfs/dbraw/zinc/02/18/30/566021830.db2.gz NXPOOJFZZRWTHD-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212776 566021834 /nfs/dbraw/zinc/02/18/34/566021834.db2.gz NXPOOJFZZRWTHD-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212776 566021839 /nfs/dbraw/zinc/02/18/39/566021839.db2.gz NXPOOJFZZRWTHD-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212776 566021842 /nfs/dbraw/zinc/02/18/42/566021842.db2.gz NXPOOJFZZRWTHD-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212776 566021847 /nfs/dbraw/zinc/02/18/47/566021847.db2.gz NXPOOJFZZRWTHD-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(O)ccc3Br)CC2)CC1 ZINC000363870727 566024685 /nfs/dbraw/zinc/02/46/85/566024685.db2.gz XFYRPXKMMBNYIE-UHFFFAOYSA-N 2 1 396.373 3.004 20 0 GGADMP O=C(CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)Nc1ccc(Br)cc1 ZINC000246441433 566030200 /nfs/dbraw/zinc/03/02/00/566030200.db2.gz DFEUTLOUCABHDQ-KBXCAEBGSA-N 2 1 392.341 3.336 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@H]2CCc3c2cccc3Br)CC1 ZINC000180094828 566032863 /nfs/dbraw/zinc/03/28/63/566032863.db2.gz BPVXDSSNGFFZPT-IBGZPJMESA-N 2 1 380.374 3.300 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3ccccc3Br)CC[C@H]21 ZINC000246723301 566038802 /nfs/dbraw/zinc/03/88/02/566038802.db2.gz FWAZLEPUTIDJEE-RHSMWYFYSA-N 2 1 380.330 3.194 20 0 GGADMP O[C@@H](COc1ccc(Br)cc1)C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000246874021 566044617 /nfs/dbraw/zinc/04/46/17/566044617.db2.gz APKUENZVYRUKQN-QZTJIDSGSA-N 2 1 397.357 3.139 20 0 GGADMP O[C@@H](COc1ccc(Br)cc1)C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000246874021 566044623 /nfs/dbraw/zinc/04/46/23/566044623.db2.gz APKUENZVYRUKQN-QZTJIDSGSA-N 2 1 397.357 3.139 20 0 GGADMP CN(Cc1ccccc1Br)C(=O)CC[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000247205907 566054721 /nfs/dbraw/zinc/05/47/21/566054721.db2.gz YRHWXTBSSPJATF-IRXDYDNUSA-N 2 1 394.357 3.014 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H]2CO)cc1Br ZINC000247954182 566070134 /nfs/dbraw/zinc/07/01/34/566070134.db2.gz FISUFAUZSIMREI-HOCLYGCPSA-N 2 1 385.346 3.345 20 0 GGADMP CC[C@H](CSC)[N@@H+](C)CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000180677628 566082205 /nfs/dbraw/zinc/08/22/05/566082205.db2.gz MNBZTCZMANIHAT-GOSISDBHSA-N 2 1 381.611 3.247 20 0 GGADMP C[C@H](c1ccccc1Br)[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000261624915 566125920 /nfs/dbraw/zinc/12/59/20/566125920.db2.gz GORUTNLJDAVFMX-RKVPGOIHSA-N 2 1 394.357 3.090 20 0 GGADMP C[C@H](c1ccccc1Br)[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000261624910 566126489 /nfs/dbraw/zinc/12/64/89/566126489.db2.gz GORUTNLJDAVFMX-IIDMSEBBSA-N 2 1 394.357 3.090 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000261676567 566129041 /nfs/dbraw/zinc/12/90/41/566129041.db2.gz HPDLKODJSHIUNI-KRWDZBQOSA-N 2 1 380.330 3.160 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000261676568 566129371 /nfs/dbraw/zinc/12/93/71/566129371.db2.gz HPDLKODJSHIUNI-QGZVFWFLSA-N 2 1 380.330 3.160 20 0 GGADMP CCC[N@H+](CC(=O)N[C@@H](C)c1ccc(Br)cc1)C1CC[NH2+]CC1 ZINC000261690189 566129493 /nfs/dbraw/zinc/12/94/93/566129493.db2.gz IXZOTWVZCMOOCC-AWEZNQCLSA-N 2 1 382.346 3.090 20 0 GGADMP CCC[N@@H+](CC(=O)N[C@@H](C)c1ccc(Br)cc1)C1CC[NH2+]CC1 ZINC000261690189 566129495 /nfs/dbraw/zinc/12/94/95/566129495.db2.gz IXZOTWVZCMOOCC-AWEZNQCLSA-N 2 1 382.346 3.090 20 0 GGADMP CC(C)[C@@H]([NH3+])CNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000417565049 566158482 /nfs/dbraw/zinc/15/84/82/566158482.db2.gz GFICBHZQDRETIC-KRWDZBQOSA-N 2 1 387.355 3.240 20 0 GGADMP C[NH2+]C[C@@H](C)CNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000417568895 566159359 /nfs/dbraw/zinc/15/93/59/566159359.db2.gz KZXUUBPHEWTSPT-CYBMUJFWSA-N 2 1 387.355 3.113 20 0 GGADMP CN(C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)C1CC([NH3+])C1 ZINC000417568883 566159433 /nfs/dbraw/zinc/15/94/33/566159433.db2.gz KYPOYUHCZXTNMO-UHFFFAOYSA-N 2 1 385.339 3.089 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)c(Br)c1 ZINC000181733052 566163362 /nfs/dbraw/zinc/16/33/62/566163362.db2.gz KHBBQTFSQVANFI-HUUCEWRRSA-N 2 1 385.346 3.345 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)c(Br)c1 ZINC000181733036 566163712 /nfs/dbraw/zinc/16/37/12/566163712.db2.gz KHBBQTFSQVANFI-LSDHHAIUSA-N 2 1 385.346 3.345 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](CCCc3ccccc3Br)C2)CC1 ZINC000181858582 566170131 /nfs/dbraw/zinc/17/01/31/566170131.db2.gz SNUDNXWDUJGUFI-GOSISDBHSA-N 2 1 380.374 3.094 20 0 GGADMP [NH3+]C1(CNC(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CCC1 ZINC000417988239 566186334 /nfs/dbraw/zinc/18/63/34/566186334.db2.gz ILFLDJJNOJFCAI-UHFFFAOYSA-N 2 1 385.339 3.138 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(Br)nc1 ZINC000290762149 566187696 /nfs/dbraw/zinc/18/76/96/566187696.db2.gz ROZFWTCLABNCDI-XKQJLSEDSA-N 2 1 382.346 3.263 20 0 GGADMP Brc1cncc(Br)c1CNC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000290961520 566198679 /nfs/dbraw/zinc/19/86/79/566198679.db2.gz WKNDCBCGVHFRLY-JTQLQIEISA-N 2 1 389.135 3.181 20 0 GGADMP C[N@H+](CC/C=C/c1ccc(Br)cc1)CCCN1CC[NH+](C)CC1 ZINC000182954605 566232010 /nfs/dbraw/zinc/23/20/10/566232010.db2.gz AAYKKRPTGAGKIL-ZZXKWVIFSA-N 2 1 380.374 3.422 20 0 GGADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000556202470 566274244 /nfs/dbraw/zinc/27/42/44/566274244.db2.gz RFZPWEGACWTDRW-OAHLLOKOSA-N 2 1 377.330 3.455 20 0 GGADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000556202470 566274252 /nfs/dbraw/zinc/27/42/52/566274252.db2.gz RFZPWEGACWTDRW-OAHLLOKOSA-N 2 1 377.330 3.455 20 0 GGADMP [NH3+]C[C@@H]([NH2+]CCC(=O)Nc1ccc(Br)cc1F)C1CCCCC1 ZINC000420377657 566274581 /nfs/dbraw/zinc/27/45/81/566274581.db2.gz WILXQSSNBFXZLZ-MRXNPFEDSA-N 2 1 386.309 3.414 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(Br)cc2)CCOCC1 ZINC000482026051 566277468 /nfs/dbraw/zinc/27/74/68/566277468.db2.gz MGOPTMUJPIBWHX-MAUKXSAKSA-N 2 1 381.358 3.427 20 0 GGADMP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccc(Br)cn1 ZINC000482155219 566286587 /nfs/dbraw/zinc/28/65/87/566286587.db2.gz HRTMECVOPTUKIT-GDBMZVCRSA-N 2 1 397.361 3.273 20 0 GGADMP C[C@H](C(=O)Nc1cccc(Br)c1)[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000575869360 566293769 /nfs/dbraw/zinc/29/37/69/566293769.db2.gz SQKNBEIWMMFNNN-KFWWJZLASA-N 2 1 380.330 3.098 20 0 GGADMP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000482463315 566309222 /nfs/dbraw/zinc/30/92/22/566309222.db2.gz MWGZEYXIZSRKMT-LLVKDONJSA-N 2 1 378.731 3.462 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@H]2CCc3c2cc(Br)cc3F)CC1 ZINC000482556505 566317591 /nfs/dbraw/zinc/31/75/91/566317591.db2.gz SYXUUVHINBGSOL-SFHVURJKSA-N 2 1 384.337 3.193 20 0 GGADMP CN(C)C(=O)CC[NH+]1CCC([NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000482899185 566341516 /nfs/dbraw/zinc/34/15/16/566341516.db2.gz JGXPJFKSTLTOAF-QGZVFWFLSA-N 2 1 381.973 3.409 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)C[N@@H+](C)[C@H]1CCSC1)c1ccccc1Cl ZINC000536072068 566349316 /nfs/dbraw/zinc/34/93/16/566349316.db2.gz HDKKPLZHZFVTBW-MAUKXSAKSA-N 2 1 383.989 3.276 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1OCCCO ZINC000462949648 566370230 /nfs/dbraw/zinc/37/02/30/566370230.db2.gz YSQLOGFUPVMEFZ-BHYGNILZSA-N 2 1 397.357 3.488 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1OCCCO ZINC000462949648 566370232 /nfs/dbraw/zinc/37/02/32/566370232.db2.gz YSQLOGFUPVMEFZ-BHYGNILZSA-N 2 1 397.357 3.488 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cnc(-c3ccsc3)s2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000536664621 566392229 /nfs/dbraw/zinc/39/22/29/566392229.db2.gz RKQOYOUCQJFIKK-CRAIPNDOSA-N 2 1 376.595 3.329 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cnc(-c3ccsc3)s2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000536664621 566392231 /nfs/dbraw/zinc/39/22/31/566392231.db2.gz RKQOYOUCQJFIKK-CRAIPNDOSA-N 2 1 376.595 3.329 20 0 GGADMP COc1sc(C[NH+]2CCC(OCC[NH+](C)C)CC2)cc1Br ZINC000536675991 566392328 /nfs/dbraw/zinc/39/23/28/566392328.db2.gz HUPTVKPENZEKIB-UHFFFAOYSA-N 2 1 377.348 3.062 20 0 GGADMP Brc1cc(C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc2c1OCCCO2 ZINC000576943724 566393532 /nfs/dbraw/zinc/39/35/32/566393532.db2.gz IBIQQJWHQLOWMH-JKSUJKDBSA-N 2 1 395.341 3.432 20 0 GGADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(Br)cc1OCCCO ZINC000463373898 566405954 /nfs/dbraw/zinc/40/59/54/566405954.db2.gz YWOQJMKNNXRBPM-ZBFHGGJFSA-N 2 1 385.346 3.345 20 0 GGADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Br)cc1OCCCO ZINC000463373898 566405958 /nfs/dbraw/zinc/40/59/58/566405958.db2.gz YWOQJMKNNXRBPM-ZBFHGGJFSA-N 2 1 385.346 3.345 20 0 GGADMP CN(C(=O)Cc1ccc(Cl)cc1Cl)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000601477604 566407763 /nfs/dbraw/zinc/40/77/63/566407763.db2.gz KBGOZJVWZKTXMT-KRWDZBQOSA-N 2 1 384.351 3.163 20 0 GGADMP CN(C(=O)CSc1ccc(Cl)cc1)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000601472263 566408272 /nfs/dbraw/zinc/40/82/72/566408272.db2.gz GELCWUBPPIAXGB-QGZVFWFLSA-N 2 1 381.973 3.059 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC[N@@H+]1C ZINC000536890237 566409341 /nfs/dbraw/zinc/40/93/41/566409341.db2.gz PUCMZKAAJINMGL-CRAIPNDOSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC[N@H+]1C ZINC000536890237 566409346 /nfs/dbraw/zinc/40/93/46/566409346.db2.gz PUCMZKAAJINMGL-CRAIPNDOSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000447571059 566417910 /nfs/dbraw/zinc/41/79/10/566417910.db2.gz WWBKRSSQDAUZNW-LBTNJELSSA-N 2 1 377.330 3.453 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000447571059 566417915 /nfs/dbraw/zinc/41/79/15/566417915.db2.gz WWBKRSSQDAUZNW-LBTNJELSSA-N 2 1 377.330 3.453 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000510905924 566418953 /nfs/dbraw/zinc/41/89/53/566418953.db2.gz JGWRFFXCDAQUJK-UHFFFAOYSA-N 2 1 392.301 3.336 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000510905924 566418957 /nfs/dbraw/zinc/41/89/57/566418957.db2.gz JGWRFFXCDAQUJK-UHFFFAOYSA-N 2 1 392.301 3.336 20 0 GGADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)[C@H](C)C1 ZINC000557827123 566424681 /nfs/dbraw/zinc/42/46/81/566424681.db2.gz JCQILMZKKWLSBT-RDTXWAMCSA-N 2 1 377.330 3.455 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)[C@H](C)C1 ZINC000557827123 566424693 /nfs/dbraw/zinc/42/46/93/566424693.db2.gz JCQILMZKKWLSBT-RDTXWAMCSA-N 2 1 377.330 3.455 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]CCn2cc(Br)cn2)CC[N@@H+]1Cc1ccccc1 ZINC000671769587 566449452 /nfs/dbraw/zinc/44/94/52/566449452.db2.gz JRIVIIWNRTVOJB-CRAIPNDOSA-N 2 1 377.330 3.288 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]CCn2cc(Br)cn2)CC[N@H+]1Cc1ccccc1 ZINC000671769587 566449454 /nfs/dbraw/zinc/44/94/54/566449454.db2.gz JRIVIIWNRTVOJB-CRAIPNDOSA-N 2 1 377.330 3.288 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]CCn2cc(Br)cn2)CC[N@@H+]1Cc1ccccc1 ZINC000671769590 566449648 /nfs/dbraw/zinc/44/96/48/566449648.db2.gz JRIVIIWNRTVOJB-YJBOKZPZSA-N 2 1 377.330 3.288 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]CCn2cc(Br)cn2)CC[N@H+]1Cc1ccccc1 ZINC000671769590 566449653 /nfs/dbraw/zinc/44/96/53/566449653.db2.gz JRIVIIWNRTVOJB-YJBOKZPZSA-N 2 1 377.330 3.288 20 0 GGADMP C[C@H](C[C@H](C)[NH3+])NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000577749117 566461460 /nfs/dbraw/zinc/46/14/60/566461460.db2.gz MIGCLODPDQEVPV-QWHCGFSZSA-N 2 1 387.355 3.383 20 0 GGADMP C[C@@H]1C[C@H](C)[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)C[C@H]1C[NH3+] ZINC000422637622 566461788 /nfs/dbraw/zinc/46/17/88/566461788.db2.gz PCNQSYUNNQDVLS-FRRDWIJNSA-N 2 1 386.309 3.222 20 0 GGADMP Brc1ccc2nc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)cn2c1 ZINC000422732565 566463339 /nfs/dbraw/zinc/46/33/39/566463339.db2.gz PBYOVHZFRRXVEY-GVDBMIGSSA-N 2 1 377.330 3.497 20 0 GGADMP C[NH+](C)CCOc1cnccc1C[NH2+]Cc1ccc(Br)cc1F ZINC000577774939 566463361 /nfs/dbraw/zinc/46/33/61/566463361.db2.gz FNPLHWNESRQTGF-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP COc1cc(Br)c(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1OC ZINC000422939523 566467595 /nfs/dbraw/zinc/46/75/95/566467595.db2.gz FZQCAHPCPBXIJW-VNQPRFMTSA-N 2 1 383.330 3.477 20 0 GGADMP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+]Cc1cc(Br)ccc1Br ZINC000423051249 566470607 /nfs/dbraw/zinc/47/06/07/566470607.db2.gz MTNRRCLSDPGNOC-WFBYXXMGSA-N 2 1 392.135 3.054 20 0 GGADMP COc1c(Br)cccc1C[N@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000650707674 566471092 /nfs/dbraw/zinc/47/10/92/566471092.db2.gz KQHRWUQUNRXYGO-QRTARXTBSA-N 2 1 383.330 3.176 20 0 GGADMP COc1ccc(Br)cc1C[N@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000650705339 566471339 /nfs/dbraw/zinc/47/13/39/566471339.db2.gz DZLGBKFEJXRSDD-OWQGQXMQSA-N 2 1 383.330 3.176 20 0 GGADMP COc1ccc(Br)c(C[N@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c1 ZINC000650707415 566471394 /nfs/dbraw/zinc/47/13/94/566471394.db2.gz FJRAPMKSKWXUNO-JCKWVBRZSA-N 2 1 383.330 3.176 20 0 GGADMP Cc1cc(N2CCC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)C2=O)ccc1Br ZINC000423046957 566471537 /nfs/dbraw/zinc/47/15/37/566471537.db2.gz GJUZLYBYWKSASW-DPXCBNATSA-N 2 1 392.341 3.126 20 0 GGADMP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]Cc1cc(Br)ccc1Br ZINC000423051247 566471587 /nfs/dbraw/zinc/47/15/87/566471587.db2.gz MTNRRCLSDPGNOC-DUFXMDAXSA-N 2 1 392.135 3.054 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000650707712 566471952 /nfs/dbraw/zinc/47/19/52/566471952.db2.gz LOIRTVFTZRODRC-XHBSWPGZSA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000650707712 566471957 /nfs/dbraw/zinc/47/19/57/566471957.db2.gz LOIRTVFTZRODRC-XHBSWPGZSA-N 2 1 389.284 3.446 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)cc1Br ZINC000650705857 566472297 /nfs/dbraw/zinc/47/22/97/566472297.db2.gz YRBHEASJYXKIRQ-RLFYNMQTSA-N 2 1 383.330 3.176 20 0 GGADMP COc1ccc(Br)c(C[N@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c1 ZINC000650707417 566472338 /nfs/dbraw/zinc/47/23/38/566472338.db2.gz FJRAPMKSKWXUNO-YEWWUXTCSA-N 2 1 383.330 3.176 20 0 GGADMP COc1ccc(Br)c(C[N@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c1 ZINC000650707414 566472349 /nfs/dbraw/zinc/47/23/49/566472349.db2.gz FJRAPMKSKWXUNO-DHSIGJKJSA-N 2 1 383.330 3.176 20 0 GGADMP OC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Br)cc1C(F)(F)F ZINC000423104305 566474572 /nfs/dbraw/zinc/47/45/72/566474572.db2.gz YFNLBRHTHSWHNB-OUEWMDHJSA-N 2 1 393.247 3.374 20 0 GGADMP OC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Br)cc1C(F)(F)F ZINC000423104304 566475030 /nfs/dbraw/zinc/47/50/30/566475030.db2.gz YFNLBRHTHSWHNB-BTQFLJHSSA-N 2 1 393.247 3.374 20 0 GGADMP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1I ZINC000423090757 566475224 /nfs/dbraw/zinc/47/52/24/566475224.db2.gz WBMAZWLCYDZGJA-HZMBPMFUSA-N 2 1 378.685 3.422 20 0 GGADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H](CO)Cc2cc(F)cc(Br)c2)c2ccccc21 ZINC000423173734 566480749 /nfs/dbraw/zinc/48/07/49/566480749.db2.gz ZVITZDPRAXYEEU-ZNOIYHFQSA-N 2 1 393.300 3.474 20 0 GGADMP Cc1c([C@H](C)[NH2+][C@H]2CCC[C@H]([NH3+])C2)nnn1-c1cccc(Br)c1 ZINC000423364459 566486404 /nfs/dbraw/zinc/48/64/04/566486404.db2.gz ASOURXOOYWSFHO-CQDKDKBSSA-N 2 1 378.318 3.259 20 0 GGADMP C[C@H]1CC[NH2+][C@H](C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000423815392 566494392 /nfs/dbraw/zinc/49/43/92/566494392.db2.gz WGQNLUVFUUKXHU-UGSOOPFHSA-N 2 1 384.351 3.462 20 0 GGADMP C[NH+](C)Cc1cnc(CNc2ccc(CC[NH+]3CCSCC3)cc2)s1 ZINC000512024544 566507146 /nfs/dbraw/zinc/50/71/46/566507146.db2.gz MQGGQCFGSJALJH-UHFFFAOYSA-N 2 1 376.595 3.408 20 0 GGADMP Brc1cscc1CNCCC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000512135071 566515255 /nfs/dbraw/zinc/51/52/55/566515255.db2.gz DUZRKFRIDKKHRZ-UHFFFAOYSA-N 2 1 395.370 3.208 20 0 GGADMP C[C@H]1C[NH+](CC2CC[NH+](Cc3cc(O)ccc3Br)CC2)C[C@H](C)O1 ZINC000512177879 566518184 /nfs/dbraw/zinc/51/81/84/566518184.db2.gz GUCYTSHFQCBGKM-GJZGRUSLSA-N 2 1 397.357 3.476 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)cc1OC ZINC000424282816 566524430 /nfs/dbraw/zinc/52/44/30/566524430.db2.gz ARSRMAWLXXQTQO-ZDUSSCGKSA-N 2 1 383.330 3.430 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1cc(Cl)cc(I)c1 ZINC000424286025 566524501 /nfs/dbraw/zinc/52/45/01/566524501.db2.gz FRZVCZHESACREI-IINYFYTJSA-N 2 1 378.685 3.374 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1Cc1cc3c(cc1Br)OCCO3)CC[NH2+]CC2 ZINC000424283212 566525391 /nfs/dbraw/zinc/52/53/91/566525391.db2.gz BBJRXKBPBBFPTC-CYBMUJFWSA-N 2 1 381.314 3.184 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)cc1OC ZINC000424282815 566525490 /nfs/dbraw/zinc/52/54/90/566525490.db2.gz ARSRMAWLXXQTQO-CYBMUJFWSA-N 2 1 383.330 3.430 20 0 GGADMP Cc1cc(Br)ccc1C[N@H+]1CC[C@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000538763912 566533586 /nfs/dbraw/zinc/53/35/86/566533586.db2.gz BWAXWEFDUVFZQP-IBGZPJMESA-N 2 1 380.374 3.358 20 0 GGADMP Cc1cc(Br)ccc1C[N@@H+]1CC[C@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000538763912 566533588 /nfs/dbraw/zinc/53/35/88/566533588.db2.gz BWAXWEFDUVFZQP-IBGZPJMESA-N 2 1 380.374 3.358 20 0 GGADMP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2cc(F)cc(Br)c2)CC1 ZINC000449195581 566535370 /nfs/dbraw/zinc/53/53/70/566535370.db2.gz ZMFKKNWYFNUAKG-ZWKOTPCHSA-N 2 1 385.321 3.446 20 0 GGADMP C[NH+](C)CCOc1cc(C[NH2+]Cc2cccc(Br)c2F)ccn1 ZINC000449222118 566539190 /nfs/dbraw/zinc/53/91/90/566539190.db2.gz LMGAITGEMBHZOP-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)NCCc1ccc(Cl)s1 ZINC000465695667 566540972 /nfs/dbraw/zinc/54/09/72/566540972.db2.gz ZNBKQXZBLNUUSB-OAHLLOKOSA-N 2 1 386.993 3.002 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1cc(C)c(Br)cn1 ZINC000628278594 566543263 /nfs/dbraw/zinc/54/32/63/566543263.db2.gz XUEXCAXGIQCYNP-QGZVFWFLSA-N 2 1 383.378 3.000 20 0 GGADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCn3cc(Br)ccc3=O)CC2)C1 ZINC000449380545 566555745 /nfs/dbraw/zinc/55/57/45/566555745.db2.gz WILPNFWJFIDXTA-CRAIPNDOSA-N 2 1 396.373 3.244 20 0 GGADMP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C[C@H](O)C[NH+]1CCCC1 ZINC000539308161 566572207 /nfs/dbraw/zinc/57/22/07/566572207.db2.gz HVCFSAOIXILTKM-IFIJOSMWSA-N 2 1 385.371 3.278 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046746 566574178 /nfs/dbraw/zinc/57/41/78/566574178.db2.gz BJNSIWMOIXSRCR-GJZGRUSLSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046746 566574188 /nfs/dbraw/zinc/57/41/88/566574188.db2.gz BJNSIWMOIXSRCR-GJZGRUSLSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046746 566574192 /nfs/dbraw/zinc/57/41/92/566574192.db2.gz BJNSIWMOIXSRCR-GJZGRUSLSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046746 566574204 /nfs/dbraw/zinc/57/42/04/566574204.db2.gz BJNSIWMOIXSRCR-GJZGRUSLSA-N 2 1 375.340 3.397 20 0 GGADMP Brc1ccc2[nH+]ccc(N3CC[NH+](C[C@@H]4CCCO4)CC3)c2c1 ZINC000674062528 566575825 /nfs/dbraw/zinc/57/58/25/566575825.db2.gz RIHAZIVITGNMGY-HNNXBMFYSA-N 2 1 376.298 3.298 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(Br)ccc2F)[C@@H](C)C1 ZINC000449596719 566578889 /nfs/dbraw/zinc/57/88/89/566578889.db2.gz CFXMEQNLNMKVNM-IYOUNJFTSA-N 2 1 387.337 3.059 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1Br ZINC000449599465 566580893 /nfs/dbraw/zinc/58/08/93/566580893.db2.gz LASMTYSNJYIACB-BZSNNMDCSA-N 2 1 381.358 3.125 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000449684989 566592473 /nfs/dbraw/zinc/59/24/73/566592473.db2.gz QSAIBONAXIDRFN-JQHSSLGASA-N 2 1 381.358 3.125 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cccc(Br)c2C)[C@H](C)C1 ZINC000449686741 566592789 /nfs/dbraw/zinc/59/27/89/566592789.db2.gz XZXVMODQRFUWTL-OGWOLHLISA-N 2 1 383.374 3.228 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2cccc(Br)c2C)[C@H](C)C1 ZINC000449686736 566593218 /nfs/dbraw/zinc/59/32/18/566593218.db2.gz XZXVMODQRFUWTL-ALKREAHSSA-N 2 1 383.374 3.228 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](CC(=O)Nc3ccc(Cl)cc3Cl)C2)C1 ZINC000652346112 566602790 /nfs/dbraw/zinc/60/27/90/566602790.db2.gz UDQKSFJURKRJDK-MRRJBJDNSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](CC(=O)Nc3ccc(Cl)cc3Cl)C2)C1 ZINC000652346112 566602798 /nfs/dbraw/zinc/60/27/98/566602798.db2.gz UDQKSFJURKRJDK-MRRJBJDNSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](CC(=O)Nc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000652345664 566602825 /nfs/dbraw/zinc/60/28/25/566602825.db2.gz IHFQPDFOMCQOIS-AHIWAGSCSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](CC(=O)Nc3ccc(Cl)cc3Cl)C2)C1 ZINC000652346114 566603845 /nfs/dbraw/zinc/60/38/45/566603845.db2.gz UDQKSFJURKRJDK-SUYBPPKGSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](CC(=O)Nc3ccc(Cl)cc3Cl)C2)C1 ZINC000652346114 566603848 /nfs/dbraw/zinc/60/38/48/566603848.db2.gz UDQKSFJURKRJDK-SUYBPPKGSA-N 2 1 386.323 3.150 20 0 GGADMP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cnc(-c4ccsc4)s3)C2)CC1 ZINC000539820943 566603977 /nfs/dbraw/zinc/60/39/77/566603977.db2.gz RYFHEWHNRWEKDT-QGZVFWFLSA-N 2 1 376.595 3.472 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3cc(Br)cc(F)c3F)C2)C1 ZINC000652350224 566605319 /nfs/dbraw/zinc/60/53/19/566605319.db2.gz MSBRBHUXOUWASD-PEYYIBSZSA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](Cc3cc(Br)cc(F)c3F)C2)C1 ZINC000652350224 566605321 /nfs/dbraw/zinc/60/53/21/566605321.db2.gz MSBRBHUXOUWASD-PEYYIBSZSA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2CC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000652360311 566605578 /nfs/dbraw/zinc/60/55/78/566605578.db2.gz FEXMIKJQYFVULH-OAUYIBNBSA-N 2 1 386.323 3.293 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@H+]2CC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000652360311 566605581 /nfs/dbraw/zinc/60/55/81/566605581.db2.gz FEXMIKJQYFVULH-OAUYIBNBSA-N 2 1 386.323 3.293 20 0 GGADMP CCCOc1ccc(Br)cc1C[N@@H+](C)C1CCN(CCO)CC1 ZINC000513554855 566608608 /nfs/dbraw/zinc/60/86/08/566608608.db2.gz TVOIGBMLHFBMQW-UHFFFAOYSA-N 2 1 385.346 3.126 20 0 GGADMP C[NH+]1CCN(C(=O)CC[N@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000514228974 566646771 /nfs/dbraw/zinc/64/67/71/566646771.db2.gz MPCXKEVDQGZRPY-UHFFFAOYSA-N 2 1 382.335 3.247 20 0 GGADMP C[NH+]1CCN(C(=O)CC[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000514228974 566646776 /nfs/dbraw/zinc/64/67/76/566646776.db2.gz MPCXKEVDQGZRPY-UHFFFAOYSA-N 2 1 382.335 3.247 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(Br)cc1 ZINC000607055550 566655321 /nfs/dbraw/zinc/65/53/21/566655321.db2.gz JUDPKPBUOBGFLP-QGZVFWFLSA-N 2 1 397.361 3.329 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](CCOc2ccc(Br)cc2)CC[C@@H]1C(F)(F)F ZINC000629568158 566668098 /nfs/dbraw/zinc/66/80/98/566668098.db2.gz RUEBHZDREAMORG-RISCZKNCSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCOc2ccc(Br)cc2)CC[C@@H]1C(F)(F)F ZINC000629568158 566668100 /nfs/dbraw/zinc/66/81/00/566668100.db2.gz RUEBHZDREAMORG-RISCZKNCSA-N 2 1 381.236 3.287 20 0 GGADMP O[C@@]1(C[NH2+]Cc2ccc(F)c(Br)c2)CC[N@H+](Cc2ccccc2)C1 ZINC000607366219 566669651 /nfs/dbraw/zinc/66/96/51/566669651.db2.gz AYJVGIICRKCDEX-LJQANCHMSA-N 2 1 393.300 3.315 20 0 GGADMP O[C@@]1(C[NH2+]Cc2ccc(F)c(Br)c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000607366219 566669655 /nfs/dbraw/zinc/66/96/55/566669655.db2.gz AYJVGIICRKCDEX-LJQANCHMSA-N 2 1 393.300 3.315 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](C[NH2+]C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000514932699 566679757 /nfs/dbraw/zinc/67/97/57/566679757.db2.gz KNKJBKNUZZYGIO-GDBMZVCRSA-N 2 1 375.340 3.301 20 0 GGADMP C[C@H](C[NH2+][C@H]1CCCOc2ccc(I)cc21)C[NH+](C)C ZINC000425927760 566682329 /nfs/dbraw/zinc/68/23/29/566682329.db2.gz UMDQULXWYITMFQ-DOMZBBRYSA-N 2 1 388.293 3.292 20 0 GGADMP Brc1ccc(-n2cc(C[N@H+]3CCC[C@@H]([C@@H]4CC[NH2+]C4)C3)cn2)cc1 ZINC000515061148 566689446 /nfs/dbraw/zinc/68/94/46/566689446.db2.gz TXHXVEFOWSQLPO-IAGOWNOFSA-N 2 1 389.341 3.456 20 0 GGADMP [NH3+][C@H]1CCO[C@H](C2CC[NH+](CC(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000561283679 566690336 /nfs/dbraw/zinc/69/03/36/566690336.db2.gz VKXYGGLNZSXKBZ-GUYCJALGSA-N 2 1 386.323 3.150 20 0 GGADMP O[C@H]1CCC[C@@H]1[NH+]1CCN(c2cc[nH+]c3cc(Br)ccc32)CC1 ZINC000608014032 566690910 /nfs/dbraw/zinc/69/09/10/566690910.db2.gz BSBNKMHFHWJPRR-ROUUACIJSA-N 2 1 376.298 3.033 20 0 GGADMP O[C@@H]1CCC[C@H]1[NH+]1CCN(c2cc[nH+]c3cc(Br)ccc32)CC1 ZINC000608014031 566691106 /nfs/dbraw/zinc/69/11/06/566691106.db2.gz BSBNKMHFHWJPRR-QZTJIDSGSA-N 2 1 376.298 3.033 20 0 GGADMP C[N@H+](CC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1)C1CCC1 ZINC000630009234 566697560 /nfs/dbraw/zinc/69/75/60/566697560.db2.gz KFCDRKHIVJYPDO-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP C[N@@H+](CC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1)C1CCC1 ZINC000630009234 566697568 /nfs/dbraw/zinc/69/75/68/566697568.db2.gz KFCDRKHIVJYPDO-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cc(Br)c2c(c1)OCCO2 ZINC000515254037 566701486 /nfs/dbraw/zinc/70/14/86/566701486.db2.gz FZBBLZXWBCPCSM-UHFFFAOYSA-N 2 1 380.286 3.247 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cc(Br)c2c(c1)OCCO2 ZINC000515254037 566701494 /nfs/dbraw/zinc/70/14/94/566701494.db2.gz FZBBLZXWBCPCSM-UHFFFAOYSA-N 2 1 380.286 3.247 20 0 GGADMP C[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1cncc(Br)c1 ZINC000580572497 566705837 /nfs/dbraw/zinc/70/58/37/566705837.db2.gz YHSCCXQTIXESLA-ZDUSSCGKSA-N 2 1 379.302 3.030 20 0 GGADMP CN(CCC[N@@H+](C)CC1=Cc2cc(Br)ccc2OC1)CC[NH+](C)C ZINC000515557138 566720834 /nfs/dbraw/zinc/72/08/34/566720834.db2.gz RFFADPCRHMPZSO-UHFFFAOYSA-N 2 1 396.373 3.040 20 0 GGADMP C[NH+]1CCN(c2cc[nH+]cc2NC(=O)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000516207818 566751887 /nfs/dbraw/zinc/75/18/87/566751887.db2.gz OLQLDJOEYRWADJ-UHFFFAOYSA-N 2 1 379.291 3.321 20 0 GGADMP C[N@H+](C[C@H](O)C[NH+]1CCC(C)(c2cccc(Br)c2)CC1)C1CC1 ZINC000562037924 566758691 /nfs/dbraw/zinc/75/86/91/566758691.db2.gz CDKLTZUMZSZGNY-SFHVURJKSA-N 2 1 381.358 3.258 20 0 GGADMP C[N@@H+](C[C@H](O)C[NH+]1CCC(C)(c2cccc(Br)c2)CC1)C1CC1 ZINC000562037924 566758697 /nfs/dbraw/zinc/75/86/97/566758697.db2.gz CDKLTZUMZSZGNY-SFHVURJKSA-N 2 1 381.358 3.258 20 0 GGADMP Brc1cccc(-c2noc(C[N@H+]3CCC[C@@H]([C@@H]4CC[NH2+]C4)C3)n2)c1 ZINC000516469850 566764014 /nfs/dbraw/zinc/76/40/14/566764014.db2.gz XJNKBPBHYMDECN-HUUCEWRRSA-N 2 1 391.313 3.321 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)[C@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000516567244 566769395 /nfs/dbraw/zinc/76/93/95/566769395.db2.gz VDLHVDLCAYRXDM-ZRGWGRIASA-N 2 1 396.373 3.107 20 0 GGADMP O=C(C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)Nc1cccc(Br)c1 ZINC000581364197 566770269 /nfs/dbraw/zinc/77/02/69/566770269.db2.gz IUPPPNRFBJHKEG-GVDBMIGSSA-N 2 1 380.330 3.288 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C[C@@H](O)COc2ccc(Br)cc2)C1 ZINC000581364943 566772400 /nfs/dbraw/zinc/77/24/00/566772400.db2.gz URZJNJLFKXJIGU-SJLPKXTDSA-N 2 1 399.373 3.291 20 0 GGADMP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2ccncc2Br)cc1 ZINC000631062710 566776211 /nfs/dbraw/zinc/77/62/11/566776211.db2.gz SIOUFRGQTXQDLS-UHFFFAOYSA-N 2 1 378.314 3.464 20 0 GGADMP CN(C)c1cc(Cl)cc(Cl)c1C[NH2+]CC1CCN(CC[NH+](C)C)CC1 ZINC000581636860 566794571 /nfs/dbraw/zinc/79/45/71/566794571.db2.gz UNOIGOFUDLWMTP-UHFFFAOYSA-N 2 1 387.399 3.423 20 0 GGADMP Cn1cc(Br)cc1C[N@@H+](C)Cc1ccc(OCC[NH+](C)C)cc1 ZINC000678337034 566795551 /nfs/dbraw/zinc/79/55/51/566795551.db2.gz QQJWEUKKRZJTGM-UHFFFAOYSA-N 2 1 380.330 3.360 20 0 GGADMP COc1ccc(Br)cc1C[N@H+](C)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000678719981 566814411 /nfs/dbraw/zinc/81/44/11/566814411.db2.gz TYXBDHKRWZQWCI-GOSISDBHSA-N 2 1 396.373 3.058 20 0 GGADMP COc1ccc(Br)cc1C[N@@H+](C)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000678719981 566814416 /nfs/dbraw/zinc/81/44/16/566814416.db2.gz TYXBDHKRWZQWCI-GOSISDBHSA-N 2 1 396.373 3.058 20 0 GGADMP C[NH2+]CCC1CC[NH+](Cc2cc(Br)c3c(c2)OCCCO3)CC1 ZINC000469851210 566820606 /nfs/dbraw/zinc/82/06/06/566820606.db2.gz HSGJFELSDXSQRJ-UHFFFAOYSA-N 2 1 383.330 3.432 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1Br ZINC000678929732 566825605 /nfs/dbraw/zinc/82/56/05/566825605.db2.gz MCGUKAQCJSGMBL-MRXNPFEDSA-N 2 1 383.330 3.191 20 0 GGADMP Brc1cccc(OCC[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)c1 ZINC000655699847 566836030 /nfs/dbraw/zinc/83/60/30/566836030.db2.gz CETPVJADJHSWQW-SFHVURJKSA-N 2 1 383.330 3.061 20 0 GGADMP COc1cc(Br)c(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c(OC)c1 ZINC000470005924 566837153 /nfs/dbraw/zinc/83/71/53/566837153.db2.gz KGISPPOJUJKVRN-KRWDZBQOSA-N 2 1 383.330 3.430 20 0 GGADMP C[NH+]1CCN(c2cc[nH+]cc2NC(=O)Cc2c(Cl)cccc2Cl)CC1 ZINC000517650894 566837651 /nfs/dbraw/zinc/83/76/51/566837651.db2.gz DUDWTNWNAOKMRF-UHFFFAOYSA-N 2 1 379.291 3.321 20 0 GGADMP Brc1cccc(C2(C[NH2+]C3CC[NH+]([C@@H]4CCOC4)CC3)CC2)c1 ZINC000655715821 566837932 /nfs/dbraw/zinc/83/79/32/566837932.db2.gz OMVAYRIBNLANJW-GOSISDBHSA-N 2 1 379.342 3.324 20 0 GGADMP C[NH+]1CCN(CCCC[NH2+]Cc2oc3ccccc3c2Br)CC1 ZINC000655710606 566837951 /nfs/dbraw/zinc/83/79/51/566837951.db2.gz BQBVSKMTBUENGX-UHFFFAOYSA-N 2 1 380.330 3.313 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)Oc1cccc(Br)c1 ZINC000655719556 566838944 /nfs/dbraw/zinc/83/89/44/566838944.db2.gz VXDUPJUQIQLUFD-YOEHRIQHSA-N 2 1 383.330 3.059 20 0 GGADMP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccccc3Br)nc2C)C1 ZINC000655710955 566839046 /nfs/dbraw/zinc/83/90/46/566839046.db2.gz DXMPHPLFKALGPR-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccccc3Br)nc2C)C1 ZINC000655710955 566839051 /nfs/dbraw/zinc/83/90/51/566839051.db2.gz DXMPHPLFKALGPR-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP C[NH2+]CC1CC[NH+](Cc2cc(Br)c(OC(F)F)c(OC)c2)CC1 ZINC000470019266 566839080 /nfs/dbraw/zinc/83/90/80/566839080.db2.gz RWJCANXTLPTBIV-UHFFFAOYSA-N 2 1 393.272 3.491 20 0 GGADMP Clc1ccc(Br)c(CC[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)c1 ZINC000655734673 566840290 /nfs/dbraw/zinc/84/02/90/566840290.db2.gz LYZIVXMICUEBEC-INIZCTEOSA-N 2 1 387.749 3.488 20 0 GGADMP Brc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1 ZINC000562980652 566840495 /nfs/dbraw/zinc/84/04/95/566840495.db2.gz GKAYOEAHOIMTMJ-INIZCTEOSA-N 2 1 390.329 3.201 20 0 GGADMP Cc1cc(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)ccc1Br ZINC000582268655 566845879 /nfs/dbraw/zinc/84/58/79/566845879.db2.gz YBDOMYZRNVOUNM-UHFFFAOYSA-N 2 1 380.374 3.217 20 0 GGADMP Clc1cc(Br)ccc1CC[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655772452 566847513 /nfs/dbraw/zinc/84/75/13/566847513.db2.gz WBCPAAMXVAQUSC-INIZCTEOSA-N 2 1 387.749 3.488 20 0 GGADMP C[NH+](C)CCCCC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000517887153 566852990 /nfs/dbraw/zinc/85/29/90/566852990.db2.gz WUPRZJSKOQAUOC-UHFFFAOYSA-N 2 1 396.373 3.262 20 0 GGADMP Brc1cc(C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc2c1OCCO2 ZINC000563135802 566857549 /nfs/dbraw/zinc/85/75/49/566857549.db2.gz UJZQXEQESCFHSS-LSDHHAIUSA-N 2 1 381.314 3.042 20 0 GGADMP C[C@@H]1C[N@H+](CCOc2cc(Cl)cc(Cl)c2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000490632672 566872379 /nfs/dbraw/zinc/87/23/79/566872379.db2.gz SXSGUEIPFWJIMG-BEFAXECRSA-N 2 1 386.367 3.330 20 0 GGADMP C[C@@H]1C[N@@H+](CCOc2cc(Cl)cc(Cl)c2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000490632672 566872385 /nfs/dbraw/zinc/87/23/85/566872385.db2.gz SXSGUEIPFWJIMG-BEFAXECRSA-N 2 1 386.367 3.330 20 0 GGADMP CC(C)[C@](C)([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000563464164 566885452 /nfs/dbraw/zinc/88/54/52/566885452.db2.gz NWRNHPNYOFHWDZ-IBGZPJMESA-N 2 1 396.373 3.074 20 0 GGADMP CC[C@H]1[NH2+]CC[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000518528220 566890004 /nfs/dbraw/zinc/89/00/04/566890004.db2.gz SEPKPBRKJUOILC-MAUKXSAKSA-N 2 1 384.351 3.462 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](CCC(=O)Nc2ccccc2Br)C1 ZINC000470961756 566918939 /nfs/dbraw/zinc/91/89/39/566918939.db2.gz YNKBHAJIDQRUOE-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000470961756 566918945 /nfs/dbraw/zinc/91/89/45/566918945.db2.gz YNKBHAJIDQRUOE-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000470961756 566918952 /nfs/dbraw/zinc/91/89/52/566918952.db2.gz YNKBHAJIDQRUOE-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+][C@@H]2CCCc3c(Br)cccc32)C1 ZINC000544010928 566927713 /nfs/dbraw/zinc/92/77/13/566927713.db2.gz IPPKNNGTCRVDDA-RDTXWAMCSA-N 2 1 394.357 3.004 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](C[NH2+]C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000564078554 566942982 /nfs/dbraw/zinc/94/29/82/566942982.db2.gz SSKXILIFPSBFAQ-ZBFHGGJFSA-N 2 1 375.340 3.301 20 0 GGADMP Brc1ccc2ncc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)n2c1 ZINC000656784088 566949614 /nfs/dbraw/zinc/94/96/14/566949614.db2.gz CMQPDWAVKKBDQM-HNNXBMFYSA-N 2 1 377.330 3.308 20 0 GGADMP COc1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c(Br)c1O ZINC000656784966 566949782 /nfs/dbraw/zinc/94/97/82/566949782.db2.gz FPKXZTHGYAZVPA-AWEZNQCLSA-N 2 1 383.330 3.375 20 0 GGADMP COc1cc(Br)c(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)cc1O ZINC000656787049 566950284 /nfs/dbraw/zinc/95/02/84/566950284.db2.gz SDRXUNLRIXINLS-CQSZACIVSA-N 2 1 383.330 3.375 20 0 GGADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000583623329 566968563 /nfs/dbraw/zinc/96/85/63/566968563.db2.gz DRIPIKSJPASQMM-INIZCTEOSA-N 2 1 396.373 3.106 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000583623329 566968567 /nfs/dbraw/zinc/96/85/67/566968567.db2.gz DRIPIKSJPASQMM-INIZCTEOSA-N 2 1 396.373 3.106 20 0 GGADMP CSc1cc(Br)ccc1C[N@@H+]1C[C@@H](C[NH3+])C2(C1)CCOCC2 ZINC000583693289 566975058 /nfs/dbraw/zinc/97/50/58/566975058.db2.gz JHQMPJJRWMWDHH-CQSZACIVSA-N 2 1 385.371 3.358 20 0 GGADMP CSc1cc(Br)ccc1C[N@H+]1C[C@@H](C[NH3+])C2(C1)CCOCC2 ZINC000583693289 566975064 /nfs/dbraw/zinc/97/50/64/566975064.db2.gz JHQMPJJRWMWDHH-CQSZACIVSA-N 2 1 385.371 3.358 20 0 GGADMP COc1c(Br)cccc1C[NH2+]Cc1ccncc1OCC[NH+](C)C ZINC000564752729 567004703 /nfs/dbraw/zinc/00/47/03/567004703.db2.gz CEGHUAYQIJGSLG-UHFFFAOYSA-N 2 1 394.313 3.083 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(OCCC[NH3+])CC1)c1ccc(Cl)c(Cl)c1 ZINC000430560997 567020647 /nfs/dbraw/zinc/02/06/47/567020647.db2.gz JJXYVCSGEAWGST-CYBMUJFWSA-N 2 1 388.339 3.000 20 0 GGADMP O=C(CC[NH+]1CCC([NH2+]CC2CC2)CC1)Nc1cccc(Br)c1 ZINC000430578439 567022538 /nfs/dbraw/zinc/02/25/38/567022538.db2.gz YRZQDHZZIHATAT-UHFFFAOYSA-N 2 1 380.330 3.242 20 0 GGADMP [NH3+]CCCOC1CC[NH+](Cc2coc(-c3ccc(Br)cc3)n2)CC1 ZINC000430581317 567022615 /nfs/dbraw/zinc/02/26/15/567022615.db2.gz HCGXDEAPBLVGPE-UHFFFAOYSA-N 2 1 394.313 3.434 20 0 GGADMP CC(C)[C@@](C)(C[NH3+])[NH2+]CCCOc1cccc(I)c1 ZINC000430586842 567023021 /nfs/dbraw/zinc/02/30/21/567023021.db2.gz UCSCVYTUIWWACA-OAHLLOKOSA-N 2 1 376.282 3.023 20 0 GGADMP O=C(NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1C[C@@]12CC[NH2+]C2 ZINC000564939618 567023131 /nfs/dbraw/zinc/02/31/31/567023131.db2.gz FKWFAKQWZAWRQF-IEBWSBKVSA-N 2 1 382.335 3.074 20 0 GGADMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000430579274 567023203 /nfs/dbraw/zinc/02/32/03/567023203.db2.gz CAQGUHRVEMSCEF-ZIAGYGMSSA-N 2 1 388.293 3.119 20 0 GGADMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000430579273 567023299 /nfs/dbraw/zinc/02/32/99/567023299.db2.gz CAQGUHRVEMSCEF-UONOGXRCSA-N 2 1 388.293 3.119 20 0 GGADMP CC[NH2+]CC1CC[NH+](Cc2nc(-c3cc(Br)cs3)no2)CC1 ZINC000430578089 567023612 /nfs/dbraw/zinc/02/36/12/567023612.db2.gz ABUPJFVHZNDHHT-UHFFFAOYSA-N 2 1 385.331 3.382 20 0 GGADMP CC[NH2+]CC1CC[NH+](Cc2nc(Cc3cccc(Br)c3)no2)CC1 ZINC000430594031 567024673 /nfs/dbraw/zinc/02/46/73/567024673.db2.gz UVAFKOAWLUEUJV-UHFFFAOYSA-N 2 1 393.329 3.244 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000564986071 567028365 /nfs/dbraw/zinc/02/83/65/567028365.db2.gz DMRUIJIKKSJTLM-HNNXBMFYSA-N 2 1 380.330 3.018 20 0 GGADMP O=C(C[NH+]1CCC2(CC[NH2+]C2)CC1)Nc1ccc(Br)cc1Cl ZINC000431025348 567047175 /nfs/dbraw/zinc/04/71/75/567047175.db2.gz YYPHURHRPUSLDY-UHFFFAOYSA-N 2 1 386.721 3.117 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cncc(Br)c2C)[C@@H](C)C1 ZINC000657362342 567051157 /nfs/dbraw/zinc/05/11/57/567051157.db2.gz AJGGCYZRYGGOEO-KBXCAEBGSA-N 2 1 384.362 3.379 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cncc(Br)c2C)[C@@H](C)C1 ZINC000657362342 567051161 /nfs/dbraw/zinc/05/11/61/567051161.db2.gz AJGGCYZRYGGOEO-KBXCAEBGSA-N 2 1 384.362 3.379 20 0 GGADMP Cc1c(Br)cncc1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000657433470 567056194 /nfs/dbraw/zinc/05/61/94/567056194.db2.gz YHZBCUXZVHHDGC-SFHVURJKSA-N 2 1 390.325 3.009 20 0 GGADMP Brc1ccc2[nH]cc(CC[NH2+][C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)c2c1 ZINC000584840297 567076064 /nfs/dbraw/zinc/07/60/64/567076064.db2.gz VGBCLPOTGNQFCU-SZVBFZGTSA-N 2 1 392.341 3.220 20 0 GGADMP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000545859432 567081944 /nfs/dbraw/zinc/08/19/44/567081944.db2.gz CQLRRBAWBLWTDA-QGZVFWFLSA-N 2 1 381.339 3.334 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@H]2C)cc1Br ZINC000453380881 567083712 /nfs/dbraw/zinc/08/37/12/567083712.db2.gz RMYBQBLCJIBDSJ-IIHSZXCVSA-N 2 1 383.374 3.227 20 0 GGADMP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000522001165 567093645 /nfs/dbraw/zinc/09/36/45/567093645.db2.gz HNHOEDNPEXMZIE-DZGCQCFKSA-N 2 1 375.314 3.465 20 0 GGADMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000522001165 567093650 /nfs/dbraw/zinc/09/36/50/567093650.db2.gz HNHOEDNPEXMZIE-DZGCQCFKSA-N 2 1 375.314 3.465 20 0 GGADMP CCOc1c(Br)cc(C[N@H+](C)CCC[NH3+])cc1Br ZINC000566226432 567140620 /nfs/dbraw/zinc/14/06/20/567140620.db2.gz SVZZFXYLLGENRC-UHFFFAOYSA-N 2 1 380.124 3.391 20 0 GGADMP CCOc1c(Br)cc(C[N@@H+](C)CCC[NH3+])cc1Br ZINC000566226432 567140628 /nfs/dbraw/zinc/14/06/28/567140628.db2.gz SVZZFXYLLGENRC-UHFFFAOYSA-N 2 1 380.124 3.391 20 0 GGADMP CC[C@@H]([NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1)c1cccc(Br)c1 ZINC000566103740 567126493 /nfs/dbraw/zinc/12/64/93/567126493.db2.gz JCWNLVJAMPPONY-OAHLLOKOSA-N 2 1 378.318 3.275 20 0 GGADMP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000546566235 567136889 /nfs/dbraw/zinc/13/68/89/567136889.db2.gz HWSSZOJGURKEEJ-QGZVFWFLSA-N 2 1 381.339 3.334 20 0 GGADMP C[N@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000546566235 567136895 /nfs/dbraw/zinc/13/68/95/567136895.db2.gz HWSSZOJGURKEEJ-QGZVFWFLSA-N 2 1 381.339 3.334 20 0 GGADMP CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNCc1ccc(F)c(Cl)c1Cl ZINC000432236425 567138818 /nfs/dbraw/zinc/13/88/18/567138818.db2.gz UMFFLTCBDPCITB-CQSZACIVSA-N 2 1 376.303 3.165 20 0 GGADMP CN(C)C(=O)[C@H]1CCCN1CCC[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000432236425 567138826 /nfs/dbraw/zinc/13/88/26/567138826.db2.gz UMFFLTCBDPCITB-CQSZACIVSA-N 2 1 376.303 3.165 20 0 GGADMP CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNCc1ccc(F)c(Cl)c1Cl ZINC000432236424 567139002 /nfs/dbraw/zinc/13/90/02/567139002.db2.gz UMFFLTCBDPCITB-AWEZNQCLSA-N 2 1 376.303 3.165 20 0 GGADMP CN(C)C(=O)[C@@H]1CCCN1CCC[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000432236424 567139007 /nfs/dbraw/zinc/13/90/07/567139007.db2.gz UMFFLTCBDPCITB-AWEZNQCLSA-N 2 1 376.303 3.165 20 0 GGADMP C[C@H]1C[N@H+](CCC[NH2+]CC2=Cc3cc(Br)ccc3OC2)CCCO1 ZINC000432361274 567153658 /nfs/dbraw/zinc/15/36/58/567153658.db2.gz CNICAXBZKHGRKO-HNNXBMFYSA-N 2 1 395.341 3.315 20 0 GGADMP C[C@H]1C[N@@H+](CCC[NH2+]CC2=Cc3cc(Br)ccc3OC2)CCCO1 ZINC000432361274 567153660 /nfs/dbraw/zinc/15/36/60/567153660.db2.gz CNICAXBZKHGRKO-HNNXBMFYSA-N 2 1 395.341 3.315 20 0 GGADMP C[C@@H]1C[N@H+](CCC[NH2+][C@@H]2CCc3cc(Br)ccc3C2)CCCO1 ZINC000432424045 567159778 /nfs/dbraw/zinc/15/97/78/567159778.db2.gz MLEASWJJYLEHBD-DNVCBOLYSA-N 2 1 381.358 3.397 20 0 GGADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H]2CCc3cc(Br)ccc3C2)CCCO1 ZINC000432424045 567159782 /nfs/dbraw/zinc/15/97/82/567159782.db2.gz MLEASWJJYLEHBD-DNVCBOLYSA-N 2 1 381.358 3.397 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)CCc1ccc(I)cc1 ZINC000474631005 567185763 /nfs/dbraw/zinc/18/57/63/567185763.db2.gz RAOAEDUNZHZKRI-ZDUSSCGKSA-N 2 1 383.277 3.407 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+]CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474707283 567193657 /nfs/dbraw/zinc/19/36/57/567193657.db2.gz JFOBJNVIFXRVPG-MRXNPFEDSA-N 2 1 386.367 3.493 20 0 GGADMP C[C@@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474714738 567194183 /nfs/dbraw/zinc/19/41/83/567194183.db2.gz OPOSZCMJDJIFMX-VNQPRFMTSA-N 2 1 383.989 3.426 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+]CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474707282 567194734 /nfs/dbraw/zinc/19/47/34/567194734.db2.gz JFOBJNVIFXRVPG-INIZCTEOSA-N 2 1 386.367 3.493 20 0 GGADMP COC(=O)c1cccc(Br)c1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000432937785 567205741 /nfs/dbraw/zinc/20/57/41/567205741.db2.gz LSWWRAOSYHVORQ-UHFFFAOYSA-N 2 1 383.330 3.399 20 0 GGADMP COc1ccc(C[NH2+]C[C@@H](c2cccs2)N2CC[NH+](C)CC2)cc1Cl ZINC000524728148 567211879 /nfs/dbraw/zinc/21/18/79/567211879.db2.gz REAKKCIZMIWWNT-KRWDZBQOSA-N 2 1 379.957 3.488 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)c2c[nH]c3ncc(Br)cc23)CC1 ZINC000659851826 567233223 /nfs/dbraw/zinc/23/32/23/567233223.db2.gz JSCVGDAYPPSVHU-UHFFFAOYSA-N 2 1 393.329 3.172 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(Br)c1 ZINC000525372303 567245199 /nfs/dbraw/zinc/24/51/99/567245199.db2.gz CGEVMJPTVINZPX-QGZVFWFLSA-N 2 1 397.361 3.329 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cnn2cc(Br)cnc12 ZINC000638366619 567245107 /nfs/dbraw/zinc/24/51/07/567245107.db2.gz PSGKSDSPOPDHRM-AWEZNQCLSA-N 2 1 380.334 3.236 20 0 GGADMP CC(C)[N@@H+](C)CC1CC[NH+](C[C@H](O)COc2ccc(Br)cc2)CC1 ZINC000590787269 567248502 /nfs/dbraw/zinc/24/85/02/567248502.db2.gz XQAWSWMATUMRQN-SFHVURJKSA-N 2 1 399.373 3.241 20 0 GGADMP CC[N@H+]1CC[C@H](N(C)CC(=O)c2c[nH]c3ncc(Br)cc23)[C@H](C)C1 ZINC000660081105 567258362 /nfs/dbraw/zinc/25/83/62/567258362.db2.gz CVRQZSIMDACJLG-WBMJQRKESA-N 2 1 393.329 3.170 20 0 GGADMP CC[N@H+]1CC[C@@H](N(C)CC(=O)c2c[nH]c3ncc(Br)cc23)[C@H](C)C1 ZINC000660081104 567258579 /nfs/dbraw/zinc/25/85/79/567258579.db2.gz CVRQZSIMDACJLG-MLGOLLRUSA-N 2 1 393.329 3.170 20 0 GGADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(Br)cc2N2CCOCC2)CC1 ZINC000475587908 567258945 /nfs/dbraw/zinc/25/89/45/567258945.db2.gz WRDVXNBNBUZORO-UHFFFAOYSA-N 2 1 396.373 3.202 20 0 GGADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(Br)cc2N2CCOCC2)CC1 ZINC000475587908 567258949 /nfs/dbraw/zinc/25/89/49/567258949.db2.gz WRDVXNBNBUZORO-UHFFFAOYSA-N 2 1 396.373 3.202 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)[C@](C)([NH3+])c2ccc(Br)cc2)CC1 ZINC000567773859 567275231 /nfs/dbraw/zinc/27/52/31/567275231.db2.gz QDVPLCMNJWLMON-LJQANCHMSA-N 2 1 396.373 3.202 20 0 GGADMP CN(CCC1CC[NH+](C2CCN(C)CC2)CC1)c1cc[nH+]cc1Br ZINC000548153803 567283115 /nfs/dbraw/zinc/28/31/15/567283115.db2.gz UZWTWVUSBNDDIM-UHFFFAOYSA-N 2 1 395.389 3.477 20 0 GGADMP C[N@@H+](CCC[NH+]1CCCC1)CCC(=O)Nc1ccc(Br)cc1F ZINC000499912503 567284087 /nfs/dbraw/zinc/28/40/87/567284087.db2.gz JAVLYYBYLMPWAA-UHFFFAOYSA-N 2 1 386.309 3.335 20 0 GGADMP CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000567894640 567288808 /nfs/dbraw/zinc/28/88/08/567288808.db2.gz KZBCDVHWIBPOPW-HOTGVXAUSA-N 2 1 384.351 3.273 20 0 GGADMP CC(C)(O)C[NH+]1CCC([NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)CC1 ZINC000639163388 567292822 /nfs/dbraw/zinc/29/28/22/567292822.db2.gz XPJOYMGOGFGKEQ-KRWDZBQOSA-N 2 1 375.340 3.242 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCC(=O)Nc2cc(Cl)ccc2Cl)CC12CCOCC2 ZINC000568513197 567334229 /nfs/dbraw/zinc/33/42/29/567334229.db2.gz KHHIILHWDAJEEX-ZDUSSCGKSA-N 2 1 386.323 3.009 20 0 GGADMP Clc1ccc(-n2cc(C[N@H+]3CCC[C@H]([C@H]4CC[NH2+]C4)C3)nn2)cc1Cl ZINC000568628681 567345432 /nfs/dbraw/zinc/34/54/32/567345432.db2.gz VFKLXGDSIFVCPG-KBPBESRZSA-N 2 1 380.323 3.396 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000435377115 567358319 /nfs/dbraw/zinc/35/83/19/567358319.db2.gz YCUGYEPKDHMACX-WFASDCNBSA-N 2 1 377.330 3.421 20 0 GGADMP [NH3+]CCCOC1CC[NH+](Cc2nc(-c3ccc(Br)cc3)c[nH]2)CC1 ZINC000435392802 567359315 /nfs/dbraw/zinc/35/93/15/567359315.db2.gz XVDFBFZGZGPVLR-UHFFFAOYSA-N 2 1 393.329 3.169 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3nc(-c4ccc(Br)cc4)c[nH]3)C[C@@H]21 ZINC000435381095 567359982 /nfs/dbraw/zinc/35/99/82/567359982.db2.gz VHRRMQJPKKULEB-CWRNSKLLSA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3nc(-c4ccc(Br)cc4)c[nH]3)C[C@@H]21 ZINC000435381095 567359987 /nfs/dbraw/zinc/35/99/87/567359987.db2.gz VHRRMQJPKKULEB-CWRNSKLLSA-N 2 1 375.314 3.398 20 0 GGADMP Cc1cc([C@H]2CCC[N@H+]2CCC(=O)N2CC[NH+](C)CC2)ccc1Br ZINC000549164879 567377430 /nfs/dbraw/zinc/37/74/30/567377430.db2.gz FXBGVDFUMUDYJG-GOSISDBHSA-N 2 1 394.357 3.059 20 0 GGADMP Cc1cc([C@H]2CCC[N@@H+]2CCC(=O)N2CC[NH+](C)CC2)ccc1Br ZINC000549164879 567377433 /nfs/dbraw/zinc/37/74/33/567377433.db2.gz FXBGVDFUMUDYJG-GOSISDBHSA-N 2 1 394.357 3.059 20 0 GGADMP CC[N@@H+](CCC(=O)Nc1ccc(Br)cc1F)[C@H]1CCC[NH2+]CC1 ZINC000435623420 567379826 /nfs/dbraw/zinc/37/98/26/567379826.db2.gz CNYVAYWBSNDAFF-AWEZNQCLSA-N 2 1 386.309 3.381 20 0 GGADMP C[C@@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1cc(F)c(Br)cc1F ZINC000527898308 567383350 /nfs/dbraw/zinc/38/33/50/567383350.db2.gz XIYAWTMRBKULDM-GFCCVEGCSA-N 2 1 390.316 3.404 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@H](CO)c2cccc(Cl)c2Cl)CC1 ZINC000661643998 567385270 /nfs/dbraw/zinc/38/52/70/567385270.db2.gz RBNFQWCCKSZFLZ-GOSISDBHSA-N 2 1 388.383 3.375 20 0 GGADMP Brc1csc(-c2noc(C[N@H+]3CCC[C@@H]([C@H]4CC[NH2+]C4)C3)n2)c1 ZINC000569245479 567389825 /nfs/dbraw/zinc/38/98/25/567389825.db2.gz KLVGTOFYTLMEKW-NWDGAFQWSA-N 2 1 397.342 3.382 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]Cc1c(F)ccc(Br)c1F ZINC000501492727 567393031 /nfs/dbraw/zinc/39/30/31/567393031.db2.gz WJSHXQMNBTUQEP-GFCCVEGCSA-N 2 1 377.273 3.054 20 0 GGADMP C[C@H]1C[N@H+](CCC[NH2+][C@@H]2CCc3cccc(Br)c3C2)CCCO1 ZINC000549816778 567411579 /nfs/dbraw/zinc/41/15/79/567411579.db2.gz ZMMKMHDJGDRQKU-DOTOQJQBSA-N 2 1 381.358 3.397 20 0 GGADMP C[C@H]1C[N@@H+](CCC[NH2+][C@@H]2CCc3cccc(Br)c3C2)CCCO1 ZINC000549816778 567411584 /nfs/dbraw/zinc/41/15/84/567411584.db2.gz ZMMKMHDJGDRQKU-DOTOQJQBSA-N 2 1 381.358 3.397 20 0 GGADMP [NH3+]CCC(=O)NC[C@H]1CCCC[N@@H+]1Cc1oc2ccccc2c1Br ZINC000662270713 567423792 /nfs/dbraw/zinc/42/37/92/567423792.db2.gz CIWKLVFETSXLNX-CYBMUJFWSA-N 2 1 394.313 3.015 20 0 GGADMP [NH3+]CCC(=O)NC[C@H]1CCCC[N@H+]1Cc1oc2ccccc2c1Br ZINC000662270713 567423797 /nfs/dbraw/zinc/42/37/97/567423797.db2.gz CIWKLVFETSXLNX-CYBMUJFWSA-N 2 1 394.313 3.015 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](Cc2oc3ccccc3c2Br)CC12CCOCC2 ZINC000662273821 567424421 /nfs/dbraw/zinc/42/44/21/567424421.db2.gz PVRMZHSSZVHFIK-CYBMUJFWSA-N 2 1 379.298 3.383 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](Cc2oc3ccccc3c2Br)CC12CCOCC2 ZINC000662273821 567424428 /nfs/dbraw/zinc/42/44/28/567424428.db2.gz PVRMZHSSZVHFIK-CYBMUJFWSA-N 2 1 379.298 3.383 20 0 GGADMP C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Br)cc2F)[C@@H]1CCC[NH3+] ZINC000662313072 567425980 /nfs/dbraw/zinc/42/59/80/567425980.db2.gz HZEHMLMFHPVESE-MLGOLLRUSA-N 2 1 386.309 3.366 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+])c1ccc(Br)cc1 ZINC000662315852 567427758 /nfs/dbraw/zinc/42/77/58/567427758.db2.gz UECLXFVXTWGBPT-RVKKMQEKSA-N 2 1 396.373 3.466 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662386262 567431055 /nfs/dbraw/zinc/43/10/55/567431055.db2.gz AGIIPWUVBBDTCC-RKVPGOIHSA-N 2 1 396.373 3.323 20 0 GGADMP C[C@@H]1CCC[N@H+](CCCCNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662387138 567431654 /nfs/dbraw/zinc/43/16/54/567431654.db2.gz BUVXMDXIZHNGQO-PBHICJAKSA-N 2 1 382.346 3.077 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662387138 567431659 /nfs/dbraw/zinc/43/16/59/567431659.db2.gz BUVXMDXIZHNGQO-PBHICJAKSA-N 2 1 382.346 3.077 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)[C@H]([NH3+])c2ccccc2Br)CC1 ZINC000662388971 567433020 /nfs/dbraw/zinc/43/30/20/567433020.db2.gz REHAPMVJONBUEA-QGZVFWFLSA-N 2 1 382.346 3.077 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)[C@H]([NH3+])c2ccccc2Br)cc1 ZINC000662398847 567433824 /nfs/dbraw/zinc/43/38/24/567433824.db2.gz JQIBKEITNUMSJU-QGZVFWFLSA-N 2 1 392.297 3.028 20 0 GGADMP CC(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@H]([NH3+])c2ccccc2Br)cc1 ZINC000662410144 567435012 /nfs/dbraw/zinc/43/50/12/567435012.db2.gz HLVRNSRSUTUBKY-ZWKOTPCHSA-N 2 1 390.325 3.389 20 0 GGADMP CC(C)c1ccc([C@H]([NH3+])CNC(=O)[C@H]([NH3+])c2ccccc2Br)cc1 ZINC000662410142 567435189 /nfs/dbraw/zinc/43/51/89/567435189.db2.gz HLVRNSRSUTUBKY-QZTJIDSGSA-N 2 1 390.325 3.389 20 0 GGADMP Cc1ccc([C@H](CNC(=O)[C@H]([NH3+])c2ccccc2Br)[NH+](C)C)cc1 ZINC000662417917 567435374 /nfs/dbraw/zinc/43/53/74/567435374.db2.gz OJDAECKKYQLPRA-ZWKOTPCHSA-N 2 1 390.325 3.176 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)c2cc3c(s2)CC[NH2+]C3)[C@@H]1c1cccs1 ZINC000662474175 567439839 /nfs/dbraw/zinc/43/98/39/567439839.db2.gz UBOUFBWPEBGTDC-FZKQIMNGSA-N 2 1 375.563 3.268 20 0 GGADMP C[NH2+][C@@H](C(=O)Nc1nc2c(s1)C[C@@H]([NH3+])CC2)c1cccc(Cl)c1Cl ZINC000662519359 567444524 /nfs/dbraw/zinc/44/45/24/567444524.db2.gz TVTAHSYRKVFPKM-RMLUDKJBSA-N 2 1 385.320 3.165 20 0 GGADMP C[N@H+](CCCNC(=O)[C@H]([NH3+])c1ccccc1Br)C1CCCCC1 ZINC000662525856 567444932 /nfs/dbraw/zinc/44/49/32/567444932.db2.gz LBMXWJJLIJJCOW-QGZVFWFLSA-N 2 1 382.346 3.220 20 0 GGADMP C[N@@H+](CCCNC(=O)[C@H]([NH3+])c1ccccc1Br)C1CCCCC1 ZINC000662525856 567444940 /nfs/dbraw/zinc/44/49/40/567444940.db2.gz LBMXWJJLIJJCOW-QGZVFWFLSA-N 2 1 382.346 3.220 20 0 GGADMP C[NH2+][C@H](C(=O)N1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)c1cccc(Cl)c1Cl ZINC000662522277 567445224 /nfs/dbraw/zinc/44/52/24/567445224.db2.gz KKOWIXMCJPXTTA-IYOUNJFTSA-N 2 1 384.351 3.492 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@@H+](C)CC(=O)Nc1ccccc1Br ZINC000502705354 567448929 /nfs/dbraw/zinc/44/89/29/567448929.db2.gz GLWCNHOSFKBSPJ-UHFFFAOYSA-N 2 1 379.302 3.305 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+](C)CC(=O)Nc1ccccc1Br ZINC000502705354 567448934 /nfs/dbraw/zinc/44/89/34/567448934.db2.gz GLWCNHOSFKBSPJ-UHFFFAOYSA-N 2 1 379.302 3.305 20 0 GGADMP [NH3+][C@H](C(=O)Nc1nc(C2CC[NH2+]CC2)cs1)c1ccccc1Br ZINC000662571651 567449641 /nfs/dbraw/zinc/44/96/41/567449641.db2.gz QLGGGECSJKMLIE-AWEZNQCLSA-N 2 1 395.326 3.011 20 0 GGADMP C[NH2+][C@@H](C(=O)N1CCC([C@@H]2CCC[NH2+]C2)CC1)c1cccc(Cl)c1Cl ZINC000662586596 567451301 /nfs/dbraw/zinc/45/13/01/567451301.db2.gz LYYMKRAWXDPMEG-RDTXWAMCSA-N 2 1 384.351 3.492 20 0 GGADMP C[NH2+][C@H](C(=O)N1CCC([C@H]2CCC[NH2+]C2)CC1)c1cccc(Cl)c1Cl ZINC000662586594 567451423 /nfs/dbraw/zinc/45/14/23/567451423.db2.gz LYYMKRAWXDPMEG-KSSFIOAISA-N 2 1 384.351 3.492 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@H](O)COc1ccc(Br)cc1 ZINC000570037144 567454130 /nfs/dbraw/zinc/45/41/30/567454130.db2.gz OPRACTDWSJYHTB-AEFFLSMTSA-N 2 1 399.373 3.433 20 0 GGADMP C[NH+](C)CCOc1cccc(NC(=O)[C@H]([NH3+])c2ccccc2Br)c1 ZINC000662673801 567456180 /nfs/dbraw/zinc/45/61/80/567456180.db2.gz RJAYLJFQBFEQNS-QGZVFWFLSA-N 2 1 392.297 3.028 20 0 GGADMP C[C@H]1CCSCC[N@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000502842374 567457714 /nfs/dbraw/zinc/45/77/14/567457714.db2.gz MWLGUPHDNIPEFD-INIZCTEOSA-N 2 1 379.595 3.001 20 0 GGADMP CC1(C)CC[NH2+][C@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000662728255 567459577 /nfs/dbraw/zinc/45/95/77/567459577.db2.gz KYRGFFNMJSGUOY-KRWDZBQOSA-N 2 1 384.351 3.462 20 0 GGADMP CC1(C)CC[NH2+][C@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000662797254 567462241 /nfs/dbraw/zinc/46/22/41/567462241.db2.gz XIPGYXTUFAZWJC-KRWDZBQOSA-N 2 1 384.351 3.462 20 0 GGADMP C[N@H+]1CCC[C@H]1CCN1CCN(Cc2ccc(Br)c(F)c2)CC1 ZINC000503055798 567466908 /nfs/dbraw/zinc/46/69/08/567466908.db2.gz YHVPMRXVKYHACI-INIZCTEOSA-N 2 1 384.337 3.190 20 0 GGADMP C[NH2+][C@@H](C(=O)NC[C@H]1CCC[N@H+](CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000663002145 567473152 /nfs/dbraw/zinc/47/31/52/567473152.db2.gz CCNQFOCWZJYOPL-RDTXWAMCSA-N 2 1 384.351 3.492 20 0 GGADMP C[NH2+][C@@H](C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000663002145 567473156 /nfs/dbraw/zinc/47/31/56/567473156.db2.gz CCNQFOCWZJYOPL-RDTXWAMCSA-N 2 1 384.351 3.492 20 0 GGADMP CC(=O)NCC[N@H+](CCCn1cc[nH+]c1C)Cc1ccc(Br)s1 ZINC000503207342 567473656 /nfs/dbraw/zinc/47/36/56/567473656.db2.gz IKHGEKBBZUICET-UHFFFAOYSA-N 2 1 399.358 3.044 20 0 GGADMP CC(=O)NCC[N@@H+](CCCn1cc[nH+]c1C)Cc1ccc(Br)s1 ZINC000503207342 567473660 /nfs/dbraw/zinc/47/36/60/567473660.db2.gz IKHGEKBBZUICET-UHFFFAOYSA-N 2 1 399.358 3.044 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+][C@@H]2CCCc3cc(Br)ccc32)C1 ZINC000479061469 567499075 /nfs/dbraw/zinc/49/90/75/567499075.db2.gz NTLUCUHDBMJBTB-CRAIPNDOSA-N 2 1 394.357 3.004 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@H]2CCCc3cc(Br)ccc32)CC1 ZINC000479062322 567499746 /nfs/dbraw/zinc/49/97/46/567499746.db2.gz OUNHYFLXGXDMCW-IBGZPJMESA-N 2 1 380.374 3.444 20 0 GGADMP Brc1cc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc2c1OCCO2 ZINC000663347519 567499869 /nfs/dbraw/zinc/49/98/69/567499869.db2.gz NBOPWNBUMWMPMM-OAHLLOKOSA-N 2 1 395.341 3.432 20 0 GGADMP Brc1cc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc2c1OCCO2 ZINC000663347519 567499874 /nfs/dbraw/zinc/49/98/74/567499874.db2.gz NBOPWNBUMWMPMM-OAHLLOKOSA-N 2 1 395.341 3.432 20 0 GGADMP Brc1ccc2ncc(C[NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)n2c1 ZINC000663345263 567499962 /nfs/dbraw/zinc/49/99/62/567499962.db2.gz HSDTXQFFNYASLA-OAHLLOKOSA-N 2 1 377.330 3.308 20 0 GGADMP Brc1ccc2ncc(C[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)n2c1 ZINC000663345263 567499964 /nfs/dbraw/zinc/49/99/64/567499964.db2.gz HSDTXQFFNYASLA-OAHLLOKOSA-N 2 1 377.330 3.308 20 0 GGADMP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)Cc2ncc(Cl)cc2Br)CC1 ZINC000529532262 567527013 /nfs/dbraw/zinc/52/70/13/567527013.db2.gz XPSDNTUDIGQINC-GFCCVEGCSA-N 2 1 390.753 3.022 20 0 GGADMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ncc(Cl)cc2Br)CC1 ZINC000529532262 567527019 /nfs/dbraw/zinc/52/70/19/567527019.db2.gz XPSDNTUDIGQINC-GFCCVEGCSA-N 2 1 390.753 3.022 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CC2 ZINC000595010176 567534926 /nfs/dbraw/zinc/53/49/26/567534926.db2.gz IDUXPOJTJSYDJC-YQQAZPJKSA-N 2 1 382.289 3.495 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CC2 ZINC000595010174 567534950 /nfs/dbraw/zinc/53/49/50/567534950.db2.gz IDUXPOJTJSYDJC-BFYDXBDKSA-N 2 1 382.289 3.495 20 0 GGADMP Brc1ccc(-c2noc(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)n2)s1 ZINC000571209398 567546915 /nfs/dbraw/zinc/54/69/15/567546915.db2.gz WKCFXYKWBCJBHD-GFCCVEGCSA-N 2 1 397.342 3.382 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000644532068 567556818 /nfs/dbraw/zinc/55/68/18/567556818.db2.gz YTJVTNUMHHBKMZ-CABCVRRESA-N 2 1 375.340 3.443 20 0 GGADMP C[N@@H+](Cc1ccccc1)C[C@@H](O)C[NH2+]CCc1ccc(Br)cc1 ZINC000644570143 567559710 /nfs/dbraw/zinc/55/97/10/567559710.db2.gz JENKADFMKKYNLA-IBGZPJMESA-N 2 1 377.326 3.074 20 0 GGADMP C[N@H+](Cc1ccccc1)C[C@@H](O)C[NH2+]CCc1ccc(Br)cc1 ZINC000644570143 567559713 /nfs/dbraw/zinc/55/97/13/567559713.db2.gz JENKADFMKKYNLA-IBGZPJMESA-N 2 1 377.326 3.074 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](C[NH2+]C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000644588779 567560829 /nfs/dbraw/zinc/56/08/29/567560829.db2.gz UBQNWKYCSQRVAV-LSDHHAIUSA-N 2 1 375.340 3.301 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000530513147 567608747 /nfs/dbraw/zinc/60/87/47/567608747.db2.gz KKJMSVZSPXGMGG-GOSISDBHSA-N 2 1 378.314 3.483 20 0 GGADMP CC[N@@H+](CCNC(=O)[C@@H](c1ccc(Cl)cc1)N(C)C)CCC(F)(F)F ZINC000572058302 567609978 /nfs/dbraw/zinc/60/99/78/567609978.db2.gz UFGCZOFCPDCZHT-OAHLLOKOSA-N 2 1 379.854 3.333 20 0 GGADMP CCN(CCNC(=O)[C@@H](c1ccc(Cl)cc1)N(C)C)CCC(F)(F)F ZINC000572058302 567609980 /nfs/dbraw/zinc/60/99/80/567609980.db2.gz UFGCZOFCPDCZHT-OAHLLOKOSA-N 2 1 379.854 3.333 20 0 GGADMP C[C@H]1CCc2ccc(Br)cc2[C@@H]([NH2+]Cc2nc(C[NH3+])cc(=O)[nH]2)C1 ZINC000665292483 567617261 /nfs/dbraw/zinc/61/72/61/567617261.db2.gz AVFGBXMSQWRGHD-ZBEGNZNMSA-N 2 1 391.313 3.207 20 0 GGADMP Oc1cccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1Br ZINC000459379753 567620442 /nfs/dbraw/zinc/62/04/42/567620442.db2.gz RSSVKISPUWXJJO-UHFFFAOYSA-N 2 1 383.330 3.232 20 0 GGADMP CCO[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3csc(CC)n3)CC2)[C@H]1SC ZINC000459403968 567622818 /nfs/dbraw/zinc/62/28/18/567622818.db2.gz BYPGWXKMLCNNBK-ZHALLVOQSA-N 2 1 383.627 3.416 20 0 GGADMP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](CC(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000572384424 567635502 /nfs/dbraw/zinc/63/55/02/567635502.db2.gz XIXSCVQRSWLXGJ-SJLPKXTDSA-N 2 1 386.323 3.150 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+]C2CC[NH+](C3CC3)CC2)cc1Br ZINC000459569465 567638194 /nfs/dbraw/zinc/63/81/94/567638194.db2.gz KRTPBJKYOHSVRL-INIZCTEOSA-N 2 1 381.358 3.125 20 0 GGADMP Cc1cc(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)sc1Br ZINC000572648334 567654703 /nfs/dbraw/zinc/65/47/03/567654703.db2.gz YFENHJJUKSHSFT-UHFFFAOYSA-N 2 1 386.403 3.278 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459777233 567657643 /nfs/dbraw/zinc/65/76/43/567657643.db2.gz KIVPULNNHNFDLD-CABCVRRESA-N 2 1 382.346 3.488 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1OC ZINC000572763215 567663231 /nfs/dbraw/zinc/66/32/31/567663231.db2.gz TXEHPXYAUJTQPP-KBPBESRZSA-N 2 1 383.330 3.288 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1OC ZINC000572763216 567663533 /nfs/dbraw/zinc/66/35/33/567663533.db2.gz TXEHPXYAUJTQPP-KGLIPLIRSA-N 2 1 383.330 3.288 20 0 GGADMP Cc1cc(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)c(Br)s1 ZINC000531601649 567668526 /nfs/dbraw/zinc/66/85/26/567668526.db2.gz ITJALNPBLRRWFQ-UHFFFAOYSA-N 2 1 395.326 3.218 20 0 GGADMP Cc1ccc(Br)c(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)c1 ZINC000531653321 567671698 /nfs/dbraw/zinc/67/16/98/567671698.db2.gz WPWXIZCPDQICOT-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP C[NH+]1CCN(c2cc[nH+]cc2NC(=O)Cc2cc(Cl)ccc2Cl)CC1 ZINC000623052868 567681560 /nfs/dbraw/zinc/68/15/60/567681560.db2.gz QFOIGILSHQKDOT-UHFFFAOYSA-N 2 1 379.291 3.321 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000531937208 567690198 /nfs/dbraw/zinc/69/01/98/567690198.db2.gz MFEUFGBWQFWYPI-XOKHGSTOSA-N 2 1 380.330 3.383 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(SC)s3)CC2)CC1 ZINC000573294873 567702475 /nfs/dbraw/zinc/70/24/75/567702475.db2.gz UVPVXNBOLSGFIK-UHFFFAOYSA-N 2 1 381.611 3.236 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+]Cc2ccc(Br)c(F)c2F)CC1 ZINC000623356908 567703426 /nfs/dbraw/zinc/70/34/26/567703426.db2.gz OFUHLDHKEDYGFG-UHFFFAOYSA-N 2 1 390.316 3.235 20 0 GGADMP Cc1cc(Br)ccc1C(=O)N1CCC([NH2+]C[C@@H]2CCCC[NH2+]2)CC1 ZINC000666770401 567703541 /nfs/dbraw/zinc/70/35/41/567703541.db2.gz YSTUZVPZLTXQEU-KRWDZBQOSA-N 2 1 394.357 3.094 20 0 GGADMP COc1c(Br)cc(Br)cc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666855172 567708004 /nfs/dbraw/zinc/70/80/04/567708004.db2.gz BVNSOZQNXGCLHT-GFCCVEGCSA-N 2 1 392.135 3.452 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1cc(Br)ccc1C ZINC000460906683 567709813 /nfs/dbraw/zinc/70/98/13/567709813.db2.gz DDOMTPUFXZLKKP-QGZVFWFLSA-N 2 1 396.373 3.246 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@H]2CCCOc3cc(Br)ccc32)CC1(C)C ZINC000442877051 567714180 /nfs/dbraw/zinc/71/41/80/567714180.db2.gz QQZTVMBGHJOVMM-KRWDZBQOSA-N 2 1 396.373 3.278 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@H]2CCCOc3c(Br)cccc32)CC1(C)C ZINC000442869695 567714278 /nfs/dbraw/zinc/71/42/78/567714278.db2.gz FBCYOFGCUPXBCU-KRWDZBQOSA-N 2 1 396.373 3.278 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]C2CC(c3ccc(Br)cc3)C2)CC1(C)C ZINC000442870598 567714654 /nfs/dbraw/zinc/71/46/54/567714654.db2.gz GFSDBFRMUQYTEY-UHFFFAOYSA-N 2 1 380.374 3.311 20 0 GGADMP Brc1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c(N2CCOCC2)c1 ZINC000666993789 567716959 /nfs/dbraw/zinc/71/69/59/567716959.db2.gz JYNPHBYVMNZQMZ-QGZVFWFLSA-N 2 1 394.357 3.050 20 0 GGADMP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000623656009 567729254 /nfs/dbraw/zinc/72/92/54/567729254.db2.gz KZCYLPGEFQAQHW-HNNXBMFYSA-N 2 1 377.330 3.456 20 0 GGADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000623656009 567729262 /nfs/dbraw/zinc/72/92/62/567729262.db2.gz KZCYLPGEFQAQHW-HNNXBMFYSA-N 2 1 377.330 3.456 20 0 GGADMP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000623657393 567729582 /nfs/dbraw/zinc/72/95/82/567729582.db2.gz PSWHAMZKVNMEGG-MRXNPFEDSA-N 2 1 396.373 3.107 20 0 GGADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000623657393 567729585 /nfs/dbraw/zinc/72/95/85/567729585.db2.gz PSWHAMZKVNMEGG-MRXNPFEDSA-N 2 1 396.373 3.107 20 0 GGADMP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000623656010 567729782 /nfs/dbraw/zinc/72/97/82/567729782.db2.gz KZCYLPGEFQAQHW-OAHLLOKOSA-N 2 1 377.330 3.456 20 0 GGADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000623656010 567729784 /nfs/dbraw/zinc/72/97/84/567729784.db2.gz KZCYLPGEFQAQHW-OAHLLOKOSA-N 2 1 377.330 3.456 20 0 GGADMP C[C@H]([NH3+])C[C@H](C)NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000573719067 567731378 /nfs/dbraw/zinc/73/13/78/567731378.db2.gz QRTKLXDAZMBDMR-STQMWFEESA-N 2 1 387.355 3.383 20 0 GGADMP Brc1ccc2oc(C[NH+]3CCN(CC[NH+]4CCCC4)CC3)cc2c1 ZINC000667483538 567748895 /nfs/dbraw/zinc/74/88/95/567748895.db2.gz JUMFRFLUNPMGMN-UHFFFAOYSA-N 2 1 392.341 3.409 20 0 GGADMP C[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1cncc(Br)c1 ZINC000574055589 567753342 /nfs/dbraw/zinc/75/33/42/567753342.db2.gz ZCNSWRQJYYLGOZ-AWEZNQCLSA-N 2 1 393.329 3.420 20 0 GGADMP C[N@@H+](Cc1cc(Br)c2c(c1)OCCCO2)C[C@H]1CCC[NH+](C)C1 ZINC000508554350 567753750 /nfs/dbraw/zinc/75/37/50/567753750.db2.gz ULUKFDGHBVNVBI-AWEZNQCLSA-N 2 1 383.330 3.384 20 0 GGADMP C[N@H+](Cc1cc(Br)c2c(c1)OCCCO2)C[C@H]1CCC[NH+](C)C1 ZINC000508554350 567753756 /nfs/dbraw/zinc/75/37/56/567753756.db2.gz ULUKFDGHBVNVBI-AWEZNQCLSA-N 2 1 383.330 3.384 20 0 GGADMP C[NH+](Cc1cc(Br)c2c(c1)OCCCO2)C[C@H]1CCC[N@H+](C)C1 ZINC000508554350 567753761 /nfs/dbraw/zinc/75/37/61/567753761.db2.gz ULUKFDGHBVNVBI-AWEZNQCLSA-N 2 1 383.330 3.384 20 0 GGADMP C[NH+](Cc1cc(Br)c2c(c1)OCCCO2)C[C@H]1CCC[N@@H+](C)C1 ZINC000508554350 567753764 /nfs/dbraw/zinc/75/37/64/567753764.db2.gz ULUKFDGHBVNVBI-AWEZNQCLSA-N 2 1 383.330 3.384 20 0 GGADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc(Br)c4c(c3)OCCO4)C2)CC1 ZINC000554878647 567754480 /nfs/dbraw/zinc/75/44/80/567754480.db2.gz CNIHMHFUGLPRNU-INIZCTEOSA-N 2 1 395.341 3.384 20 0 GGADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc(Br)c4c(c3)OCCO4)C2)CC1 ZINC000554878649 567754489 /nfs/dbraw/zinc/75/44/89/567754489.db2.gz CNIHMHFUGLPRNU-MRXNPFEDSA-N 2 1 395.341 3.384 20 0 GGADMP Cc1c(Br)cncc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000667675735 567763904 /nfs/dbraw/zinc/76/39/04/567763904.db2.gz UTECLDFBBZKHCR-UHFFFAOYSA-N 2 1 382.346 3.229 20 0 GGADMP C[NH2+]CCC[N@H+](C)Cc1cc(Br)c(OC)c(Br)c1 ZINC000574293711 567769686 /nfs/dbraw/zinc/76/96/86/567769686.db2.gz ITJIPUSXFKLMJN-UHFFFAOYSA-N 2 1 380.124 3.262 20 0 GGADMP C[NH2+]CCC[N@@H+](C)Cc1cc(Br)c(OC)c(Br)c1 ZINC000574293711 567769693 /nfs/dbraw/zinc/76/96/93/567769693.db2.gz ITJIPUSXFKLMJN-UHFFFAOYSA-N 2 1 380.124 3.262 20 0 GGADMP COc1c(Br)cc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1Br ZINC000574501307 567782447 /nfs/dbraw/zinc/78/24/47/567782447.db2.gz PMZNIHGXXWIOCZ-MWLCHTKSSA-N 2 1 392.135 3.450 20 0 GGADMP Cc1c(Br)cncc1C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000667983414 567786709 /nfs/dbraw/zinc/78/67/09/567786709.db2.gz LVXYCZWWLUIUSR-UHFFFAOYSA-N 2 1 395.389 3.002 20 0 GGADMP Brc1cc(C[N@H+](C2CC2)C2CC[NH2+]CC2)cc2c1OCCCO2 ZINC000647483060 567788156 /nfs/dbraw/zinc/78/81/56/567788156.db2.gz WBYDWVQZGMMKMC-UHFFFAOYSA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[N@@H+](C2CC2)C2CC[NH2+]CC2)cc2c1OCCCO2 ZINC000647483060 567788163 /nfs/dbraw/zinc/78/81/63/567788163.db2.gz WBYDWVQZGMMKMC-UHFFFAOYSA-N 2 1 381.314 3.327 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c(OC)c1 ZINC000647545705 567790800 /nfs/dbraw/zinc/79/08/00/567790800.db2.gz HYJVUNGENHWELE-KBPBESRZSA-N 2 1 383.330 3.288 20 0 GGADMP CN(Cc1cc(Br)c2c(c1)OCCO2)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000574678225 567791359 /nfs/dbraw/zinc/79/13/59/567791359.db2.gz PLFRGCZNKICOGA-YIONKMFJSA-N 2 1 381.314 3.277 20 0 GGADMP C[N@H+](Cc1cc(Br)c2c(c1)OCCO2)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000574678225 567791364 /nfs/dbraw/zinc/79/13/64/567791364.db2.gz PLFRGCZNKICOGA-YIONKMFJSA-N 2 1 381.314 3.277 20 0 GGADMP C[N@@H+](Cc1cc(Br)c2c(c1)OCCO2)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000574678225 567791370 /nfs/dbraw/zinc/79/13/70/567791370.db2.gz PLFRGCZNKICOGA-YIONKMFJSA-N 2 1 381.314 3.277 20 0 GGADMP C[NH+](Cc1cc(Br)c2c(c1)OCCO2)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000574678225 567791374 /nfs/dbraw/zinc/79/13/74/567791374.db2.gz PLFRGCZNKICOGA-YIONKMFJSA-N 2 1 381.314 3.277 20 0 GGADMP C[NH+](Cc1cc(Br)c2c(c1)OCCO2)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000574678225 567791376 /nfs/dbraw/zinc/79/13/76/567791376.db2.gz PLFRGCZNKICOGA-YIONKMFJSA-N 2 1 381.314 3.277 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647975754 567808692 /nfs/dbraw/zinc/80/86/92/567808692.db2.gz FOPWBBSQPRAVPY-HOTGVXAUSA-N 2 1 394.357 3.408 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccccc1Br ZINC000647976954 567808861 /nfs/dbraw/zinc/80/88/61/567808861.db2.gz WHJXSZFLNQTCSF-CVEARBPZSA-N 2 1 394.357 3.489 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)Nc1cccc(Br)c1 ZINC000647977906 567809154 /nfs/dbraw/zinc/80/91/54/567809154.db2.gz JQJHGJIBDWUNGU-HZPDHXFCSA-N 2 1 394.357 3.489 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000647977051 567809225 /nfs/dbraw/zinc/80/92/25/567809225.db2.gz XKZQEXUXKJUDGC-CVEARBPZSA-N 2 1 394.357 3.489 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1)c1ccc(Cl)cc1Cl ZINC000647987296 567809904 /nfs/dbraw/zinc/80/99/04/567809904.db2.gz GUOOLGAEIUZNMK-RRFJBIMHSA-N 2 1 384.351 3.492 20 0 GGADMP Cc1cc(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)ccc1Br ZINC000534497045 567813449 /nfs/dbraw/zinc/81/34/49/567813449.db2.gz RYZRSFMBPCTWEO-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCc3ccc(C[NH+](C)C)cc3)cc2)C[C@H](C)O1 ZINC000028895140 570465623 /nfs/dbraw/zinc/46/56/23/570465623.db2.gz QCEXTRQODAUFLD-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCc3ccc(C[NH+](C)C)cc3)cc2)C[C@H](C)O1 ZINC000028895140 570465628 /nfs/dbraw/zinc/46/56/28/570465628.db2.gz QCEXTRQODAUFLD-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCc3ccccc3-c3nn[nH]n3)c2)CC[N@H+]1C ZINC000820667613 599449173 /nfs/dbraw/zinc/44/91/73/599449173.db2.gz NCBPAPHCWUQFHU-LPHOPBHVSA-N 2 1 392.507 3.018 20 0 GGADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@@H](C(=O)[O-])c1ccccc1F ZINC000830923651 601156611 /nfs/dbraw/zinc/15/66/11/601156611.db2.gz OQFBQLBHZWPNJF-OAQYLSRUSA-N 2 1 391.531 3.080 20 0 GGADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@@H](C(=O)[O-])c1ccccc1F ZINC000830923651 601156612 /nfs/dbraw/zinc/15/66/12/601156612.db2.gz OQFBQLBHZWPNJF-OAQYLSRUSA-N 2 1 391.531 3.080 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(-c4nn[nH]n4)s3)cc2)C1 ZINC000820710080 606409005 /nfs/dbraw/zinc/40/90/05/606409005.db2.gz NTSUPKMBPKWMRA-HNNXBMFYSA-N 2 1 382.537 3.450 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccc(-c2nn[nH]n2)c1 ZINC000820409889 607083893 /nfs/dbraw/zinc/08/38/93/607083893.db2.gz BLRQNXULUPUYBE-WWMYMODYSA-N 2 1 376.508 3.428 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1cccc(-c2nn[nH]n2)c1 ZINC000820409889 607083894 /nfs/dbraw/zinc/08/38/94/607083894.db2.gz BLRQNXULUPUYBE-WWMYMODYSA-N 2 1 376.508 3.428 20 0 GGADMP CCC1(C[NH2+]Cc2ccc(-c3nn[nH]n3)o2)CC[NH+](Cc2ccccc2)CC1 ZINC000825171567 607820017 /nfs/dbraw/zinc/82/00/17/607820017.db2.gz RTOTZEQMHGLZQN-UHFFFAOYSA-N 2 1 380.496 3.242 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(-c2nn[nH]n2)cc1F ZINC000824617871 609325036 /nfs/dbraw/zinc/32/50/36/609325036.db2.gz KKPCPZUVWVXBDG-OAHLLOKOSA-N 2 1 380.471 3.452 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000053749203 1406503465 /nfs/dbraw/zinc/50/34/65/1406503465.db2.gz WXPDWLJCLKKFLE-UHFFFAOYSA-N 2 1 398.576 3.070 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000053749203 1406503471 /nfs/dbraw/zinc/50/34/71/1406503471.db2.gz WXPDWLJCLKKFLE-UHFFFAOYSA-N 2 1 398.576 3.070 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccco1 ZINC000054038145 1406598403 /nfs/dbraw/zinc/59/84/03/1406598403.db2.gz GAJSFNMBWIRJNK-FQEVSTJZSA-N 2 1 384.524 3.368 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCC[NH+](C)Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000054265488 1406672648 /nfs/dbraw/zinc/67/26/48/1406672648.db2.gz AMTKGDGQEZOUIL-BGYRXZFFSA-N 2 1 395.547 3.158 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCC[NH+](C)Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000054265488 1406672658 /nfs/dbraw/zinc/67/26/58/1406672658.db2.gz AMTKGDGQEZOUIL-BGYRXZFFSA-N 2 1 395.547 3.158 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCC[N@H+](C)Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000054265488 1406672670 /nfs/dbraw/zinc/67/26/70/1406672670.db2.gz AMTKGDGQEZOUIL-BGYRXZFFSA-N 2 1 395.547 3.158 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCC[N@@H+](C)Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000054265488 1406672676 /nfs/dbraw/zinc/67/26/76/1406672676.db2.gz AMTKGDGQEZOUIL-BGYRXZFFSA-N 2 1 395.547 3.158 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)NCC[N@H+](C)Cc1ccccc1 ZINC000054382359 1406709799 /nfs/dbraw/zinc/70/97/99/1406709799.db2.gz CCKQTKCYPKIUPM-UHFFFAOYSA-N 2 1 395.551 3.000 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)C1 ZINC000054511537 1406757905 /nfs/dbraw/zinc/75/79/05/1406757905.db2.gz XMWFWASRSKPACX-VQTJNVASSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000054511537 1406757912 /nfs/dbraw/zinc/75/79/12/1406757912.db2.gz XMWFWASRSKPACX-VQTJNVASSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000054511537 1406757921 /nfs/dbraw/zinc/75/79/21/1406757921.db2.gz XMWFWASRSKPACX-VQTJNVASSA-N 2 1 386.584 3.450 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)NC[C@@H](c2cccs2)[NH+](C)C)C1 ZINC000054539969 1406765817 /nfs/dbraw/zinc/76/58/17/1406765817.db2.gz AZVAPAJICICFSA-NEWSRXKRSA-N 2 1 386.565 3.486 20 0 GGADMP CCC(CC)[C@@H](CNC(=O)NCc1cccnc1-n1cc[nH+]c1C)[NH+]1CCCC1 ZINC000054606368 1406781309 /nfs/dbraw/zinc/78/13/09/1406781309.db2.gz NAIQNIJVMGEKPW-HXUWFJFHSA-N 2 1 398.555 3.276 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NCc1cccnc1-n1cc[nH+]c1C)CC(C)C ZINC000054606387 1406781733 /nfs/dbraw/zinc/78/17/33/1406781733.db2.gz NKJXOPGQYDLBDG-LJQANCHMSA-N 2 1 386.544 3.131 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000054609194 1406782851 /nfs/dbraw/zinc/78/28/51/1406782851.db2.gz KFUFJQUQTKNPMU-QZTJIDSGSA-N 2 1 398.555 3.133 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)cn1 ZINC000054625812 1406790304 /nfs/dbraw/zinc/79/03/04/1406790304.db2.gz VORDZENBUYYRQE-UHFFFAOYSA-N 2 1 389.503 3.492 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)C1 ZINC000054719513 1406812341 /nfs/dbraw/zinc/81/23/41/1406812341.db2.gz CBPHCQZLUYNCHK-UXPWSPDFSA-N 2 1 386.565 3.486 20 0 GGADMP C[NH+](C)CCN(Cc1ccc(F)cc1)C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000054761324 1406820317 /nfs/dbraw/zinc/82/03/17/1406820317.db2.gz PWINAILGIZUGLK-UHFFFAOYSA-N 2 1 386.515 3.031 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1)Cc1ccccc1 ZINC000054762621 1406820728 /nfs/dbraw/zinc/82/07/28/1406820728.db2.gz IUBSOAMQGXWZPI-IBGZPJMESA-N 2 1 386.565 3.316 20 0 GGADMP C[NH+](C)CCCNC(=S)NCc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000055003932 1406867689 /nfs/dbraw/zinc/86/76/89/1406867689.db2.gz IZWQBVZRDVNVIP-UHFFFAOYSA-N 2 1 376.614 3.367 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[NH+]2CCC(c3nc4ccccc4s3)CC2)CC1 ZINC000006978690 1398580074 /nfs/dbraw/zinc/58/00/74/1398580074.db2.gz XAMIXULQRJHCGR-UHFFFAOYSA-N 2 1 386.565 3.076 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@H+]3CC[C@H]4CCCC[C@@H]4C3)cc2)CC1 ZINC000007241783 1398638200 /nfs/dbraw/zinc/63/82/00/1398638200.db2.gz FZIPBWQDZXENID-WOJBJXKFSA-N 2 1 384.568 3.279 20 0 GGADMP COc1ccc(C[N@H+](C)[C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000026168488 1399865573 /nfs/dbraw/zinc/86/55/73/1399865573.db2.gz KJGZHIBDUCQCPU-IBGZPJMESA-N 2 1 395.547 3.296 20 0 GGADMP COc1ccc(C[N@@H+](C)[C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000026168488 1399865575 /nfs/dbraw/zinc/86/55/75/1399865575.db2.gz KJGZHIBDUCQCPU-IBGZPJMESA-N 2 1 395.547 3.296 20 0 GGADMP COc1ccc(C[N@H+](C)[C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000026168492 1399865717 /nfs/dbraw/zinc/86/57/17/1399865717.db2.gz KJGZHIBDUCQCPU-LJQANCHMSA-N 2 1 395.547 3.296 20 0 GGADMP COc1ccc(C[N@@H+](C)[C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000026168492 1399865720 /nfs/dbraw/zinc/86/57/20/1399865720.db2.gz KJGZHIBDUCQCPU-LJQANCHMSA-N 2 1 395.547 3.296 20 0 GGADMP COc1cccc(C[N@H+](C)[C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000026177127 1399866541 /nfs/dbraw/zinc/86/65/41/1399866541.db2.gz AEZMFQRONBTIDV-LJQANCHMSA-N 2 1 395.547 3.296 20 0 GGADMP COc1cccc(C[N@@H+](C)[C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000026177127 1399866542 /nfs/dbraw/zinc/86/65/42/1399866542.db2.gz AEZMFQRONBTIDV-LJQANCHMSA-N 2 1 395.547 3.296 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+](C)Cc1cccc(F)c1 ZINC000026194609 1399868417 /nfs/dbraw/zinc/86/84/17/1399868417.db2.gz PPSCIDPMIBLZTH-SFHVURJKSA-N 2 1 383.511 3.427 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)Cc1cccc(F)c1 ZINC000026194609 1399868420 /nfs/dbraw/zinc/86/84/20/1399868420.db2.gz PPSCIDPMIBLZTH-SFHVURJKSA-N 2 1 383.511 3.427 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H](c1cccs1)[NH+](C)C)[N@@H+]1CCc2sccc2C1 ZINC000028380909 1400158103 /nfs/dbraw/zinc/15/81/03/1400158103.db2.gz FCPMQENFLFANMN-GOEBONIOSA-N 2 1 392.594 3.158 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H](c1cccs1)[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000028380909 1400158110 /nfs/dbraw/zinc/15/81/10/1400158110.db2.gz FCPMQENFLFANMN-GOEBONIOSA-N 2 1 392.594 3.158 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)cc2)C[C@H](C)O1 ZINC000028838805 1400202109 /nfs/dbraw/zinc/20/21/09/1400202109.db2.gz IGDWONFQPBINDW-YYDVJCTNSA-N 2 1 395.547 3.329 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)cc2)C[C@H](C)O1 ZINC000028838805 1400202115 /nfs/dbraw/zinc/20/21/15/1400202115.db2.gz IGDWONFQPBINDW-YYDVJCTNSA-N 2 1 395.547 3.329 20 0 GGADMP CC(C)[C@@H]([NH2+]CC(=O)NCC1([NH+]2CCOCC2)CCCCC1)c1ccccc1 ZINC000029189529 1400257060 /nfs/dbraw/zinc/25/70/60/1400257060.db2.gz SRBFFCKVNDVDII-JOCHJYFZSA-N 2 1 387.568 3.125 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](C)[C@H]3CCc4ccccc43)cc2)CC1 ZINC000029807516 1400356036 /nfs/dbraw/zinc/35/60/36/1400356036.db2.gz CNNXNWNNFHMPGJ-QHCPKHFHSA-N 2 1 392.547 3.386 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)C(=O)NC(=O)NC(C)(C)C ZINC000056156196 1407232996 /nfs/dbraw/zinc/23/29/96/1407232996.db2.gz POZDMRIDZPBEAF-SJORKVTESA-N 2 1 388.556 3.163 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000043137216 1403714005 /nfs/dbraw/zinc/71/40/05/1403714005.db2.gz XUVDKMUOLSHENU-MOPGFXCFSA-N 2 1 376.545 3.370 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC1 ZINC000043137661 1403715171 /nfs/dbraw/zinc/71/51/71/1403715171.db2.gz CWWVEQWYABROPA-FQEVSTJZSA-N 2 1 384.524 3.108 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC1 ZINC000043137661 1403715178 /nfs/dbraw/zinc/71/51/78/1403715178.db2.gz CWWVEQWYABROPA-FQEVSTJZSA-N 2 1 384.524 3.108 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)C1 ZINC000043144392 1403717958 /nfs/dbraw/zinc/71/79/58/1403717958.db2.gz PBXIOXQMLUTHST-KSZLIROESA-N 2 1 380.602 3.408 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000043167314 1403723718 /nfs/dbraw/zinc/72/37/18/1403723718.db2.gz VLEGFMJZVHTVAN-MOPGFXCFSA-N 2 1 376.545 3.228 20 0 GGADMP C[NH+](C)CCN(Cc1ccccc1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000043240212 1403732541 /nfs/dbraw/zinc/73/25/41/1403732541.db2.gz DFTIANFGXHAHBB-JOCHJYFZSA-N 2 1 380.536 3.034 20 0 GGADMP C[NH+](C)CCN(Cc1ccccc1)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000043240215 1403732554 /nfs/dbraw/zinc/73/25/54/1403732554.db2.gz DFTIANFGXHAHBB-QFIPXVFZSA-N 2 1 380.536 3.034 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CNC(=S)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000043564691 1403785432 /nfs/dbraw/zinc/78/54/32/1403785432.db2.gz FQKKTEVXUXGHLL-LJQANCHMSA-N 2 1 395.016 3.253 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=S)NCCC[NH+](C)C)C1 ZINC000044186217 1403897031 /nfs/dbraw/zinc/89/70/31/1403897031.db2.gz DRNZZJGYGLVSPI-HDICACEKSA-N 2 1 376.614 3.080 20 0 GGADMP CCC(CC)[C@@H](CNC(=O)Nc1cccc(C[NH+](C)C)c1)[NH+]1CCOCC1 ZINC000044277193 1403911677 /nfs/dbraw/zinc/91/16/77/1403911677.db2.gz XAIIWAPCLOSQML-HXUWFJFHSA-N 2 1 376.545 3.007 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)[N@H+](C)CC1CCCCC1 ZINC000044715275 1403989540 /nfs/dbraw/zinc/98/95/40/1403989540.db2.gz LOYWJUJOVXZVLI-IBGZPJMESA-N 2 1 387.568 3.036 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)[N@@H+](C)CC1CCCCC1 ZINC000044715275 1403989548 /nfs/dbraw/zinc/98/95/48/1403989548.db2.gz LOYWJUJOVXZVLI-IBGZPJMESA-N 2 1 387.568 3.036 20 0 GGADMP C[N@@H+](CCCNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000045027485 1404039626 /nfs/dbraw/zinc/03/96/26/1404039626.db2.gz WLWRXOWGPWYNQJ-UHFFFAOYSA-N 2 1 394.563 3.472 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000045032682 1404040209 /nfs/dbraw/zinc/04/02/09/1404040209.db2.gz XFQSFYGHCHYGEH-UHFFFAOYSA-N 2 1 392.547 3.009 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)NC3CC[NH+](CC(C)C)CC3)CC2)cc1 ZINC000045463674 1404126865 /nfs/dbraw/zinc/12/68/65/1404126865.db2.gz WGGUYPSBGCHONU-UHFFFAOYSA-N 2 1 386.584 3.333 20 0 GGADMP C[C@H](CNC(=O)NC[C@H](c1cccs1)[NH+](C)C)[N@H+]1CCc2ccccc2C1 ZINC000045543529 1404143710 /nfs/dbraw/zinc/14/37/10/1404143710.db2.gz JCRAURDAVWSHRN-VQIMIIECSA-N 2 1 386.565 3.097 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)N[C@@H]2CC[NH+]3CCCC[C@H]23)cc1 ZINC000045778503 1404201429 /nfs/dbraw/zinc/20/14/29/1404201429.db2.gz LRJFLMBARUVKDZ-STZQEDGTSA-N 2 1 384.568 3.487 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N[C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000045778503 1404201433 /nfs/dbraw/zinc/20/14/33/1404201433.db2.gz LRJFLMBARUVKDZ-STZQEDGTSA-N 2 1 384.568 3.487 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000045778503 1404201436 /nfs/dbraw/zinc/20/14/36/1404201436.db2.gz LRJFLMBARUVKDZ-STZQEDGTSA-N 2 1 384.568 3.487 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N[C@@H]2CC[NH+]3CCCC[C@H]23)C1 ZINC000045788597 1404205654 /nfs/dbraw/zinc/20/56/54/1404205654.db2.gz SOOFBYMRXKPRSL-STZQEDGTSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N[C@@H]2CC[N@@H+]3CCCC[C@H]23)C1 ZINC000045788597 1404205662 /nfs/dbraw/zinc/20/56/62/1404205662.db2.gz SOOFBYMRXKPRSL-STZQEDGTSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)C1 ZINC000045788597 1404205670 /nfs/dbraw/zinc/20/56/70/1404205670.db2.gz SOOFBYMRXKPRSL-STZQEDGTSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)Nc2ccccc2N2CC[NH+](C)CC2)C1 ZINC000045983943 1404262054 /nfs/dbraw/zinc/26/20/54/1404262054.db2.gz MEIBZUZGELIXOL-IBGZPJMESA-N 2 1 387.572 3.072 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC000046926775 1404637455 /nfs/dbraw/zinc/63/74/55/1404637455.db2.gz HYFKFURAQWJVEJ-UHFFFAOYSA-N 2 1 380.536 3.166 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)c1 ZINC000046926297 1404637668 /nfs/dbraw/zinc/63/76/68/1404637668.db2.gz WFBDKLMPYHQKAJ-UHFFFAOYSA-N 2 1 398.526 3.305 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)c1 ZINC000046926297 1404637682 /nfs/dbraw/zinc/63/76/82/1404637682.db2.gz WFBDKLMPYHQKAJ-UHFFFAOYSA-N 2 1 398.526 3.305 20 0 GGADMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047777403 1404938622 /nfs/dbraw/zinc/93/86/22/1404938622.db2.gz IHOFJVZONURYCP-RTWAWAEBSA-N 2 1 396.535 3.380 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000047871731 1404979145 /nfs/dbraw/zinc/97/91/45/1404979145.db2.gz CFGVSPKELVLMHZ-OAQYLSRUSA-N 2 1 396.535 3.164 20 0 GGADMP C[C@H](CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000047882920 1404982960 /nfs/dbraw/zinc/98/29/60/1404982960.db2.gz AROLMOBYAYORHM-WIYYLYMNSA-N 2 1 396.535 3.163 20 0 GGADMP C[NH+]1CCC(NC(=O)NC[C@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CC1 ZINC000047886809 1404984528 /nfs/dbraw/zinc/98/45/28/1404984528.db2.gz TVOSVHZSSUSEOU-HXUWFJFHSA-N 2 1 398.576 3.241 20 0 GGADMP C[NH+]1CCC(NC(=O)NC[C@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CC1 ZINC000047886809 1404984534 /nfs/dbraw/zinc/98/45/34/1404984534.db2.gz TVOSVHZSSUSEOU-HXUWFJFHSA-N 2 1 398.576 3.241 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)NC[C@H](Cc1ccccc1)[NH+](C)C ZINC000047929659 1405001400 /nfs/dbraw/zinc/00/14/00/1405001400.db2.gz BYMHUAVFLQJJQI-QHCPKHFHSA-N 2 1 396.579 3.499 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2sccc2C1 ZINC000047966029 1405011944 /nfs/dbraw/zinc/01/19/44/1405011944.db2.gz UGAQUEDZBZJSMO-FXAWDEMLSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2sccc2C1 ZINC000047966029 1405011960 /nfs/dbraw/zinc/01/19/60/1405011960.db2.gz UGAQUEDZBZJSMO-FXAWDEMLSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2sccc2C1 ZINC000047966029 1405011972 /nfs/dbraw/zinc/01/19/72/1405011972.db2.gz UGAQUEDZBZJSMO-FXAWDEMLSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2sccc2C1 ZINC000047966029 1405011987 /nfs/dbraw/zinc/01/19/87/1405011987.db2.gz UGAQUEDZBZJSMO-FXAWDEMLSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NC3CC[NH+](C4CC4)CC3)cc2)C1 ZINC000048394996 1405177328 /nfs/dbraw/zinc/17/73/28/1405177328.db2.gz IRAFVQIHSOVHCA-SFHVURJKSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)NC2CC[NH+](C3CC3)CC2)cc1 ZINC000048394817 1405177731 /nfs/dbraw/zinc/17/77/31/1405177731.db2.gz RFTKCUQZYINACE-GOSISDBHSA-N 2 1 384.568 3.487 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000048394990 1405177764 /nfs/dbraw/zinc/17/77/64/1405177764.db2.gz GXJSNXYSCQCGEI-GOSISDBHSA-N 2 1 384.568 3.487 20 0 GGADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2ccc(-n3cncn3)c(F)c2)CC1 ZINC000048716607 1405267115 /nfs/dbraw/zinc/26/71/15/1405267115.db2.gz MOAJNAMPYOGDRT-UHFFFAOYSA-N 2 1 379.483 3.469 20 0 GGADMP CC[C@@H](CNC(=O)NCc1cccc(C[NH+](C)C)c1)[N@H+]1CCc2ccccc2C1 ZINC000049164748 1405347452 /nfs/dbraw/zinc/34/74/52/1405347452.db2.gz LGOBCNGCRVSLIM-QHCPKHFHSA-N 2 1 394.563 3.384 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)c1cccc(F)c1 ZINC000049798345 1405419822 /nfs/dbraw/zinc/41/98/22/1405419822.db2.gz LOJFKYCFLHBQEX-JOCHJYFZSA-N 2 1 398.526 3.346 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)c1cccc(F)c1 ZINC000049798344 1405420949 /nfs/dbraw/zinc/42/09/49/1405420949.db2.gz LOJFKYCFLHBQEX-QFIPXVFZSA-N 2 1 398.526 3.346 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)CC1 ZINC000050137740 1405496571 /nfs/dbraw/zinc/49/65/71/1405496571.db2.gz MXNKTZUIJKKYJQ-SFHVURJKSA-N 2 1 392.613 3.476 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000050137740 1405496585 /nfs/dbraw/zinc/49/65/85/1405496585.db2.gz MXNKTZUIJKKYJQ-SFHVURJKSA-N 2 1 392.613 3.476 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000050137740 1405496590 /nfs/dbraw/zinc/49/65/90/1405496590.db2.gz MXNKTZUIJKKYJQ-SFHVURJKSA-N 2 1 392.613 3.476 20 0 GGADMP C[NH+](C)C1(CNC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CCCC1 ZINC000050137174 1405496688 /nfs/dbraw/zinc/49/66/88/1405496688.db2.gz MRJYSCLUPIFHBW-QGZVFWFLSA-N 2 1 378.586 3.134 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000050136865 1405497721 /nfs/dbraw/zinc/49/77/21/1405497721.db2.gz HNHQGEJQSSYMQI-LJQANCHMSA-N 2 1 392.613 3.333 20 0 GGADMP O[C@@H](C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1)C[NH+]1CCCC1 ZINC000051187990 1405740099 /nfs/dbraw/zinc/74/00/99/1405740099.db2.gz CZSVQKGDIOOFIP-FQEVSTJZSA-N 2 1 396.560 3.206 20 0 GGADMP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]C[C@@H](O)C[NH+]1CCCC1 ZINC000051188007 1405740952 /nfs/dbraw/zinc/74/09/52/1405740952.db2.gz XBKKHKQBHGRTJW-JOCHJYFZSA-N 2 1 390.531 3.394 20 0 GGADMP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H](O)C[NH+]2CCCC2)cc1 ZINC000051188000 1405741041 /nfs/dbraw/zinc/74/10/41/1405741041.db2.gz KRQYGOYWFIMRFO-QHCPKHFHSA-N 2 1 390.531 3.394 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1 ZINC000176281782 1428219111 /nfs/dbraw/zinc/21/91/11/1428219111.db2.gz MDSVOFJTEUXIBL-HNNXBMFYSA-N 2 1 397.947 3.350 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1 ZINC000176281782 1428219120 /nfs/dbraw/zinc/21/91/20/1428219120.db2.gz MDSVOFJTEUXIBL-HNNXBMFYSA-N 2 1 397.947 3.350 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1 ZINC000176281782 1428219128 /nfs/dbraw/zinc/21/91/28/1428219128.db2.gz MDSVOFJTEUXIBL-HNNXBMFYSA-N 2 1 397.947 3.350 20 0 GGADMP CCN(C(=O)C[NH+]1CCC(C[NH+]2CCOCC2)CC1)c1cccc2ccccc21 ZINC000051958767 1405889741 /nfs/dbraw/zinc/88/97/41/1405889741.db2.gz QFBRULLOTJMHRE-UHFFFAOYSA-N 2 1 395.547 3.237 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1C(F)(F)F)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051958900 1405889884 /nfs/dbraw/zinc/88/98/84/1405889884.db2.gz MMFYLIYRGCBFQC-OAHLLOKOSA-N 2 1 399.457 3.077 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(C[NH+]2CCOCC2)CC1)c1cccc2ccccc21 ZINC000051957947 1405889999 /nfs/dbraw/zinc/88/99/99/1405889999.db2.gz KYIRWBYXKHDNCJ-LJQANCHMSA-N 2 1 395.547 3.061 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 ZINC000052209312 1405985232 /nfs/dbraw/zinc/98/52/32/1405985232.db2.gz AHAWXQWWZKBPKU-UHFFFAOYSA-N 2 1 388.600 3.155 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H](O)Cn2cnc3cc(C)c(C)cc32)CC1 ZINC000052210267 1405985468 /nfs/dbraw/zinc/98/54/68/1405985468.db2.gz HZHJWBZJAHBLPT-NRFANRHFSA-N 2 1 386.584 3.458 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)NC[C@@H](c1ccccc1)[NH+]1CCC(C)CC1 ZINC000052552842 1406080246 /nfs/dbraw/zinc/08/02/46/1406080246.db2.gz KBBRFNXVIHKDIL-NRFANRHFSA-N 2 1 383.540 3.354 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000056950316 1407482563 /nfs/dbraw/zinc/48/25/63/1407482563.db2.gz PLYMIBBMECSCOU-SFTDATJTSA-N 2 1 384.499 3.002 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)C[NH+]1CCCCC1 ZINC000057042266 1407507149 /nfs/dbraw/zinc/50/71/49/1407507149.db2.gz HCCVLGPJMGIEEI-IBGZPJMESA-N 2 1 390.547 3.165 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)C[NH+]1CCCCC1 ZINC000057042266 1407507154 /nfs/dbraw/zinc/50/71/54/1407507154.db2.gz HCCVLGPJMGIEEI-IBGZPJMESA-N 2 1 390.547 3.165 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C(C)C)[NH+]2CCCCCC2)cn1 ZINC000057127974 1407530932 /nfs/dbraw/zinc/53/09/32/1407530932.db2.gz VZSMQFZYSWURPE-FQEVSTJZSA-N 2 1 398.555 3.276 20 0 GGADMP CCC(CC)[C@H](CNC(=O)NCc1ccc(-n2cc[nH+]c2C)nc1)[NH+]1CCCC1 ZINC000057128044 1407530953 /nfs/dbraw/zinc/53/09/53/1407530953.db2.gz RWUYUHUAVJFBPO-FQEVSTJZSA-N 2 1 398.555 3.276 20 0 GGADMP C[NH+](C)CCOc1cccc(CNC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000057174359 1407545007 /nfs/dbraw/zinc/54/50/07/1407545007.db2.gz ULUZWAKMNOFOQK-QFIPXVFZSA-N 2 1 395.547 3.155 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000057552300 1407648366 /nfs/dbraw/zinc/64/83/66/1407648366.db2.gz AUSJEKVKDBVTBL-JQVVWYNYSA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000057552300 1407648370 /nfs/dbraw/zinc/64/83/70/1407648370.db2.gz AUSJEKVKDBVTBL-JQVVWYNYSA-N 2 1 387.568 3.242 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000057634807 1407673089 /nfs/dbraw/zinc/67/30/89/1407673089.db2.gz MNFKQGFIPQGXND-UHFFFAOYSA-N 2 1 383.540 3.457 20 0 GGADMP CC[N@H+]1CCC[C@H]1CNC(=S)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000057817360 1407727363 /nfs/dbraw/zinc/72/73/63/1407727363.db2.gz MMBZCUFYVPSPFJ-IBGZPJMESA-N 2 1 392.638 3.049 20 0 GGADMP COc1ccc(NC(=O)C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000057843677 1407735392 /nfs/dbraw/zinc/73/53/92/1407735392.db2.gz ONVOURJCALEGTP-UHFFFAOYSA-N 2 1 381.520 3.478 20 0 GGADMP COc1ccc(NC(=O)C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)cc1 ZINC000057843677 1407735397 /nfs/dbraw/zinc/73/53/97/1407735397.db2.gz ONVOURJCALEGTP-UHFFFAOYSA-N 2 1 381.520 3.478 20 0 GGADMP Cc1csc2nc(C[NH+]3CCC(C[N@H+](C)Cc4ccccc4)CC3)cc(=O)n12 ZINC000057843861 1407736404 /nfs/dbraw/zinc/73/64/04/1407736404.db2.gz MDXJEJPJRUWOTR-UHFFFAOYSA-N 2 1 396.560 3.408 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NC1CC[NH+](Cc2cccc(OC)c2)CC1)c1ccccc1 ZINC000057914415 1407754559 /nfs/dbraw/zinc/75/45/59/1407754559.db2.gz MJUMXHLWBOHGMH-QHCPKHFHSA-N 2 1 395.547 3.469 20 0 GGADMP CC1CCC([N@H+](C)CN2C(=O)N[C@@]3(CCC[NH+](Cc4ccccc4)C3)C2=O)CC1 ZINC000058205824 1407798113 /nfs/dbraw/zinc/79/81/13/1407798113.db2.gz SWBLEZPEPVAYGJ-KXNZUKPASA-N 2 1 398.551 3.041 20 0 GGADMP CC1CCC([N@@H+](C)CN2C(=O)N[C@@]3(CCC[NH+](Cc4ccccc4)C3)C2=O)CC1 ZINC000058205824 1407798118 /nfs/dbraw/zinc/79/81/18/1407798118.db2.gz SWBLEZPEPVAYGJ-KXNZUKPASA-N 2 1 398.551 3.041 20 0 GGADMP CC1CCC([NH+](C)CN2C(=O)N[C@@]3(CCC[N@H+](Cc4ccccc4)C3)C2=O)CC1 ZINC000058205824 1407798121 /nfs/dbraw/zinc/79/81/21/1407798121.db2.gz SWBLEZPEPVAYGJ-KXNZUKPASA-N 2 1 398.551 3.041 20 0 GGADMP CC1CCC([NH+](C)CN2C(=O)N[C@@]3(CCC[N@@H+](Cc4ccccc4)C3)C2=O)CC1 ZINC000058205824 1407798124 /nfs/dbraw/zinc/79/81/24/1407798124.db2.gz SWBLEZPEPVAYGJ-KXNZUKPASA-N 2 1 398.551 3.041 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000058811116 1407884772 /nfs/dbraw/zinc/88/47/72/1407884772.db2.gz RUHFPQUDAWKFRW-HXUWFJFHSA-N 2 1 381.520 3.478 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(F)c(F)c1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368432 1407962771 /nfs/dbraw/zinc/96/27/71/1407962771.db2.gz WSZBYNQJBJNNLT-XHSDSOJGSA-N 2 1 395.494 3.113 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(F)c(F)c1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368432 1407962777 /nfs/dbraw/zinc/96/27/77/1407962777.db2.gz WSZBYNQJBJNNLT-XHSDSOJGSA-N 2 1 395.494 3.113 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CCCOc3ccc4c(c3)OCO4)CC2)C[C@H](C)O1 ZINC000060368382 1407962890 /nfs/dbraw/zinc/96/28/90/1407962890.db2.gz FMXUJBNVTLNCEO-HDICACEKSA-N 2 1 390.524 3.005 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000060368436 1407962948 /nfs/dbraw/zinc/96/29/48/1407962948.db2.gz YHNRVGLOYNCLJS-KSZLIROESA-N 2 1 391.531 3.282 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000060368436 1407962953 /nfs/dbraw/zinc/96/29/53/1407962953.db2.gz YHNRVGLOYNCLJS-KSZLIROESA-N 2 1 391.531 3.282 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000061142108 1408082183 /nfs/dbraw/zinc/08/21/83/1408082183.db2.gz APVKMQQCWUWHJI-CEXWTWQISA-N 2 1 376.545 3.084 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000061553123 1408146107 /nfs/dbraw/zinc/14/61/07/1408146107.db2.gz LLMUSVMJTTWFPY-BGYRXZFFSA-N 2 1 386.584 3.450 20 0 GGADMP CC1CC[NH+](CCNC(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)CC1 ZINC000061868648 1408186233 /nfs/dbraw/zinc/18/62/33/1408186233.db2.gz HZVXJRKZTDGWLC-HXUWFJFHSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)N1[C@@H]2CC[C@H]1C[N@@H+](CC)CC2)c1ccsc1 ZINC000176395799 1428298789 /nfs/dbraw/zinc/29/87/89/1428298789.db2.gz LUFLYFMJYBDLAG-QYZOEREBSA-N 2 1 378.586 3.399 20 0 GGADMP C[NH+](C)CCN(Cc1cccc(F)c1)C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000062500075 1408269980 /nfs/dbraw/zinc/26/99/80/1408269980.db2.gz DPPQAKHDNOKXDB-UHFFFAOYSA-N 2 1 386.515 3.031 20 0 GGADMP C[C@@H](CC[NH+](C)C)NC(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000062506440 1408271929 /nfs/dbraw/zinc/27/19/29/1408271929.db2.gz VKMOCQPXTWYEJD-FQEVSTJZSA-N 2 1 394.563 3.443 20 0 GGADMP C[C@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000063148794 1408308006 /nfs/dbraw/zinc/30/80/06/1408308006.db2.gz HZMZKXMQDSEOKU-RBUKOAKNSA-N 2 1 388.625 3.236 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)NC2CC[NH+](CC3CCCC3)CC2)CC1 ZINC000063333848 1408339465 /nfs/dbraw/zinc/33/94/65/1408339465.db2.gz QNJSJGDRNIUFED-UHFFFAOYSA-N 2 1 398.595 3.477 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC2CC[NH+](CC3CCCC3)CC2)C1 ZINC000063407688 1408350188 /nfs/dbraw/zinc/35/01/88/1408350188.db2.gz MACOVGHGUOPLJG-LJQANCHMSA-N 2 1 378.605 3.452 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=S)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000063565772 1408372294 /nfs/dbraw/zinc/37/22/94/1408372294.db2.gz GOTIMQCWLMZKKV-HXUWFJFHSA-N 2 1 388.625 3.236 20 0 GGADMP C[C@H](c1ccc(NC(=O)N(CC[NH+](C)C)C2CCCC2)cc1)[NH+]1CCOCC1 ZINC000176419786 1428313311 /nfs/dbraw/zinc/31/33/11/1428313311.db2.gz XIFIFASUVFOCJE-GOSISDBHSA-N 2 1 388.556 3.418 20 0 GGADMP C[NH+](C)C1(CNC(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CCCC1 ZINC000064337030 1408536476 /nfs/dbraw/zinc/53/64/76/1408536476.db2.gz ZEZIMWLUQOBFLP-HXUWFJFHSA-N 2 1 397.485 3.432 20 0 GGADMP O=C(C[NH+]1CCC(CC[NH+]2CCOCC2)CC1)Nc1cccc2ccccc21 ZINC000064344445 1408537314 /nfs/dbraw/zinc/53/73/14/1408537314.db2.gz HOSAAQKCLAMGMI-UHFFFAOYSA-N 2 1 381.520 3.213 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000064644072 1408590180 /nfs/dbraw/zinc/59/01/80/1408590180.db2.gz PMYYTLFWESFLDT-SFHVURJKSA-N 2 1 392.613 3.380 20 0 GGADMP C[N@@H+]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)[C@@H](c2ccccc2)C1 ZINC000176490203 1428337665 /nfs/dbraw/zinc/33/76/65/1428337665.db2.gz QMQXOCMZILMMBC-JOCHJYFZSA-N 2 1 384.568 3.482 20 0 GGADMP C[N@H+]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)[C@@H](c2ccccc2)C1 ZINC000176490203 1428337672 /nfs/dbraw/zinc/33/76/72/1428337672.db2.gz QMQXOCMZILMMBC-JOCHJYFZSA-N 2 1 384.568 3.482 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000065441576 1408669417 /nfs/dbraw/zinc/66/94/17/1408669417.db2.gz MYAXHXFSBWHBJB-HXUWFJFHSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1 ZINC000065441888 1408669883 /nfs/dbraw/zinc/66/98/83/1408669883.db2.gz SNSYNXSJXNNSJZ-HXUWFJFHSA-N 2 1 394.563 3.397 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)N2CC[NH+](CCc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000065466760 1408673337 /nfs/dbraw/zinc/67/33/37/1408673337.db2.gz HQQSWGCWRUSSRI-HSZRJFAPSA-N 2 1 394.563 3.168 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NCCC[N@H+]2CCc3ccccc3C2)[NH+](C)C)cc1 ZINC000065469424 1408673806 /nfs/dbraw/zinc/67/38/06/1408673806.db2.gz SYZFEXZYNIBKMV-QHCPKHFHSA-N 2 1 394.563 3.345 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)C1 ZINC000065475560 1408675069 /nfs/dbraw/zinc/67/50/69/1408675069.db2.gz JWFMFFOEMQZGCC-BBWFWOEESA-N 2 1 380.602 3.407 20 0 GGADMP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000176493061 1428339045 /nfs/dbraw/zinc/33/90/45/1428339045.db2.gz VXJHBUUMOHLJCL-UHFFFAOYSA-N 2 1 376.589 3.443 20 0 GGADMP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000176495652 1428340162 /nfs/dbraw/zinc/34/01/62/1428340162.db2.gz YJFYGWQUUWVFLQ-UHFFFAOYSA-N 2 1 384.568 3.311 20 0 GGADMP CC[N@H+]1CCC[C@H]1CNC(=S)N(CC[NH+](C)C)Cc1cccc(Cl)c1 ZINC000065704354 1408715081 /nfs/dbraw/zinc/71/50/81/1408715081.db2.gz OSPLSARLIXFNRK-SFHVURJKSA-N 2 1 383.005 3.062 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000065901146 1408750764 /nfs/dbraw/zinc/75/07/64/1408750764.db2.gz FBNQSYLEYRTEGV-IBGZPJMESA-N 2 1 375.532 3.274 20 0 GGADMP CC[N@H+](CCc1ccccn1)CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000065952042 1408761530 /nfs/dbraw/zinc/76/15/30/1408761530.db2.gz FBWNXNOKNFZWAN-UHFFFAOYSA-N 2 1 394.563 3.035 20 0 GGADMP CC[N@@H+](CCc1ccccn1)CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000065952042 1408761533 /nfs/dbraw/zinc/76/15/33/1408761533.db2.gz FBWNXNOKNFZWAN-UHFFFAOYSA-N 2 1 394.563 3.035 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)cn1 ZINC000065992185 1408769398 /nfs/dbraw/zinc/76/93/98/1408769398.db2.gz GFQQUANHOPFLRJ-UHFFFAOYSA-N 2 1 389.503 3.104 20 0 GGADMP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[NH+](CCc2cccs2)CC1 ZINC000065992734 1408769488 /nfs/dbraw/zinc/76/94/88/1408769488.db2.gz OBYHZEROLOQANR-UHFFFAOYSA-N 2 1 397.588 3.347 20 0 GGADMP CN(c1ccc(NC(=O)C[N@H+](C)Cc2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC000066048122 1408778559 /nfs/dbraw/zinc/77/85/59/1408778559.db2.gz KMLQILDTXIXDCK-UHFFFAOYSA-N 2 1 380.536 3.288 20 0 GGADMP CN(c1ccc(NC(=O)C[N@@H+](C)Cc2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC000066048122 1408778563 /nfs/dbraw/zinc/77/85/63/1408778563.db2.gz KMLQILDTXIXDCK-UHFFFAOYSA-N 2 1 380.536 3.288 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N3CC[C@H]([NH+]4CCCC4)C3)cc2)C1 ZINC000066178615 1408787556 /nfs/dbraw/zinc/78/75/56/1408787556.db2.gz IRBSYHWWCCCIET-UGKGYDQZSA-N 2 1 384.568 3.298 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N3CC[C@H]([NH+]4CCCC4)C3)cc2)C1 ZINC000066178614 1408787705 /nfs/dbraw/zinc/78/77/05/1408787705.db2.gz IRBSYHWWCCCIET-KNQAVFIVSA-N 2 1 384.568 3.298 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)CC1 ZINC000066189675 1408788887 /nfs/dbraw/zinc/78/88/87/1408788887.db2.gz ZMAVLRJJDLUSEP-UHFFFAOYSA-N 2 1 387.503 3.336 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@H](c2ccccc2OC)[NH+]2CCCC2)cc1 ZINC000066242308 1408794796 /nfs/dbraw/zinc/79/47/96/1408794796.db2.gz ISLOOAQIGGQHSU-OAQYLSRUSA-N 2 1 396.535 3.197 20 0 GGADMP C[NH+]1CCN(Cc2cccc(NC(=O)[C@@H]3CCC[N@H+]3Cc3ccccc3)c2)CC1 ZINC000066922512 1408952883 /nfs/dbraw/zinc/95/28/83/1408952883.db2.gz ZQTDEAYTWQTRDG-QHCPKHFHSA-N 2 1 392.547 3.037 20 0 GGADMP C[NH+]1CCN(Cc2cccc(NC(=O)[C@H]3CCC[N@H+]3Cc3ccccc3)c2)CC1 ZINC000066922513 1408952982 /nfs/dbraw/zinc/95/29/82/1408952982.db2.gz ZQTDEAYTWQTRDG-HSZRJFAPSA-N 2 1 392.547 3.037 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)NCCc2ccc(F)cc2)CC1 ZINC000066960600 1408963751 /nfs/dbraw/zinc/96/37/51/1408963751.db2.gz PEGFXNXHBLDOFU-GOSISDBHSA-N 2 1 377.548 3.317 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccccc3N3CCOCC3)c2)CCO1 ZINC000066989574 1408973428 /nfs/dbraw/zinc/97/34/28/1408973428.db2.gz ZNXHDWQVFHJNAE-HXUWFJFHSA-N 2 1 395.547 3.034 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccccc3N3CCOCC3)c2)CCO1 ZINC000066989574 1408973430 /nfs/dbraw/zinc/97/34/30/1408973430.db2.gz ZNXHDWQVFHJNAE-HXUWFJFHSA-N 2 1 395.547 3.034 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[C@@H](C[NH+]3CCCC3)C2)cc1)[NH+]1CCOCC1 ZINC000176561785 1428364456 /nfs/dbraw/zinc/36/44/56/1428364456.db2.gz IWQHEUHTBQEAAA-OALUTQOASA-N 2 1 386.540 3.029 20 0 GGADMP CCC[NH+](CCC)CCCNC(=O)NC1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000176566200 1428365996 /nfs/dbraw/zinc/36/59/96/1428365996.db2.gz QEBDVRYHCMDVDV-UHFFFAOYSA-N 2 1 375.561 3.170 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000067222664 1409046750 /nfs/dbraw/zinc/04/67/50/1409046750.db2.gz FMUOVSMZICLRGN-QGZVFWFLSA-N 2 1 384.524 3.070 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000067265074 1409058647 /nfs/dbraw/zinc/05/86/47/1409058647.db2.gz QXXNVXLOJFAKIT-OALUTQOASA-N 2 1 387.568 3.146 20 0 GGADMP CC[NH+]1CCC(CNC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000067418743 1409111490 /nfs/dbraw/zinc/11/14/90/1409111490.db2.gz HKGFSTIOLROLNH-UHFFFAOYSA-N 2 1 386.584 3.272 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1F ZINC000067646401 1409196359 /nfs/dbraw/zinc/19/63/59/1409196359.db2.gz ZWNYTZWUYDCGSF-NRFANRHFSA-N 2 1 395.482 3.422 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCC[NH2+]C2CCCCC2)cc1F ZINC000067646408 1409196624 /nfs/dbraw/zinc/19/66/24/1409196624.db2.gz RHEDFFWIUWWQQO-UHFFFAOYSA-N 2 1 387.503 3.431 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1F ZINC000067646402 1409196642 /nfs/dbraw/zinc/19/66/42/1409196642.db2.gz ZWNYTZWUYDCGSF-OAQYLSRUSA-N 2 1 395.482 3.422 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC(CC[NH+](C)C)CC2)cc1F ZINC000067646786 1409196975 /nfs/dbraw/zinc/19/69/75/1409196975.db2.gz MDAAWNODQBLADN-UHFFFAOYSA-N 2 1 387.503 3.193 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)CC1 ZINC000067646758 1409197231 /nfs/dbraw/zinc/19/72/31/1409197231.db2.gz RJQSTGQHDCTGKA-UHFFFAOYSA-N 2 1 387.503 3.336 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000067686983 1409206859 /nfs/dbraw/zinc/20/68/59/1409206859.db2.gz RLGFJZKHPMTPRZ-QFIPXVFZSA-N 2 1 386.584 3.448 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000067735057 1409217294 /nfs/dbraw/zinc/21/72/94/1409217294.db2.gz PDHSSSDPICWFCX-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[C@@H]3C[NH+]3CCCCC3)cc2)C[C@@H](C)O1 ZINC000068133591 1409310919 /nfs/dbraw/zinc/31/09/19/1409310919.db2.gz AVJPGGKKSICVOP-TXTKFYIRSA-N 2 1 399.579 3.386 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000068218245 1409332828 /nfs/dbraw/zinc/33/28/28/1409332828.db2.gz RCRGHEUTBHIZAW-LJQANCHMSA-N 2 1 375.532 3.371 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@]3([NH+](C)C)CCC[C@@H](C)C3)CC2)cs1 ZINC000068304375 1409358200 /nfs/dbraw/zinc/35/82/00/1409358200.db2.gz DGZUCEKLXKOKIJ-IERDGZPVSA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@]3([NH+](C)C)CCC[C@@H](C)C3)CC2)cs1 ZINC000068304377 1409358301 /nfs/dbraw/zinc/35/83/01/1409358301.db2.gz DGZUCEKLXKOKIJ-IIBYNOLFSA-N 2 1 392.613 3.290 20 0 GGADMP O=C(NCC[NH+]1Cc2ccccc2C1)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000068407716 1409393211 /nfs/dbraw/zinc/39/32/11/1409393211.db2.gz FJVXSLKZONALNB-UHFFFAOYSA-N 2 1 392.547 3.488 20 0 GGADMP COc1cccc([C@@H](CNC(=O)C[N@H+](C)Cc2ccccc2)[NH+]2CCCC2)c1 ZINC000068410795 1409395082 /nfs/dbraw/zinc/39/50/82/1409395082.db2.gz VSQBQVZBXWZWAN-JOCHJYFZSA-N 2 1 381.520 3.080 20 0 GGADMP COc1cccc([C@@H](CNC(=O)C[N@@H+](C)Cc2ccccc2)[NH+]2CCCC2)c1 ZINC000068410795 1409395090 /nfs/dbraw/zinc/39/50/90/1409395090.db2.gz VSQBQVZBXWZWAN-JOCHJYFZSA-N 2 1 381.520 3.080 20 0 GGADMP C[C@H]1C[NH+](CC2CC[NH+](CC(=O)NC3(c4ccccc4)CCC3)CC2)C[C@H](C)O1 ZINC000069017009 1409544082 /nfs/dbraw/zinc/54/40/82/1409544082.db2.gz LUMRLTSBGVJUQF-PMACEKPBSA-N 2 1 399.579 3.003 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](CC(=O)NC3(c4ccccc4)CCC3)CC2)C[C@H](C)O1 ZINC000069017006 1409544395 /nfs/dbraw/zinc/54/43/95/1409544395.db2.gz LUMRLTSBGVJUQF-BGYRXZFFSA-N 2 1 399.579 3.003 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CC(=O)NC3(c4ccccc4)CCC3)CC2)C[C@H](C)O1 ZINC000069017006 1409544399 /nfs/dbraw/zinc/54/43/99/1409544399.db2.gz LUMRLTSBGVJUQF-BGYRXZFFSA-N 2 1 399.579 3.003 20 0 GGADMP C[C@H](C(=O)Nc1cccc2ccccc21)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069030185 1409547531 /nfs/dbraw/zinc/54/75/31/1409547531.db2.gz DSWYVHCEEIXIIF-GOSISDBHSA-N 2 1 381.520 3.211 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@@H+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000069047429 1409553296 /nfs/dbraw/zinc/55/32/96/1409553296.db2.gz LMZZTQKZCXSQQX-OALUTQOASA-N 2 1 387.568 3.242 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@H+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000069047429 1409553303 /nfs/dbraw/zinc/55/33/03/1409553303.db2.gz LMZZTQKZCXSQQX-OALUTQOASA-N 2 1 387.568 3.242 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1C(=O)NCC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000069467161 1409639283 /nfs/dbraw/zinc/63/92/83/1409639283.db2.gz XEQMOPVIAMGRKC-QFIPXVFZSA-N 2 1 387.568 3.288 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1C(=O)NCC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000069467156 1409639438 /nfs/dbraw/zinc/63/94/38/1409639438.db2.gz XEQMOPVIAMGRKC-JOCHJYFZSA-N 2 1 387.568 3.288 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)Nc2ccc(CC[NH+]3CCSCC3)cc2)CC1 ZINC000069661944 1409672222 /nfs/dbraw/zinc/67/22/22/1409672222.db2.gz RHYOYHSCADPPBI-UHFFFAOYSA-N 2 1 390.597 3.226 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)CC1 ZINC000069822449 1409708853 /nfs/dbraw/zinc/70/88/53/1409708853.db2.gz UTUPRXYHSCBDLJ-GOSISDBHSA-N 2 1 378.586 3.086 20 0 GGADMP CC(C)[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000069822449 1409708865 /nfs/dbraw/zinc/70/88/65/1409708865.db2.gz UTUPRXYHSCBDLJ-GOSISDBHSA-N 2 1 378.586 3.086 20 0 GGADMP CC(C)[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000069822449 1409708872 /nfs/dbraw/zinc/70/88/72/1409708872.db2.gz UTUPRXYHSCBDLJ-GOSISDBHSA-N 2 1 378.586 3.086 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)CC2([NH+]3CCOCC3)CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000176720260 1428432964 /nfs/dbraw/zinc/43/29/64/1428432964.db2.gz WAMHKOVIGILPIM-IFMALSPDSA-N 2 1 399.579 3.191 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)Cc1ccccc1 ZINC000071925456 1409830892 /nfs/dbraw/zinc/83/08/92/1409830892.db2.gz SLJKMQBEPZKSRO-JOCHJYFZSA-N 2 1 380.536 3.255 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)Cc1ccccc1 ZINC000071925455 1409830961 /nfs/dbraw/zinc/83/09/61/1409830961.db2.gz SLJKMQBEPZKSRO-QFIPXVFZSA-N 2 1 380.536 3.255 20 0 GGADMP Cc1cccc(C[NH+]2CCN(C(=O)NCCCC[NH+]3CCC(C)CC3)CC2)c1 ZINC000071935635 1409831321 /nfs/dbraw/zinc/83/13/21/1409831321.db2.gz PQGNGHARZUFSKG-UHFFFAOYSA-N 2 1 386.584 3.334 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000071935883 1409831596 /nfs/dbraw/zinc/83/15/96/1409831596.db2.gz PHEMRVCGSILBRU-NHCUHLMSSA-N 2 1 386.584 3.272 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](CC(=O)Nc2cc(Cl)ccc2C)CC1 ZINC000072694698 1409852636 /nfs/dbraw/zinc/85/26/36/1409852636.db2.gz NEPNBIVZZAYJLV-UHFFFAOYSA-N 2 1 381.948 3.410 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N1CCC[N@@H+](Cc2ccccc2C)CC1 ZINC000072905838 1409854958 /nfs/dbraw/zinc/85/49/58/1409854958.db2.gz RBOLUNPMWMCNBC-UHFFFAOYSA-N 2 1 377.598 3.104 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCCC2)CC1)[C@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000073106204 1409857855 /nfs/dbraw/zinc/85/78/55/1409857855.db2.gz VRQXWOMZNOQHDJ-JOCHJYFZSA-N 2 1 384.568 3.207 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCCC2)CC1)[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000073106204 1409857860 /nfs/dbraw/zinc/85/78/60/1409857860.db2.gz VRQXWOMZNOQHDJ-JOCHJYFZSA-N 2 1 384.568 3.207 20 0 GGADMP CC1CC[NH+](CCCNC(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000073536800 1409861951 /nfs/dbraw/zinc/86/19/51/1409861951.db2.gz VAZRXHJKXAFBRV-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3C)CC2)C1 ZINC000073619965 1409863344 /nfs/dbraw/zinc/86/33/44/1409863344.db2.gz KOQBFIOJGPJYRS-FQEVSTJZSA-N 2 1 386.584 3.333 20 0 GGADMP C[C@H](CNC(=O)N(C)CC[C@H]1CCCC[N@@H+]1C)[NH+]1CCc2sccc2C1 ZINC000073725383 1409865086 /nfs/dbraw/zinc/86/50/86/1409865086.db2.gz HTYHSMWMOCQRKM-SJLPKXTDSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@H](CNC(=O)N(C)CC[C@H]1CCCC[N@H+]1C)[NH+]1CCc2sccc2C1 ZINC000073725383 1409865087 /nfs/dbraw/zinc/86/50/87/1409865087.db2.gz HTYHSMWMOCQRKM-SJLPKXTDSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@H](CNC(=O)N(C)CC[C@H]1CCCC[NH+]1C)[N@@H+]1CCc2sccc2C1 ZINC000073725383 1409865088 /nfs/dbraw/zinc/86/50/88/1409865088.db2.gz HTYHSMWMOCQRKM-SJLPKXTDSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@H](CNC(=O)N(C)CC[C@H]1CCCC[NH+]1C)[N@H+]1CCc2sccc2C1 ZINC000073725383 1409865091 /nfs/dbraw/zinc/86/50/91/1409865091.db2.gz HTYHSMWMOCQRKM-SJLPKXTDSA-N 2 1 378.586 3.011 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2)CC1 ZINC000073811050 1409865817 /nfs/dbraw/zinc/86/58/17/1409865817.db2.gz REFQXFJIHDACJW-FSSWDIPSSA-N 2 1 384.568 3.338 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000073874628 1409866492 /nfs/dbraw/zinc/86/64/92/1409866492.db2.gz SQPIPSSPKHLPRV-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000073903288 1409867189 /nfs/dbraw/zinc/86/71/89/1409867189.db2.gz HIYDWIDBVYLGLN-VXKWHMMOSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000073903288 1409867191 /nfs/dbraw/zinc/86/71/91/1409867191.db2.gz HIYDWIDBVYLGLN-VXKWHMMOSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000073903288 1409867194 /nfs/dbraw/zinc/86/71/94/1409867194.db2.gz HIYDWIDBVYLGLN-VXKWHMMOSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000073903290 1409867355 /nfs/dbraw/zinc/86/73/55/1409867355.db2.gz HIYDWIDBVYLGLN-FCHUYYIVSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000073903290 1409867360 /nfs/dbraw/zinc/86/73/60/1409867360.db2.gz HIYDWIDBVYLGLN-FCHUYYIVSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000073903290 1409867361 /nfs/dbraw/zinc/86/73/61/1409867361.db2.gz HIYDWIDBVYLGLN-FCHUYYIVSA-N 2 1 386.584 3.272 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000074103393 1409869060 /nfs/dbraw/zinc/86/90/60/1409869060.db2.gz YJAOJSKQWJGQPZ-YADHBBJMSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000074103393 1409869061 /nfs/dbraw/zinc/86/90/61/1409869061.db2.gz YJAOJSKQWJGQPZ-YADHBBJMSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000074103393 1409869063 /nfs/dbraw/zinc/86/90/63/1409869063.db2.gz YJAOJSKQWJGQPZ-YADHBBJMSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[C@H](CNC(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1)[NH+]1CCC(C)CC1 ZINC000074850589 1409877653 /nfs/dbraw/zinc/87/76/53/1409877653.db2.gz LBZMHKBRHFCGHD-SFTDATJTSA-N 2 1 378.605 3.116 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)C1 ZINC000074858079 1409878178 /nfs/dbraw/zinc/87/81/78/1409878178.db2.gz BDJZAKVZZKNAGU-QWFCFKBJSA-N 2 1 378.605 3.116 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(C)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000074876231 1409878779 /nfs/dbraw/zinc/87/87/79/1409878779.db2.gz ULKHVRXDCWFDSQ-FGZHOGPDSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000074876231 1409878780 /nfs/dbraw/zinc/87/87/80/1409878780.db2.gz ULKHVRXDCWFDSQ-FGZHOGPDSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000074876231 1409878782 /nfs/dbraw/zinc/87/87/82/1409878782.db2.gz ULKHVRXDCWFDSQ-FGZHOGPDSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1)c1ccccc1 ZINC000074891282 1409878813 /nfs/dbraw/zinc/87/88/13/1409878813.db2.gz JEPAYFNYGPWJCX-AZUAARDMSA-N 2 1 386.584 3.489 20 0 GGADMP C[C@@H]([NH2+]C(C)(C)CNC(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1)c1ccccc1 ZINC000074891285 1409878880 /nfs/dbraw/zinc/87/88/80/1409878880.db2.gz JEPAYFNYGPWJCX-UYAOXDASSA-N 2 1 386.584 3.489 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(Cl)c2)CC1 ZINC000075007714 1409880033 /nfs/dbraw/zinc/88/00/33/1409880033.db2.gz LPTVYIIUAMSAQZ-INIZCTEOSA-N 2 1 381.948 3.490 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](CC(=O)Nc2cccc(SC)c2)CC1 ZINC000075007474 1409880122 /nfs/dbraw/zinc/88/01/22/1409880122.db2.gz BDMJSBVQCWHUSE-UHFFFAOYSA-N 2 1 379.570 3.170 20 0 GGADMP c1ccc(-c2nnn(CCCCC[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)n2)cc1 ZINC000075834669 1409883222 /nfs/dbraw/zinc/88/32/22/1409883222.db2.gz VQBWOUQOHSPAHT-FQEVSTJZSA-N 2 1 382.556 3.318 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CC[C@H](CSc3ccccc3)C2)CC1 ZINC000075963886 1409884305 /nfs/dbraw/zinc/88/43/05/1409884305.db2.gz MWXMBAQUBQLQLZ-SFHVURJKSA-N 2 1 375.582 3.090 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000076515065 1409889282 /nfs/dbraw/zinc/88/92/82/1409889282.db2.gz VOOLZWFRSDXLRR-QFIPXVFZSA-N 2 1 386.584 3.448 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)CCc1ccnc2ccccc12 ZINC000076588199 1409890031 /nfs/dbraw/zinc/89/00/31/1409890031.db2.gz LHAGEQVJOCLLSF-HXUWFJFHSA-N 2 1 382.552 3.042 20 0 GGADMP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000076763086 1409891363 /nfs/dbraw/zinc/89/13/63/1409891363.db2.gz OEKZVSQGQSUWRI-NRFANRHFSA-N 2 1 382.552 3.139 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)N2CCC[NH+]3CCC[C@@H]3C2)cc1 ZINC000077763972 1409899927 /nfs/dbraw/zinc/89/99/27/1409899927.db2.gz ORKBTUQTXDBAPG-SIKLNZKXSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N2CCC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000077763972 1409899929 /nfs/dbraw/zinc/89/99/29/1409899929.db2.gz ORKBTUQTXDBAPG-SIKLNZKXSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000077763972 1409899930 /nfs/dbraw/zinc/89/99/30/1409899930.db2.gz ORKBTUQTXDBAPG-SIKLNZKXSA-N 2 1 384.568 3.441 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000077800784 1409901601 /nfs/dbraw/zinc/90/16/01/1409901601.db2.gz YQOMDQJUFRQOTO-QFIPXVFZSA-N 2 1 384.568 3.442 20 0 GGADMP C[NH+]1CCC(CNc2ncnc3cc(F)c(F)cc32)([NH+]2CCCCC2)CC1 ZINC000078457631 1409919643 /nfs/dbraw/zinc/91/96/43/1409919643.db2.gz XTIYBUYABXLJCR-UHFFFAOYSA-N 2 1 375.467 3.270 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NC[C@@H]3CC[NH+](C4CC4)C3)cc2)C1 ZINC000079170464 1409961241 /nfs/dbraw/zinc/96/12/41/1409961241.db2.gz JUJFOFMUBAZLIA-RXVVDRJESA-N 2 1 384.568 3.202 20 0 GGADMP C[C@H]1CCC[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CC[N@@H+](C4CC4)C3)cc2)C1 ZINC000079170464 1409961247 /nfs/dbraw/zinc/96/12/47/1409961247.db2.gz JUJFOFMUBAZLIA-RXVVDRJESA-N 2 1 384.568 3.202 20 0 GGADMP C[C@H]1CCC[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)cc2)C1 ZINC000079170464 1409961255 /nfs/dbraw/zinc/96/12/55/1409961255.db2.gz JUJFOFMUBAZLIA-RXVVDRJESA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)NC[C@@H]2CC[NH+](C3CC3)C2)cc1 ZINC000079169041 1409961316 /nfs/dbraw/zinc/96/13/16/1409961316.db2.gz VYBUKTNNPDUIOM-NQIIRXRSSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000079169041 1409961325 /nfs/dbraw/zinc/96/13/25/1409961325.db2.gz VYBUKTNNPDUIOM-NQIIRXRSSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000079169041 1409961333 /nfs/dbraw/zinc/96/13/33/1409961333.db2.gz VYBUKTNNPDUIOM-NQIIRXRSSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)NC[C@@H]2CC[NH+](C3CC3)C2)C1 ZINC000079170567 1409961725 /nfs/dbraw/zinc/96/17/25/1409961725.db2.gz FLUQXKUYRNDQFG-MOPGFXCFSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000079170567 1409961734 /nfs/dbraw/zinc/96/17/34/1409961734.db2.gz FLUQXKUYRNDQFG-MOPGFXCFSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)C1 ZINC000079170567 1409961738 /nfs/dbraw/zinc/96/17/38/1409961738.db2.gz FLUQXKUYRNDQFG-MOPGFXCFSA-N 2 1 384.568 3.202 20 0 GGADMP CC[C@H](CNC(=O)N1CCC([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079256841 1409963395 /nfs/dbraw/zinc/96/33/95/1409963395.db2.gz SUZSTDZQPCXRJP-OAQYLSRUSA-N 2 1 384.568 3.093 20 0 GGADMP CC[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000079256950 1409964469 /nfs/dbraw/zinc/96/44/69/1409964469.db2.gz PAAHGOOYIYTLNS-YADHBBJMSA-N 2 1 384.568 3.093 20 0 GGADMP CC(C)(CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000079493658 1409978449 /nfs/dbraw/zinc/97/84/49/1409978449.db2.gz ZHAVRORVLOPIGB-OAQYLSRUSA-N 2 1 384.568 3.093 20 0 GGADMP CC[NH+](CC)CCN(Cc1cccs1)C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000079551699 1409981318 /nfs/dbraw/zinc/98/13/18/1409981318.db2.gz BURWDOPYJAAQSW-RBUKOAKNSA-N 2 1 378.586 3.228 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000079653462 1409985955 /nfs/dbraw/zinc/98/59/55/1409985955.db2.gz KTCAVUPUIQZRME-PXNSSMCTSA-N 2 1 378.536 3.382 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)CC1 ZINC000080015056 1409997762 /nfs/dbraw/zinc/99/77/62/1409997762.db2.gz GYIUCOWNGDWWAW-MRXNPFEDSA-N 2 1 378.586 3.011 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)CC1 ZINC000080015056 1409997782 /nfs/dbraw/zinc/99/77/82/1409997782.db2.gz GYIUCOWNGDWWAW-MRXNPFEDSA-N 2 1 378.586 3.011 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000080064789 1409998995 /nfs/dbraw/zinc/99/89/95/1409998995.db2.gz JLEHVGQXXOWNEX-SIKLNZKXSA-N 2 1 386.584 3.459 20 0 GGADMP O=C(NC1CCC([NH+]2CCCCC2)CC1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000080212691 1410003709 /nfs/dbraw/zinc/00/37/09/1410003709.db2.gz RATAKORHSALFHO-UHFFFAOYSA-N 2 1 376.589 3.443 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000080553152 1410007230 /nfs/dbraw/zinc/00/72/30/1410007230.db2.gz ONUFKBFIBJWHQY-NRFANRHFSA-N 2 1 375.532 3.418 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000080553152 1410007241 /nfs/dbraw/zinc/00/72/41/1410007241.db2.gz ONUFKBFIBJWHQY-NRFANRHFSA-N 2 1 375.532 3.418 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)C1 ZINC000080657280 1410009402 /nfs/dbraw/zinc/00/94/02/1410009402.db2.gz ZWCNFVMCVMQIJJ-IRLDBZIGSA-N 2 1 384.568 3.197 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000081333735 1410017602 /nfs/dbraw/zinc/01/76/02/1410017602.db2.gz AHSHVLMUEYJLDV-PMACEKPBSA-N 2 1 375.532 3.228 20 0 GGADMP O=C([C@H]1CCC[N@@H+]1Cc1ccccn1)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000081338387 1410017709 /nfs/dbraw/zinc/01/77/09/1410017709.db2.gz DRYVPNRKNPVEIS-JOCHJYFZSA-N 2 1 384.568 3.161 20 0 GGADMP O=C([C@H]1CCC[N@H+]1Cc1ccccn1)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000081338387 1410017716 /nfs/dbraw/zinc/01/77/16/1410017716.db2.gz DRYVPNRKNPVEIS-JOCHJYFZSA-N 2 1 384.568 3.161 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N1CCC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000081444250 1410020108 /nfs/dbraw/zinc/02/01/08/1410020108.db2.gz ARATVGKYVHIBIH-IBGZPJMESA-N 2 1 377.598 3.184 20 0 GGADMP CC[NH+](CC)[C@H](C(=O)NCCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1 ZINC000083027998 1410027200 /nfs/dbraw/zinc/02/72/00/1410027200.db2.gz ILWYDBQWRUSGLC-ZVDOUQERSA-N 2 1 375.557 3.075 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000083422792 1410030474 /nfs/dbraw/zinc/03/04/74/1410030474.db2.gz ZRJQOWWQFFGDKD-UHFFFAOYSA-N 2 1 375.944 3.418 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000083422792 1410030479 /nfs/dbraw/zinc/03/04/79/1410030479.db2.gz ZRJQOWWQFFGDKD-UHFFFAOYSA-N 2 1 375.944 3.418 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(F)c1)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000089594635 1410055800 /nfs/dbraw/zinc/05/58/00/1410055800.db2.gz XYOKTKOZGWJAMK-QGZVFWFLSA-N 2 1 377.504 3.168 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)C[NH+](C)[C@@H]2CCSC2)cc1 ZINC000089935801 1410059096 /nfs/dbraw/zinc/05/90/96/1410059096.db2.gz ZUJFTXKNYDBQEN-YLJYHZDGSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)C[N@H+](C)[C@@H]2CCSC2)cc1 ZINC000089935801 1410059104 /nfs/dbraw/zinc/05/91/04/1410059104.db2.gz ZUJFTXKNYDBQEN-YLJYHZDGSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)C[N@@H+](C)[C@@H]2CCSC2)cc1 ZINC000089935801 1410059114 /nfs/dbraw/zinc/05/91/14/1410059114.db2.gz ZUJFTXKNYDBQEN-YLJYHZDGSA-N 2 1 375.582 3.115 20 0 GGADMP CCCN(Cc1ccc(C)cc1)C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000090004543 1410060096 /nfs/dbraw/zinc/06/00/96/1410060096.db2.gz AXCHSHCKYBMVAL-NRFANRHFSA-N 2 1 382.552 3.422 20 0 GGADMP CCCN(Cc1ccc(C)cc1)C(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000090004543 1410060103 /nfs/dbraw/zinc/06/01/03/1410060103.db2.gz AXCHSHCKYBMVAL-NRFANRHFSA-N 2 1 382.552 3.422 20 0 GGADMP C[C@@H]1C[C@H](NC2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)CC[N@H+]1Cc1ccccc1 ZINC000090525877 1410064162 /nfs/dbraw/zinc/06/41/62/1410064162.db2.gz FFXRWDDCGWFWEC-CDIGIKMISA-N 2 1 385.596 3.397 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@H]3CCO[C@]4(CCSC4)C3)CC2)cc1 ZINC000090540148 1410064892 /nfs/dbraw/zinc/06/48/92/1410064892.db2.gz WZFGVMGUYQCCBY-LEWJYISDSA-N 2 1 378.557 3.477 20 0 GGADMP COCCc1nc(C)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)s1 ZINC000090526746 1410065221 /nfs/dbraw/zinc/06/52/21/1410065221.db2.gz QFQSKYLHVJGUDZ-WBAXXEDZSA-N 2 1 381.586 3.059 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H](C)[C@@H](OC2CCOCC2)c2ccccc2)CC1 ZINC000090605068 1410065938 /nfs/dbraw/zinc/06/59/38/1410065938.db2.gz NRUBBSOKCRLFSL-PGRDOPGGSA-N 2 1 376.541 3.012 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1nc2ccccc2n1C ZINC000091367836 1410073067 /nfs/dbraw/zinc/07/30/67/1410073067.db2.gz MDZQGBRVBRRIBU-KRWDZBQOSA-N 2 1 378.520 3.381 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1nc2ccccc2n1C ZINC000091367837 1410073503 /nfs/dbraw/zinc/07/35/03/1410073503.db2.gz MDZQGBRVBRRIBU-QGZVFWFLSA-N 2 1 378.520 3.381 20 0 GGADMP CCOc1ccc(C2=CC[N@H+](CC(=O)NC3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000091810929 1410082913 /nfs/dbraw/zinc/08/29/13/1410082913.db2.gz ZVBBBUXLESUPIA-UHFFFAOYSA-N 2 1 385.552 3.163 20 0 GGADMP CCOc1ccc(C2=CC[N@@H+](CC(=O)NC3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000091810929 1410082920 /nfs/dbraw/zinc/08/29/20/1410082920.db2.gz ZVBBBUXLESUPIA-UHFFFAOYSA-N 2 1 385.552 3.163 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@@H+](C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 ZINC000091934762 1410094565 /nfs/dbraw/zinc/09/45/65/1410094565.db2.gz DSLFFAFRYMKLNS-UHFFFAOYSA-N 2 1 391.556 3.458 20 0 GGADMP C[C@H]1CC[N@@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@@H]1n1ccnc1 ZINC000091960580 1410095407 /nfs/dbraw/zinc/09/54/07/1410095407.db2.gz WWVFRRZWVXXSFD-CVDCTZTESA-N 2 1 381.568 3.497 20 0 GGADMP Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)C1 ZINC000092011474 1410098150 /nfs/dbraw/zinc/09/81/50/1410098150.db2.gz PRLHEZIZJPKOSZ-RTWAWAEBSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@@H](O)[C@@H]1CCC[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)C1 ZINC000092011474 1410098158 /nfs/dbraw/zinc/09/81/58/1410098158.db2.gz PRLHEZIZJPKOSZ-RTWAWAEBSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@@H](O)[C@@H]1CCC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC000092011474 1410098166 /nfs/dbraw/zinc/09/81/66/1410098166.db2.gz PRLHEZIZJPKOSZ-RTWAWAEBSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1cc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000092253359 1410130356 /nfs/dbraw/zinc/13/03/56/1410130356.db2.gz HIXRILKYLPJOQJ-QGZVFWFLSA-N 2 1 384.524 3.022 20 0 GGADMP Cn1cc(C[N@@H+](C)C[C@@H]2CCC[NH+](C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000092253359 1410130362 /nfs/dbraw/zinc/13/03/62/1410130362.db2.gz HIXRILKYLPJOQJ-QGZVFWFLSA-N 2 1 384.524 3.022 20 0 GGADMP Cn1cc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000092253359 1410130368 /nfs/dbraw/zinc/13/03/68/1410130368.db2.gz HIXRILKYLPJOQJ-QGZVFWFLSA-N 2 1 384.524 3.022 20 0 GGADMP Cn1cc(C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000092253359 1410130374 /nfs/dbraw/zinc/13/03/74/1410130374.db2.gz HIXRILKYLPJOQJ-QGZVFWFLSA-N 2 1 384.524 3.022 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+]3CCC[C@@H]3Cc3ccccc3Cl)cn2)CC1 ZINC000092360893 1410142775 /nfs/dbraw/zinc/14/27/75/1410142775.db2.gz KZLYCGCQFWVUKB-LJQANCHMSA-N 2 1 385.943 3.089 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+]3CCC[C@@H]3Cc3ccccc3Cl)cn2)CC1 ZINC000092360893 1410142786 /nfs/dbraw/zinc/14/27/86/1410142786.db2.gz KZLYCGCQFWVUKB-LJQANCHMSA-N 2 1 385.943 3.089 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+]3CCC[C@H]3Cc3ccccc3Cl)cn2)CC1 ZINC000092360894 1410142870 /nfs/dbraw/zinc/14/28/70/1410142870.db2.gz KZLYCGCQFWVUKB-IBGZPJMESA-N 2 1 385.943 3.089 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+]3CCC[C@H]3Cc3ccccc3Cl)cn2)CC1 ZINC000092360894 1410142880 /nfs/dbraw/zinc/14/28/80/1410142880.db2.gz KZLYCGCQFWVUKB-IBGZPJMESA-N 2 1 385.943 3.089 20 0 GGADMP CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000092400061 1410150561 /nfs/dbraw/zinc/15/05/61/1410150561.db2.gz QHSSCPYOIXFYIG-UYAOXDASSA-N 2 1 375.557 3.144 20 0 GGADMP CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000092455522 1410159425 /nfs/dbraw/zinc/15/94/25/1410159425.db2.gz SLWTYACQSXQRSR-IBGZPJMESA-N 2 1 389.540 3.260 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCC[C@H](CNC(=O)OC(C)(C)C)C2)cc1 ZINC000092513089 1410165571 /nfs/dbraw/zinc/16/55/71/1410165571.db2.gz JMCOQSBYZMHCBM-LJQANCHMSA-N 2 1 391.556 3.364 20 0 GGADMP CCOc1ccc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1OC ZINC000092587543 1410177363 /nfs/dbraw/zinc/17/73/63/1410177363.db2.gz MOECTDQLYZLDDQ-HDICACEKSA-N 2 1 376.541 3.415 20 0 GGADMP COc1cc(OC)c(C[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c(OC)c1 ZINC000092587393 1410177404 /nfs/dbraw/zinc/17/74/04/1410177404.db2.gz SWJNWDKVWKEQBN-IAGOWNOFSA-N 2 1 392.540 3.034 20 0 GGADMP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000092666096 1410186108 /nfs/dbraw/zinc/18/61/08/1410186108.db2.gz GKUAVMYWZFIVLH-PMACEKPBSA-N 2 1 395.551 3.259 20 0 GGADMP CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000092708036 1410191926 /nfs/dbraw/zinc/19/19/26/1410191926.db2.gz LFJRYGWAYNMIQC-NRFANRHFSA-N 2 1 387.568 3.290 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(c2ccnn2CCO)CC1 ZINC000092811287 1410203164 /nfs/dbraw/zinc/20/31/64/1410203164.db2.gz CAFBKUICILYLRA-UHFFFAOYSA-N 2 1 384.568 3.213 20 0 GGADMP Cc1ccccc1CNC(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092821330 1410203865 /nfs/dbraw/zinc/20/38/65/1410203865.db2.gz LHUUUPUFYUBJES-UHFFFAOYSA-N 2 1 380.536 3.245 20 0 GGADMP C[C@@H](NC(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000092821463 1410204020 /nfs/dbraw/zinc/20/40/20/1410204020.db2.gz HLKHIQWABABLPX-LJQANCHMSA-N 2 1 380.536 3.497 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc(N)c2ccccc2n1 ZINC000092821704 1410204138 /nfs/dbraw/zinc/20/41/38/1410204138.db2.gz WDPBFNOLGUURQF-UHFFFAOYSA-N 2 1 376.508 3.346 20 0 GGADMP C[C@H](NC(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000092821462 1410204505 /nfs/dbraw/zinc/20/45/05/1410204505.db2.gz HLKHIQWABABLPX-IBGZPJMESA-N 2 1 380.536 3.497 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCCN(C(=O)Oc3ccccc3)CC2)cc1 ZINC000092938946 1410211380 /nfs/dbraw/zinc/21/13/80/1410211380.db2.gz YZBPFFLLMRGPHJ-UHFFFAOYSA-N 2 1 397.519 3.334 20 0 GGADMP CCOc1cc(C[N@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)ccc1OCC(C)C ZINC000093133388 1410223118 /nfs/dbraw/zinc/22/31/18/1410223118.db2.gz OMRSNECVVNEXMD-OAQYLSRUSA-N 2 1 389.584 3.332 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cn(-c4ccccc4)nc3C(C)C)C2)CC1 ZINC000093132625 1410223542 /nfs/dbraw/zinc/22/35/42/1410223542.db2.gz LRYYAUDTIZRNMW-QFIPXVFZSA-N 2 1 381.568 3.208 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(-c4c(F)cccc4F)o3)C2)CC1 ZINC000093132895 1410223606 /nfs/dbraw/zinc/22/36/06/1410223606.db2.gz ZWVBVFILSYYRRD-INIZCTEOSA-N 2 1 375.463 3.437 20 0 GGADMP CCCCOc1ccc(C[N@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)cc1OC ZINC000093133166 1410223742 /nfs/dbraw/zinc/22/37/42/1410223742.db2.gz WHPGOCDZMWXACH-FQEVSTJZSA-N 2 1 375.557 3.086 20 0 GGADMP CCCCCOc1cc(C[N@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)ccc1OC ZINC000093133099 1410224079 /nfs/dbraw/zinc/22/40/79/1410224079.db2.gz ZBVONHRKVDDZKB-OAQYLSRUSA-N 2 1 389.584 3.476 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](CC3=Cc4cc(Cl)cc(Cl)c4OC3)C2)CC1 ZINC000093132766 1410224359 /nfs/dbraw/zinc/22/43/59/1410224359.db2.gz NNXZQNGIDPXDRG-GOSISDBHSA-N 2 1 396.362 3.481 20 0 GGADMP Cn1cc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000093336825 1410235928 /nfs/dbraw/zinc/23/59/28/1410235928.db2.gz CHBRDACZSBYJCA-HXUWFJFHSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000093336825 1410235936 /nfs/dbraw/zinc/23/59/36/1410235936.db2.gz CHBRDACZSBYJCA-HXUWFJFHSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000093336825 1410235946 /nfs/dbraw/zinc/23/59/46/1410235946.db2.gz CHBRDACZSBYJCA-HXUWFJFHSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000093336825 1410235953 /nfs/dbraw/zinc/23/59/53/1410235953.db2.gz CHBRDACZSBYJCA-HXUWFJFHSA-N 2 1 375.520 3.436 20 0 GGADMP CN(c1ccccc1C[N@@H+](CCO)CCc1ccccc1)C1CC[NH+](C)CC1 ZINC000093389733 1410242465 /nfs/dbraw/zinc/24/24/65/1410242465.db2.gz SGWKDGKQZOXIPI-UHFFFAOYSA-N 2 1 381.564 3.254 20 0 GGADMP C[C@@H](c1cccnc1)N1CC[NH+](Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000093413627 1410243713 /nfs/dbraw/zinc/24/37/13/1410243713.db2.gz ISEAQOLYSJLNML-NRFANRHFSA-N 2 1 394.563 3.435 20 0 GGADMP C[C@@H](c1cccnc1)[NH+]1CCN(Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000093413627 1410243718 /nfs/dbraw/zinc/24/37/18/1410243718.db2.gz ISEAQOLYSJLNML-NRFANRHFSA-N 2 1 394.563 3.435 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1nccs1 ZINC000093404876 1410243879 /nfs/dbraw/zinc/24/38/79/1410243879.db2.gz BXEDTNQRYRZMDG-INIZCTEOSA-N 2 1 375.538 3.484 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1nccs1 ZINC000093404876 1410243882 /nfs/dbraw/zinc/24/38/82/1410243882.db2.gz BXEDTNQRYRZMDG-INIZCTEOSA-N 2 1 375.538 3.484 20 0 GGADMP CN(c1ccccc1C[N@@H+](C)CCC(=O)OC(C)(C)C)C1CC[NH+](C)CC1 ZINC000093686676 1410260320 /nfs/dbraw/zinc/26/03/20/1410260320.db2.gz CRHJGSRQLGCNKS-UHFFFAOYSA-N 2 1 375.557 3.381 20 0 GGADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093741898 1410262636 /nfs/dbraw/zinc/26/26/36/1410262636.db2.gz NQGVVNBSTHWVIA-GOSISDBHSA-N 2 1 398.551 3.412 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093741898 1410262642 /nfs/dbraw/zinc/26/26/42/1410262642.db2.gz NQGVVNBSTHWVIA-GOSISDBHSA-N 2 1 398.551 3.412 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093741898 1410262648 /nfs/dbraw/zinc/26/26/48/1410262648.db2.gz NQGVVNBSTHWVIA-GOSISDBHSA-N 2 1 398.551 3.412 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093741898 1410262653 /nfs/dbraw/zinc/26/26/53/1410262653.db2.gz NQGVVNBSTHWVIA-GOSISDBHSA-N 2 1 398.551 3.412 20 0 GGADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093769947 1410265509 /nfs/dbraw/zinc/26/55/09/1410265509.db2.gz CGZFIMNTJLGLHB-KRWDZBQOSA-N 2 1 384.524 3.022 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093769947 1410265514 /nfs/dbraw/zinc/26/55/14/1410265514.db2.gz CGZFIMNTJLGLHB-KRWDZBQOSA-N 2 1 384.524 3.022 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093769947 1410265520 /nfs/dbraw/zinc/26/55/20/1410265520.db2.gz CGZFIMNTJLGLHB-KRWDZBQOSA-N 2 1 384.524 3.022 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093769947 1410265523 /nfs/dbraw/zinc/26/55/23/1410265523.db2.gz CGZFIMNTJLGLHB-KRWDZBQOSA-N 2 1 384.524 3.022 20 0 GGADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093769948 1410265586 /nfs/dbraw/zinc/26/55/86/1410265586.db2.gz CGZFIMNTJLGLHB-QGZVFWFLSA-N 2 1 384.524 3.022 20 0 GGADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093769948 1410265589 /nfs/dbraw/zinc/26/55/89/1410265589.db2.gz CGZFIMNTJLGLHB-QGZVFWFLSA-N 2 1 384.524 3.022 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093769948 1410265592 /nfs/dbraw/zinc/26/55/92/1410265592.db2.gz CGZFIMNTJLGLHB-QGZVFWFLSA-N 2 1 384.524 3.022 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093769948 1410265597 /nfs/dbraw/zinc/26/55/97/1410265597.db2.gz CGZFIMNTJLGLHB-QGZVFWFLSA-N 2 1 384.524 3.022 20 0 GGADMP CCOC(=O)c1ccc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)o1 ZINC000093844439 1410274410 /nfs/dbraw/zinc/27/44/10/1410274410.db2.gz VMFJDVBXXRTYOM-CALCHBBNSA-N 2 1 378.513 3.168 20 0 GGADMP COc1ccc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1OC ZINC000093844370 1410274622 /nfs/dbraw/zinc/27/46/22/1410274622.db2.gz SFGFWESNXLPDJP-HDICACEKSA-N 2 1 376.541 3.415 20 0 GGADMP CC[C@@H]1C[N@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)CC[C@@H]1c1ccccc1 ZINC000093882511 1410277533 /nfs/dbraw/zinc/27/75/33/1410277533.db2.gz CRWUUVYUFZLMBL-IRLDBZIGSA-N 2 1 379.552 3.244 20 0 GGADMP CC[C@@H]1C[N@@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)CC[C@@H]1c1ccccc1 ZINC000093882511 1410277541 /nfs/dbraw/zinc/27/75/41/1410277541.db2.gz CRWUUVYUFZLMBL-IRLDBZIGSA-N 2 1 379.552 3.244 20 0 GGADMP C[C@@H](CNC(=O)N(CC[NH+](C)C)C1CCCC1)[N@@H+]1CCc2sccc2C1 ZINC000176814493 1428477673 /nfs/dbraw/zinc/47/76/73/1428477673.db2.gz XXOMZHBUDJJNHD-INIZCTEOSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(CC[NH+](C)C)C1CCCC1)[N@H+]1CCc2sccc2C1 ZINC000176814493 1428477681 /nfs/dbraw/zinc/47/76/81/1428477681.db2.gz XXOMZHBUDJJNHD-INIZCTEOSA-N 2 1 378.586 3.011 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1nc2ccccc2s1 ZINC000101602690 1410475211 /nfs/dbraw/zinc/47/52/11/1410475211.db2.gz KANFOZJYJSDSNE-OAHLLOKOSA-N 2 1 375.542 3.176 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[NH+]1[C@H](C)CC[C@H]1C ZINC000101648507 1410485650 /nfs/dbraw/zinc/48/56/50/1410485650.db2.gz QEZUNJGSRWHRHZ-OAGGEKHMSA-N 2 1 379.495 3.307 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@H+](CCCc2ccccc2)CC1)c1ccco1 ZINC000101770779 1410501116 /nfs/dbraw/zinc/50/11/16/1410501116.db2.gz FOGAEWKTOCNJPV-OAQYLSRUSA-N 2 1 398.551 3.232 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1)c1ccco1 ZINC000101770779 1410501118 /nfs/dbraw/zinc/50/11/18/1410501118.db2.gz FOGAEWKTOCNJPV-OAQYLSRUSA-N 2 1 398.551 3.232 20 0 GGADMP CC[N@H+]1CCCC[C@H]1C(=O)NCCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000176848639 1428499648 /nfs/dbraw/zinc/49/96/48/1428499648.db2.gz NQQUOHDYKFKVIF-QFIPXVFZSA-N 2 1 387.568 3.048 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000102935466 1410809672 /nfs/dbraw/zinc/80/96/72/1410809672.db2.gz AFPFPYBFLUEECB-WMZOPIPTSA-N 2 1 397.567 3.386 20 0 GGADMP COc1cccc(CNC(=O)C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000103143100 1410831436 /nfs/dbraw/zinc/83/14/36/1410831436.db2.gz XYBDRTCTOMORKH-UHFFFAOYSA-N 2 1 395.547 3.155 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc(=O)n3ccsc3n2)CC1 ZINC000103143164 1410831457 /nfs/dbraw/zinc/83/14/57/1410831457.db2.gz PIQVBNTUCUTVNT-UHFFFAOYSA-N 2 1 382.533 3.100 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCN2C(=O)c3ccccc3C2=O)CC1 ZINC000103143172 1410831508 /nfs/dbraw/zinc/83/15/08/1410831508.db2.gz OCLLCVXJDRZUPL-UHFFFAOYSA-N 2 1 391.515 3.127 20 0 GGADMP CC1(C)CC(NC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC(C)(C)[NH2+]1 ZINC000103185060 1410835400 /nfs/dbraw/zinc/83/54/00/1410835400.db2.gz PNEUTKLYAKJIFI-IBGZPJMESA-N 2 1 386.584 3.159 20 0 GGADMP CC1(C)CC(NC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)CC(C)(C)[NH2+]1 ZINC000103185063 1410835459 /nfs/dbraw/zinc/83/54/59/1410835459.db2.gz PNEUTKLYAKJIFI-LJQANCHMSA-N 2 1 386.584 3.159 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1)c1ccccc1 ZINC000103191831 1410836340 /nfs/dbraw/zinc/83/63/40/1410836340.db2.gz JOPYRRUWDHRENY-AUSIDOKSSA-N 2 1 395.547 3.217 20 0 GGADMP CCN(C)[C@@H](C(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1)c1ccccc1 ZINC000103191831 1410836341 /nfs/dbraw/zinc/83/63/41/1410836341.db2.gz JOPYRRUWDHRENY-AUSIDOKSSA-N 2 1 395.547 3.217 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1 ZINC000103247304 1410840620 /nfs/dbraw/zinc/84/06/20/1410840620.db2.gz MPKMAWNDAGSNQP-IRLDBZIGSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCNC(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000103247304 1410840622 /nfs/dbraw/zinc/84/06/22/1410840622.db2.gz MPKMAWNDAGSNQP-IRLDBZIGSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCNC(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000103247304 1410840623 /nfs/dbraw/zinc/84/06/23/1410840623.db2.gz MPKMAWNDAGSNQP-IRLDBZIGSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N(C)CC3CC[NH+](C)CC3)cc2)C1 ZINC000103511610 1410865094 /nfs/dbraw/zinc/86/50/94/1410865094.db2.gz NYJVCFDORLMMKE-IBGZPJMESA-N 2 1 386.584 3.402 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)[C@@H](C(C)C)N2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534797 1410866623 /nfs/dbraw/zinc/86/66/23/1410866623.db2.gz YMKDUZGUJSBTPI-SVFBPWRDSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)[C@@H](C(C)C)[NH+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534797 1410866625 /nfs/dbraw/zinc/86/66/25/1410866625.db2.gz YMKDUZGUJSBTPI-SVFBPWRDSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)[C@@H](C(C)C)[NH+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534797 1410866626 /nfs/dbraw/zinc/86/66/26/1410866626.db2.gz YMKDUZGUJSBTPI-SVFBPWRDSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[NH+](C)CC1CCN(C(=O)[C@@H](C(C)C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534797 1410866627 /nfs/dbraw/zinc/86/66/27/1410866627.db2.gz YMKDUZGUJSBTPI-SVFBPWRDSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[NH+](C)CC1CCN(C(=O)[C@@H](C(C)C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534797 1410866628 /nfs/dbraw/zinc/86/66/28/1410866628.db2.gz YMKDUZGUJSBTPI-SVFBPWRDSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)[C@H](C(C)C)N2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534801 1410866657 /nfs/dbraw/zinc/86/66/57/1410866657.db2.gz YMKDUZGUJSBTPI-ZVDOUQERSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)[C@H](C(C)C)[NH+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534801 1410866661 /nfs/dbraw/zinc/86/66/61/1410866661.db2.gz YMKDUZGUJSBTPI-ZVDOUQERSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)[C@H](C(C)C)[NH+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534801 1410866664 /nfs/dbraw/zinc/86/66/64/1410866664.db2.gz YMKDUZGUJSBTPI-ZVDOUQERSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[NH+](C)CC1CCN(C(=O)[C@H](C(C)C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534801 1410866665 /nfs/dbraw/zinc/86/66/65/1410866665.db2.gz YMKDUZGUJSBTPI-ZVDOUQERSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[NH+](C)CC1CCN(C(=O)[C@H](C(C)C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000103534801 1410866666 /nfs/dbraw/zinc/86/66/66/1410866666.db2.gz YMKDUZGUJSBTPI-ZVDOUQERSA-N 2 1 381.605 3.091 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCC2)cc1 ZINC000104272919 1410889977 /nfs/dbraw/zinc/88/99/77/1410889977.db2.gz ZYCKNDFJDOOWGW-HXUWFJFHSA-N 2 1 386.540 3.314 20 0 GGADMP COCCN(CC[NH+](C)C)C(=O)Nc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000105005063 1411012245 /nfs/dbraw/zinc/01/22/45/1411012245.db2.gz IXDYAHGUTVCRED-UHFFFAOYSA-N 2 1 387.528 3.097 20 0 GGADMP COc1ccc([C@H](CNC(=O)NC[C@@H](C)[N@@H+](C)C2CC2)[NH+]2CCCCC2)cc1 ZINC000105077929 1411024912 /nfs/dbraw/zinc/02/49/12/1411024912.db2.gz OFLKRIZZMJMHRE-UTKZUKDTSA-N 2 1 388.556 3.004 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)NCC3CC[NH+](C)CC3)cc2)C1 ZINC000105121828 1411031589 /nfs/dbraw/zinc/03/15/89/1411031589.db2.gz LJLBGCQIXDHSEZ-KDURUIRLSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)NCC2CC[NH+](C)CC2)C1 ZINC000105121871 1411031895 /nfs/dbraw/zinc/03/18/95/1411031895.db2.gz HKULTKGIDNPOGO-KDURUIRLSA-N 2 1 386.584 3.306 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)cc1F ZINC000105190186 1411040323 /nfs/dbraw/zinc/04/03/23/1411040323.db2.gz PJFFEQXSMZMXHX-LJQANCHMSA-N 2 1 399.514 3.480 20 0 GGADMP CC(C)[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCCC1 ZINC000105209370 1411042196 /nfs/dbraw/zinc/04/21/96/1411042196.db2.gz VNJQLGRGZMYRIK-UYAOXDASSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000105209288 1411042521 /nfs/dbraw/zinc/04/25/21/1411042521.db2.gz WJJNPNLCOPUBJS-RBUKOAKNSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000105209288 1411042528 /nfs/dbraw/zinc/04/25/28/1411042528.db2.gz WJJNPNLCOPUBJS-RBUKOAKNSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000105209288 1411042535 /nfs/dbraw/zinc/04/25/35/1411042535.db2.gz WJJNPNLCOPUBJS-RBUKOAKNSA-N 2 1 392.613 3.380 20 0 GGADMP C[N@H+](CCN1CC[NH+](C[C@@H](O)c2ccc(Cl)cc2)CC1)Cc1ccccc1 ZINC000105414226 1411064272 /nfs/dbraw/zinc/06/42/72/1411064272.db2.gz NYOGVYAHWWCPSM-JOCHJYFZSA-N 2 1 387.955 3.123 20 0 GGADMP C[N@@H+](CCN1CC[NH+](C[C@@H](O)c2ccc(Cl)cc2)CC1)Cc1ccccc1 ZINC000105414226 1411064277 /nfs/dbraw/zinc/06/42/77/1411064277.db2.gz NYOGVYAHWWCPSM-JOCHJYFZSA-N 2 1 387.955 3.123 20 0 GGADMP CCCOc1c(Cl)cc(C[NH2+]CCCN2CCC[N@@H+](C)CC2)cc1OC ZINC000105477053 1411070637 /nfs/dbraw/zinc/07/06/37/1411070637.db2.gz DTTFRDCHSXEWNA-UHFFFAOYSA-N 2 1 383.964 3.255 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](CCC[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000105475533 1411070959 /nfs/dbraw/zinc/07/09/59/1411070959.db2.gz AAJCPFBZYFNUIN-HNNXBMFYSA-N 2 1 375.900 3.277 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000105475533 1411070967 /nfs/dbraw/zinc/07/09/67/1411070967.db2.gz AAJCPFBZYFNUIN-HNNXBMFYSA-N 2 1 375.900 3.277 20 0 GGADMP CC[C@@H]1c2ccsc2CCN1C(=O)C[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000106164662 1411175391 /nfs/dbraw/zinc/17/53/91/1411175391.db2.gz LGKCPUJMIRUANI-GOSISDBHSA-N 2 1 386.565 3.272 20 0 GGADMP CC[C@H]1c2ccsc2CCN1C(=O)C[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000106164663 1411175601 /nfs/dbraw/zinc/17/56/01/1411175601.db2.gz LGKCPUJMIRUANI-SFHVURJKSA-N 2 1 386.565 3.272 20 0 GGADMP Cc1nn(-c2cc(C)ccc2C)c(Cl)c1C[NH2+][C@H](C)CN1CC[NH+](C)CC1 ZINC000106484061 1411224049 /nfs/dbraw/zinc/22/40/49/1411224049.db2.gz YHIRWNNIFRPIAZ-QGZVFWFLSA-N 2 1 389.975 3.176 20 0 GGADMP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+][C@@H](C)CN1CC[NH+](C)CC1 ZINC000106485568 1411224620 /nfs/dbraw/zinc/22/46/20/1411224620.db2.gz YGQKLRZHHAUBIH-KRWDZBQOSA-N 2 1 389.975 3.375 20 0 GGADMP C[C@H](CN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2cccc(Br)c2)o1 ZINC000106485518 1411224706 /nfs/dbraw/zinc/22/47/06/1411224706.db2.gz LQVNDPBPOKCBQJ-OAHLLOKOSA-N 2 1 392.341 3.435 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)CC1 ZINC000106526879 1411233904 /nfs/dbraw/zinc/23/39/04/1411233904.db2.gz ZADCXGQHDDVRBX-OAQYLSRUSA-N 2 1 384.568 3.276 20 0 GGADMP CCC[NH+]1CCC(NC(=O)N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000107329965 1411361066 /nfs/dbraw/zinc/36/10/66/1411361066.db2.gz COPOIFNLXFJQAZ-UHFFFAOYSA-N 2 1 392.975 3.432 20 0 GGADMP CCC[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000107329965 1411361072 /nfs/dbraw/zinc/36/10/72/1411361072.db2.gz COPOIFNLXFJQAZ-UHFFFAOYSA-N 2 1 392.975 3.432 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(C(=O)Nc4ccccc4)cc3)C2)CC1 ZINC000107372006 1411366502 /nfs/dbraw/zinc/36/65/02/1411366502.db2.gz VWFUKPKQBRKMBJ-HSZRJFAPSA-N 2 1 392.547 3.151 20 0 GGADMP CC1CCN(Cc2csc(NC(=O)CN(C)CCC3CCOCC3)n2)CC1 ZINC000177030280 1428560897 /nfs/dbraw/zinc/56/08/97/1428560897.db2.gz PXCYGOZVYZBQIB-UHFFFAOYSA-N 2 1 394.585 3.062 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc4ccccc4o3)c2)C1 ZINC000108420676 1411495194 /nfs/dbraw/zinc/49/51/94/1411495194.db2.gz XHGKPMDMILTFIT-FQEVSTJZSA-N 2 1 377.488 3.420 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(F)c(F)c(F)c3)c2)C1 ZINC000108420928 1411495409 /nfs/dbraw/zinc/49/54/09/1411495409.db2.gz OAQBDENIXYTDAM-QGZVFWFLSA-N 2 1 391.437 3.091 20 0 GGADMP CCOc1ccccc1C[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000108420632 1411496286 /nfs/dbraw/zinc/49/62/86/1411496286.db2.gz FMQAFOJRQWBLPQ-OAQYLSRUSA-N 2 1 381.520 3.072 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(Cl)c(F)c3)c2)C1 ZINC000108421066 1411497303 /nfs/dbraw/zinc/49/73/03/1411497303.db2.gz VLXXJTNUVMEAHI-SFHVURJKSA-N 2 1 389.902 3.466 20 0 GGADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)o1 ZINC000108421043 1411497500 /nfs/dbraw/zinc/49/75/00/1411497500.db2.gz PLKFTQKYSKPCIQ-LKUPVBHCSA-N 2 1 381.520 3.390 20 0 GGADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)o1 ZINC000108421043 1411497508 /nfs/dbraw/zinc/49/75/08/1411497508.db2.gz PLKFTQKYSKPCIQ-LKUPVBHCSA-N 2 1 381.520 3.390 20 0 GGADMP O=S(=O)(CCC[NH+]1CCC(C[NH+]2CCCCCC2)CC1)c1ccccc1 ZINC000108444829 1411503128 /nfs/dbraw/zinc/50/31/28/1411503128.db2.gz DCKKGWHUNUISGF-UHFFFAOYSA-N 2 1 378.582 3.438 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)NC[C@H]2CCC[N@@H+](C)C2)c2cccs2)CC1 ZINC000108541056 1411533328 /nfs/dbraw/zinc/53/33/28/1411533328.db2.gz UYVUXMLQNIJLIP-MSOLQXFVSA-N 2 1 378.586 3.162 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1Cl ZINC000108541062 1411533958 /nfs/dbraw/zinc/53/39/58/1411533958.db2.gz FOTUHLZTWYQUPG-LPHOPBHVSA-N 2 1 380.964 3.364 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CCC[N@@H+](C)C3)cc2)C1 ZINC000108551650 1411537237 /nfs/dbraw/zinc/53/72/37/1411537237.db2.gz DTQFTFNIQNVNTE-KNKQGSTJSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)NC[C@@H]3CCC[NH+](C)C3)cc2)C1 ZINC000108551644 1411537312 /nfs/dbraw/zinc/53/73/12/1411537312.db2.gz DTQFTFNIQNVNTE-JQVVWYNYSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CCC[N@H+](C)C3)cc2)C1 ZINC000108551644 1411537317 /nfs/dbraw/zinc/53/73/17/1411537317.db2.gz DTQFTFNIQNVNTE-JQVVWYNYSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CCC[N@@H+](C)C3)cc2)C1 ZINC000108551644 1411537324 /nfs/dbraw/zinc/53/73/24/1411537324.db2.gz DTQFTFNIQNVNTE-JQVVWYNYSA-N 2 1 386.584 3.306 20 0 GGADMP C[N@@H+](CCNC(=O)N1CCC[NH+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000108811125 1411619775 /nfs/dbraw/zinc/61/97/75/1411619775.db2.gz BGYPLPRTHWRQHI-UHFFFAOYSA-N 2 1 380.536 3.036 20 0 GGADMP C[NH+](CCNC(=O)N1CCC[N@H+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000108811125 1411619799 /nfs/dbraw/zinc/61/97/99/1411619799.db2.gz BGYPLPRTHWRQHI-UHFFFAOYSA-N 2 1 380.536 3.036 20 0 GGADMP C[NH+](CCNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000108811125 1411619809 /nfs/dbraw/zinc/61/98/09/1411619809.db2.gz BGYPLPRTHWRQHI-UHFFFAOYSA-N 2 1 380.536 3.036 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](CCSc3ccccc3F)CC2)CC1 ZINC000108873290 1411627909 /nfs/dbraw/zinc/62/79/09/1411627909.db2.gz HRGAPFIZOFYVIT-UHFFFAOYSA-N 2 1 393.572 3.184 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000108873090 1411628212 /nfs/dbraw/zinc/62/82/12/1411628212.db2.gz NKLQUNZEFCUKQS-UHFFFAOYSA-N 2 1 397.485 3.472 20 0 GGADMP C[NH+](C)CCCOC1CCN(C(=O)[C@@H]2CCCC[N@H+]2Cc2ccccc2)CC1 ZINC000177084279 1428582789 /nfs/dbraw/zinc/58/27/89/1428582789.db2.gz FSTVFAUSKFHKJT-QFIPXVFZSA-N 2 1 387.568 3.000 20 0 GGADMP COc1cccc([C@@H](CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)[NH+](C)C)c1 ZINC000108930323 1411642205 /nfs/dbraw/zinc/64/22/05/1411642205.db2.gz JZIAUWWPMDYUFU-FCHUYYIVSA-N 2 1 381.520 3.079 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000109269024 1411729303 /nfs/dbraw/zinc/72/93/03/1411729303.db2.gz HAIBMALOVZZFSL-QHCPKHFHSA-N 2 1 393.531 3.164 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000109269024 1411729304 /nfs/dbraw/zinc/72/93/04/1411729304.db2.gz HAIBMALOVZZFSL-QHCPKHFHSA-N 2 1 393.531 3.164 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)c1ccccc1 ZINC000109339901 1411744680 /nfs/dbraw/zinc/74/46/80/1411744680.db2.gz MUOVOAQYHMHEFD-IRLDBZIGSA-N 2 1 383.511 3.457 20 0 GGADMP C[C@H](C(=O)N1c2ccccc2C[C@H]1C)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110429267 1411850408 /nfs/dbraw/zinc/85/04/08/1411850408.db2.gz QDEGEESSVOOZDZ-YSTOQKLRSA-N 2 1 399.579 3.174 20 0 GGADMP C[C@H](C(=O)N1c2ccccc2C[C@@H]1C)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110429270 1411850425 /nfs/dbraw/zinc/85/04/25/1411850425.db2.gz QDEGEESSVOOZDZ-VNTMZGSJSA-N 2 1 399.579 3.174 20 0 GGADMP CCC[NH+]1CCC(NC(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000110480826 1411852286 /nfs/dbraw/zinc/85/22/86/1411852286.db2.gz UJIIZNDEWJGHLX-FQEVSTJZSA-N 2 1 397.485 3.432 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110552477 1411857059 /nfs/dbraw/zinc/85/70/59/1411857059.db2.gz LXWNZJDXXUFUIT-BBWFWOEESA-N 2 1 393.959 3.488 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110552477 1411857060 /nfs/dbraw/zinc/85/70/60/1411857060.db2.gz LXWNZJDXXUFUIT-BBWFWOEESA-N 2 1 393.959 3.488 20 0 GGADMP COc1cc2[nH+]c(NCc3ccccc3C[NH+]3CCCC3)nc(N)c2cc1OC ZINC000111106145 1411887471 /nfs/dbraw/zinc/88/74/71/1411887471.db2.gz WNGYIJMXNCZPMH-UHFFFAOYSA-N 2 1 393.491 3.437 20 0 GGADMP Cc1nc(C[NH+]2CCC(CNC(=O)[C@@H](C(C)C)[NH+]3CCCCC3)CC2)oc1C ZINC000111155219 1411891972 /nfs/dbraw/zinc/89/19/72/1411891972.db2.gz JKJRGRKUULMZOT-OAQYLSRUSA-N 2 1 390.572 3.130 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H](C(=O)NC3CC3)c3ccccc3)CC2)oc1C ZINC000111377247 1411934053 /nfs/dbraw/zinc/93/40/53/1411934053.db2.gz OLABCPFASBDCRN-JOCHJYFZSA-N 2 1 396.535 3.113 20 0 GGADMP Cc1nn(-c2ccc(F)cc2)c(Cl)c1C[NH2+]CCCC[N@H+]1CCC[C@H]1CO ZINC000111386808 1411937872 /nfs/dbraw/zinc/93/78/72/1411937872.db2.gz KVJNUIQAGFEODU-SFHVURJKSA-N 2 1 394.922 3.300 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc(C(=O)NC)cc3)CC2)cs1 ZINC000111397410 1411939831 /nfs/dbraw/zinc/93/98/31/1411939831.db2.gz XHLNNZLKANOXPK-UHFFFAOYSA-N 2 1 386.565 3.067 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cs1 ZINC000111646517 1412007497 /nfs/dbraw/zinc/00/74/97/1412007497.db2.gz PAOCPDIQIDRNLQ-BBWFWOEESA-N 2 1 392.613 3.295 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cs1 ZINC000111646517 1412007506 /nfs/dbraw/zinc/00/75/06/1412007506.db2.gz PAOCPDIQIDRNLQ-BBWFWOEESA-N 2 1 392.613 3.295 20 0 GGADMP O=C(C[N@H+]1CCS[C@H]2CCCC[C@@H]21)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000177188718 1428622199 /nfs/dbraw/zinc/62/21/99/1428622199.db2.gz ZIOKKECBHSEBPG-SFTDATJTSA-N 2 1 387.593 3.259 20 0 GGADMP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](CCCc2nc(-c3ccccc3)no2)CC1 ZINC000112649191 1412186541 /nfs/dbraw/zinc/18/65/41/1412186541.db2.gz MMJHZPMPYXIYEX-PMACEKPBSA-N 2 1 397.567 3.160 20 0 GGADMP COc1ccc(C[NH+](C)C/C=C/C[N@H+](C)Cc2ccc(OC)c(O)c2)cc1O ZINC000177219572 1428637754 /nfs/dbraw/zinc/63/77/54/1428637754.db2.gz ZINHTPJTHKVYDE-AATRIKPKSA-N 2 1 386.492 3.235 20 0 GGADMP Cc1ccc([C@H](OC[C@H](O)C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c2ccccc2)cc1 ZINC000113515345 1412310935 /nfs/dbraw/zinc/31/09/35/1412310935.db2.gz WIFRYPABMYXVDI-AGILITTLSA-N 2 1 382.548 3.345 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000113616501 1412321975 /nfs/dbraw/zinc/32/19/75/1412321975.db2.gz AIRRYDQIEJJXQR-NRFANRHFSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000113934124 1412354215 /nfs/dbraw/zinc/35/42/15/1412354215.db2.gz HPQYKVVMDPSWCF-RTBURBONSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000113934124 1412354221 /nfs/dbraw/zinc/35/42/21/1412354221.db2.gz HPQYKVVMDPSWCF-RTBURBONSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000113934124 1412354227 /nfs/dbraw/zinc/35/42/27/1412354227.db2.gz HPQYKVVMDPSWCF-RTBURBONSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000113934591 1412354767 /nfs/dbraw/zinc/35/47/67/1412354767.db2.gz GLRWYKGFNZIYHT-QZTJIDSGSA-N 2 1 387.524 3.330 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000113934591 1412354770 /nfs/dbraw/zinc/35/47/70/1412354770.db2.gz GLRWYKGFNZIYHT-QZTJIDSGSA-N 2 1 387.524 3.330 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000113934591 1412354774 /nfs/dbraw/zinc/35/47/74/1412354774.db2.gz GLRWYKGFNZIYHT-QZTJIDSGSA-N 2 1 387.524 3.330 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+](C)Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000114454274 1412436766 /nfs/dbraw/zinc/43/67/66/1412436766.db2.gz KDSXMBUEFVGVJO-UHFFFAOYSA-N 2 1 387.446 3.006 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+](C)Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000114454274 1412436770 /nfs/dbraw/zinc/43/67/70/1412436770.db2.gz KDSXMBUEFVGVJO-UHFFFAOYSA-N 2 1 387.446 3.006 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)CC1 ZINC000114475635 1412441041 /nfs/dbraw/zinc/44/10/41/1412441041.db2.gz ITBPADOHYTXHMF-UHFFFAOYSA-N 2 1 396.579 3.497 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2cc(C(C)(C)C)nn2C)CC1 ZINC000114475751 1412441261 /nfs/dbraw/zinc/44/12/61/1412441261.db2.gz KYSJYHBPPBWMFU-UHFFFAOYSA-N 2 1 377.577 3.100 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2cc(C(C)(C)C)nn2C)CC1 ZINC000114475751 1412441265 /nfs/dbraw/zinc/44/12/65/1412441265.db2.gz KYSJYHBPPBWMFU-UHFFFAOYSA-N 2 1 377.577 3.100 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)CC1 ZINC000114475722 1412441284 /nfs/dbraw/zinc/44/12/84/1412441284.db2.gz UFLUCEBGYXVMIN-QGZVFWFLSA-N 2 1 388.556 3.416 20 0 GGADMP CC[NH+]1CCC(NC(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000114583493 1412467371 /nfs/dbraw/zinc/46/73/71/1412467371.db2.gz CMBXNMOSFSMAHX-GOSISDBHSA-N 2 1 398.473 3.063 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)[NH+](C)C1CC1 ZINC000114595833 1412471016 /nfs/dbraw/zinc/47/10/16/1412471016.db2.gz RORHDVDAQQQLHH-WMLDXEAASA-N 2 1 398.473 3.062 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1)[N@H+](C)C1CC1 ZINC000114595833 1412471023 /nfs/dbraw/zinc/47/10/23/1412471023.db2.gz RORHDVDAQQQLHH-WMLDXEAASA-N 2 1 398.473 3.062 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1)[N@@H+](C)C1CC1 ZINC000114595833 1412471028 /nfs/dbraw/zinc/47/10/28/1412471028.db2.gz RORHDVDAQQQLHH-WMLDXEAASA-N 2 1 398.473 3.062 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)C1 ZINC000114604125 1412472345 /nfs/dbraw/zinc/47/23/45/1412472345.db2.gz WPLNQHBZOHTOFG-QZTJIDSGSA-N 2 1 398.473 3.015 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCN(CC(F)(F)F)C2=O)C1 ZINC000114748173 1412517957 /nfs/dbraw/zinc/51/79/57/1412517957.db2.gz JEPHLZYGPJKGAI-JTDSTZFVSA-N 2 1 397.485 3.417 20 0 GGADMP Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000114752847 1412519321 /nfs/dbraw/zinc/51/93/21/1412519321.db2.gz NCSONGFYZMKRQQ-RDJZCZTQSA-N 2 1 384.524 3.111 20 0 GGADMP Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000114752845 1412519585 /nfs/dbraw/zinc/51/95/85/1412519585.db2.gz NCSONGFYZMKRQQ-WBVHZDCISA-N 2 1 384.524 3.111 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N(C)C[C@H]3CCC[N@@H+](C)C3)cc2)CC1 ZINC000115794829 1412790945 /nfs/dbraw/zinc/79/09/45/1412790945.db2.gz YDKBHNXBQPZZHH-QFIPXVFZSA-N 2 1 386.584 3.402 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c2ccccc2)CC1 ZINC000115806802 1412794606 /nfs/dbraw/zinc/79/46/06/1412794606.db2.gz PEIYDXJBFUYBPF-IRLDBZIGSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc2)C[C@H](C)O1 ZINC000116129636 1412834771 /nfs/dbraw/zinc/83/47/71/1412834771.db2.gz XZEHIQCVIJCZNF-UEXGIBASSA-N 2 1 389.584 3.392 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc2)C[C@H](C)O1 ZINC000116129636 1412834775 /nfs/dbraw/zinc/83/47/75/1412834775.db2.gz XZEHIQCVIJCZNF-UEXGIBASSA-N 2 1 389.584 3.392 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@H](c2ccco2)[NH+](C)C)CC1 ZINC000116521057 1412871401 /nfs/dbraw/zinc/87/14/01/1412871401.db2.gz IQNZBWIIQVJCFW-YLJYHZDGSA-N 2 1 384.524 3.407 20 0 GGADMP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@H](c2ccco2)[NH+](C)C)CC1 ZINC000116521054 1412871486 /nfs/dbraw/zinc/87/14/86/1412871486.db2.gz IQNZBWIIQVJCFW-FXAWDEMLSA-N 2 1 384.524 3.407 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000116540950 1412874547 /nfs/dbraw/zinc/87/45/47/1412874547.db2.gz SHJWLEYXBKTLNV-ZWKOTPCHSA-N 2 1 383.540 3.352 20 0 GGADMP COc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000177318286 1428685613 /nfs/dbraw/zinc/68/56/13/1428685613.db2.gz ZISMVNXFCKHMOM-UWJYYQICSA-N 2 1 381.520 3.243 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](CCc2ccc(Cl)cc2)CC2CC2)CC1 ZINC000116995035 1412974131 /nfs/dbraw/zinc/97/41/31/1412974131.db2.gz ZUGNCAZYPVLYPU-UHFFFAOYSA-N 2 1 377.960 3.195 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C2CCN(C(=O)OC(C)(C)C)CC2)[C@H](C)C1 ZINC000177343132 1428699975 /nfs/dbraw/zinc/69/99/75/1428699975.db2.gz NWMSURNWAOBDQT-MJGOQNOKSA-N 2 1 383.577 3.113 20 0 GGADMP C[C@H](c1ccc(NC(=O)NC2CC[NH+](C(C)(C)C)CC2)cc1)[NH+]1CCOCC1 ZINC000118029542 1413098669 /nfs/dbraw/zinc/09/86/69/1413098669.db2.gz ZDOOCYFJGBAQOK-QGZVFWFLSA-N 2 1 388.556 3.464 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)C[NH+]1CCCCC1 ZINC000118029553 1413098758 /nfs/dbraw/zinc/09/87/58/1413098758.db2.gz AYWUPKFJLZRSSN-MOPGFXCFSA-N 2 1 388.556 3.323 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1)[NH+]1CCC(C)CC1 ZINC000118029496 1413098801 /nfs/dbraw/zinc/09/88/01/1413098801.db2.gz GYSDQKNHVGYRFI-RTBURBONSA-N 2 1 388.556 3.322 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NC2CC[NH+](C(C)(C)C)CC2)cc1)[NH+]1CCOCC1 ZINC000118029539 1413099060 /nfs/dbraw/zinc/09/90/60/1413099060.db2.gz ZDOOCYFJGBAQOK-KRWDZBQOSA-N 2 1 388.556 3.464 20 0 GGADMP CC[C@H]1CCCC[N@@H+]1CCNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000118030288 1413099308 /nfs/dbraw/zinc/09/93/08/1413099308.db2.gz XIHRSFRTEXHVBD-NQIIRXRSSA-N 2 1 388.556 3.466 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000118030288 1413099315 /nfs/dbraw/zinc/09/93/15/1413099315.db2.gz XIHRSFRTEXHVBD-NQIIRXRSSA-N 2 1 388.556 3.466 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCc2ccc(C[NH+](C)C)cc2)cc1)[NH+]1CCOCC1 ZINC000118030971 1413099502 /nfs/dbraw/zinc/09/95/02/1413099502.db2.gz PYTZXXXLSVINBY-GOSISDBHSA-N 2 1 396.535 3.463 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)CC1 ZINC000118031258 1413099755 /nfs/dbraw/zinc/09/97/55/1413099755.db2.gz WEFRDOODZAZMNI-SFHVURJKSA-N 2 1 388.556 3.418 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NCc2ccc(C[NH+](C)C)cc2)cc1)[NH+]1CCOCC1 ZINC000118030969 1413099903 /nfs/dbraw/zinc/09/99/03/1413099903.db2.gz PYTZXXXLSVINBY-SFHVURJKSA-N 2 1 396.535 3.463 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NCCC[NH+]2CCCCCC2)cc1)[NH+]1CCOCC1 ZINC000118032104 1413100627 /nfs/dbraw/zinc/10/06/27/1413100627.db2.gz GVJNGXIUZNHARX-IBGZPJMESA-N 2 1 388.556 3.467 20 0 GGADMP O=C1[C@@H]([NH+]2CCC(OCC[NH+]3CCCC3)CC2)CCN1c1cccc(Cl)c1 ZINC000177362262 1428704449 /nfs/dbraw/zinc/70/44/49/1428704449.db2.gz DZBMDHZKIGWCJR-FQEVSTJZSA-N 2 1 391.943 3.022 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](CCC(=O)Nc3cc(Cl)ccc3Cl)C2)CC1 ZINC000118834606 1413237264 /nfs/dbraw/zinc/23/72/64/1413237264.db2.gz SZNHEDHGOCUZFG-MRXNPFEDSA-N 2 1 399.366 3.034 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000118868257 1413255580 /nfs/dbraw/zinc/25/55/80/1413255580.db2.gz LIQXSBIDVJZQCD-UHFFFAOYSA-N 2 1 383.540 3.091 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000118957995 1413274849 /nfs/dbraw/zinc/27/48/49/1413274849.db2.gz UTKGLNUPHDSTFQ-OALUTQOASA-N 2 1 392.613 3.237 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000118957995 1413274859 /nfs/dbraw/zinc/27/48/59/1413274859.db2.gz UTKGLNUPHDSTFQ-OALUTQOASA-N 2 1 392.613 3.237 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000118957995 1413274867 /nfs/dbraw/zinc/27/48/67/1413274867.db2.gz UTKGLNUPHDSTFQ-OALUTQOASA-N 2 1 392.613 3.237 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(C(=O)OC(C)(C)C)C2)[C@H](C)C1 ZINC000118979960 1413288152 /nfs/dbraw/zinc/28/81/52/1413288152.db2.gz LVZRJOMGYZLEOK-QRVBRYPASA-N 2 1 383.577 3.113 20 0 GGADMP COc1cccc(CCC[NH+]2CCN(CC[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000119033800 1413311416 /nfs/dbraw/zinc/31/14/16/1413311416.db2.gz KHHBMAIIFFCMQG-UHFFFAOYSA-N 2 1 381.564 3.377 20 0 GGADMP C[C@H](CNC(=O)N1CCC(CC[N@H+]2CCCC[C@H]2C)CC1)C[NH+]1CCCC1 ZINC000119109239 1413340378 /nfs/dbraw/zinc/34/03/78/1413340378.db2.gz CGVKUTLCZZJFJX-WOJBJXKFSA-N 2 1 378.605 3.404 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)[NH+]2CCCC2)o1 ZINC000119184793 1413369160 /nfs/dbraw/zinc/36/91/60/1413369160.db2.gz GXVLABOWKLPVCU-OALUTQOASA-N 2 1 376.545 3.002 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](CCC[NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000119270229 1413395002 /nfs/dbraw/zinc/39/50/02/1413395002.db2.gz YQXTYCDIHKOIFC-HXUWFJFHSA-N 2 1 399.510 3.082 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000119270229 1413395008 /nfs/dbraw/zinc/39/50/08/1413395008.db2.gz YQXTYCDIHKOIFC-HXUWFJFHSA-N 2 1 399.510 3.082 20 0 GGADMP C[N@@H+](CC1CC[NH+](C[C@H](O)c2ccccc2)CC1)[C@@H]1Cc2ccccc2[C@@H]1O ZINC000119402901 1413435320 /nfs/dbraw/zinc/43/53/20/1413435320.db2.gz RSJIYFMBSJJNSJ-SGNDLWITSA-N 2 1 380.532 3.022 20 0 GGADMP C[C@H](NC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C[NH+](C)C ZINC000119423859 1413443015 /nfs/dbraw/zinc/44/30/15/1413443015.db2.gz KJQIWPJSARIZHE-IRXDYDNUSA-N 2 1 380.602 3.236 20 0 GGADMP C[C@H]1CN(C(C)(C)C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000119501651 1413467686 /nfs/dbraw/zinc/46/76/86/1413467686.db2.gz JULXDKLXNNKEHG-OALUTQOASA-N 2 1 391.575 3.310 20 0 GGADMP C[C@@H]1CN(C(C)(C)C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C[C@@H](C)O1 ZINC000119501775 1413467928 /nfs/dbraw/zinc/46/79/28/1413467928.db2.gz JULXDKLXNNKEHG-RTBURBONSA-N 2 1 391.575 3.310 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)NCCC2CC[NH+](C)CC2)CC1 ZINC000119503011 1413468446 /nfs/dbraw/zinc/46/84/46/1413468446.db2.gz YTVOLUKIFADKKN-IBGZPJMESA-N 2 1 378.605 3.404 20 0 GGADMP CCCOc1ccc(C[N@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)c(OCCC)c1 ZINC000119582091 1413493289 /nfs/dbraw/zinc/49/32/89/1413493289.db2.gz LMHAMGLPZOYAIQ-OAQYLSRUSA-N 2 1 389.584 3.476 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cn(C)nc3-c3cc4ccccc4o3)C2)CC1 ZINC000119608402 1413502185 /nfs/dbraw/zinc/50/21/85/1413502185.db2.gz ACIQMCTYMDYFHF-HXUWFJFHSA-N 2 1 393.535 3.045 20 0 GGADMP C[NH+](C)C1(C(=O)NC[C@@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CCC1 ZINC000119609386 1413503008 /nfs/dbraw/zinc/50/30/08/1413503008.db2.gz DLAHSQVGOHXHIS-IBGZPJMESA-N 2 1 383.561 3.448 20 0 GGADMP C[NH+](C)C1(C(=O)NC[C@@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CCC1 ZINC000119609386 1413503012 /nfs/dbraw/zinc/50/30/12/1413503012.db2.gz DLAHSQVGOHXHIS-IBGZPJMESA-N 2 1 383.561 3.448 20 0 GGADMP C[C@@]1(CNC(=O)N2CCC([NH+]3CCCC3)CC2)CCC[N@H+]1Cc1ccccc1 ZINC000119632903 1413509678 /nfs/dbraw/zinc/50/96/78/1413509678.db2.gz BYHVQVWJRFTNLZ-QHCPKHFHSA-N 2 1 384.568 3.311 20 0 GGADMP O=C(NC1CC[NH+](C2CCCCC2)CC1)[C@@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000177429776 1428734102 /nfs/dbraw/zinc/73/41/02/1428734102.db2.gz YIYIKMMBFPIOFR-HSZRJFAPSA-N 2 1 399.579 3.098 20 0 GGADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000119714829 1413542685 /nfs/dbraw/zinc/54/26/85/1413542685.db2.gz MVTWCEIASIWVNL-QGZVFWFLSA-N 2 1 391.581 3.139 20 0 GGADMP CC[C@@H](CNC(=O)N(C)CCCn1cc[nH+]c1C)[N@@H+]1CCc2ccccc2C1 ZINC000119902686 1413611670 /nfs/dbraw/zinc/61/16/70/1413611670.db2.gz ONZOBIQVVRTTJZ-NRFANRHFSA-N 2 1 383.540 3.060 20 0 GGADMP CC[C@@H](CNC(=O)N(C)CCCn1cc[nH+]c1C)[N@H+]1CCc2ccccc2C1 ZINC000119902686 1413611673 /nfs/dbraw/zinc/61/16/73/1413611673.db2.gz ONZOBIQVVRTTJZ-NRFANRHFSA-N 2 1 383.540 3.060 20 0 GGADMP CC[C@H](CNC(=O)N(C)CCCn1cc[nH+]c1C)[N@@H+]1CCc2ccccc2C1 ZINC000119902807 1413611743 /nfs/dbraw/zinc/61/17/43/1413611743.db2.gz ONZOBIQVVRTTJZ-OAQYLSRUSA-N 2 1 383.540 3.060 20 0 GGADMP CC[C@H](CNC(=O)N(C)CCCn1cc[nH+]c1C)[N@H+]1CCc2ccccc2C1 ZINC000119902807 1413611746 /nfs/dbraw/zinc/61/17/46/1413611746.db2.gz ONZOBIQVVRTTJZ-OAQYLSRUSA-N 2 1 383.540 3.060 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000120092629 1413684486 /nfs/dbraw/zinc/68/44/86/1413684486.db2.gz LJJMWXZQDFTONW-KRWDZBQOSA-N 2 1 375.542 3.122 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C)C[C@@H]1C)c1cccc(OC)c1 ZINC000120171266 1413716656 /nfs/dbraw/zinc/71/66/56/1413716656.db2.gz QGWSNBMTUZPNMS-IOMROCGXSA-N 2 1 390.572 3.060 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N(C)[C@@H]2CC[NH+](C)C[C@@H]2C)C1 ZINC000120216422 1413734729 /nfs/dbraw/zinc/73/47/29/1413734729.db2.gz NFKOUIQCZAEYKK-XQBPLPMBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)C1 ZINC000120216422 1413734741 /nfs/dbraw/zinc/73/47/41/1413734741.db2.gz NFKOUIQCZAEYKK-XQBPLPMBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)C1 ZINC000120216422 1413734744 /nfs/dbraw/zinc/73/47/44/1413734744.db2.gz NFKOUIQCZAEYKK-XQBPLPMBSA-N 2 1 386.584 3.400 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000120530332 1413837002 /nfs/dbraw/zinc/83/70/02/1413837002.db2.gz GJZCLEOLAIEAKL-GOSISDBHSA-N 2 1 389.569 3.197 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000120530332 1413837003 /nfs/dbraw/zinc/83/70/03/1413837003.db2.gz GJZCLEOLAIEAKL-GOSISDBHSA-N 2 1 389.569 3.197 20 0 GGADMP CCc1noc(C2CCC([NH2+]Cc3ccccc3C[N@H+]3CCC[C@H]3CO)CC2)n1 ZINC000120639218 1413862569 /nfs/dbraw/zinc/86/25/69/1413862569.db2.gz LCMNLIKXIGFITI-JITJBCMDSA-N 2 1 398.551 3.405 20 0 GGADMP O[C@H]1CC[N@@H+](Cc2ccccc2C[NH2+]C2CCN(CCc3ccccc3)CC2)C1 ZINC000120651439 1413866355 /nfs/dbraw/zinc/86/63/55/1413866355.db2.gz IQICZQLWHGKWDB-VWLOTQADSA-N 2 1 393.575 3.050 20 0 GGADMP O[C@H]1CC[N@H+](Cc2ccccc2CNC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000120651439 1413866357 /nfs/dbraw/zinc/86/63/57/1413866357.db2.gz IQICZQLWHGKWDB-VWLOTQADSA-N 2 1 393.575 3.050 20 0 GGADMP O[C@H]1CC[N@@H+](Cc2ccccc2CNC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000120651439 1413866361 /nfs/dbraw/zinc/86/63/61/1413866361.db2.gz IQICZQLWHGKWDB-VWLOTQADSA-N 2 1 393.575 3.050 20 0 GGADMP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000120651439 1413866362 /nfs/dbraw/zinc/86/63/62/1413866362.db2.gz IQICZQLWHGKWDB-VWLOTQADSA-N 3 1 393.575 3.050 20 0 GGADMP O[C@H]1CC[N@@H+](Cc2ccccc2C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000120651439 1413866364 /nfs/dbraw/zinc/86/63/64/1413866364.db2.gz IQICZQLWHGKWDB-VWLOTQADSA-N 3 1 393.575 3.050 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2c(F)cccc2F)N(C)C)[C@H](C)C1 ZINC000120706913 1413880458 /nfs/dbraw/zinc/88/04/58/1413880458.db2.gz OYHIAFIHDVFJOF-UXPWSPDFSA-N 2 1 383.527 3.294 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@@H](c2c(F)cccc2F)N(C)C)[C@H](C)C1 ZINC000120706913 1413880463 /nfs/dbraw/zinc/88/04/63/1413880463.db2.gz OYHIAFIHDVFJOF-UXPWSPDFSA-N 2 1 383.527 3.294 20 0 GGADMP COc1ccc(C[N@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)[C@H](C)C2CC2)cc1 ZINC000120714706 1413882804 /nfs/dbraw/zinc/88/28/04/1413882804.db2.gz RAPDVPPTIKNJLS-GOSISDBHSA-N 2 1 395.551 3.038 20 0 GGADMP COc1ccc(C[N@@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)[C@H](C)C2CC2)cc1 ZINC000120714706 1413882807 /nfs/dbraw/zinc/88/28/07/1413882807.db2.gz RAPDVPPTIKNJLS-GOSISDBHSA-N 2 1 395.551 3.038 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)ccc1S(C)(=O)=O ZINC000120768105 1413897136 /nfs/dbraw/zinc/89/71/36/1413897136.db2.gz PMCHXIWPZMUIBF-INIZCTEOSA-N 2 1 382.570 3.404 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)ccc1S(C)(=O)=O ZINC000120768105 1413897137 /nfs/dbraw/zinc/89/71/37/1413897137.db2.gz PMCHXIWPZMUIBF-INIZCTEOSA-N 2 1 382.570 3.404 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](CCC(=O)Nc3cccc(F)c3)CC2)C[C@H](C)O1 ZINC000177487867 1428764170 /nfs/dbraw/zinc/76/41/70/1428764170.db2.gz CSNOEECKCQBFTD-HDICACEKSA-N 2 1 391.531 3.366 20 0 GGADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000120792503 1413904726 /nfs/dbraw/zinc/90/47/26/1413904726.db2.gz PFVNJYYGSQTSHH-HXUWFJFHSA-N 2 1 375.520 3.425 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000120854551 1413927153 /nfs/dbraw/zinc/92/71/53/1413927153.db2.gz ANPCLYJFQHOOPH-HXUWFJFHSA-N 2 1 387.568 3.145 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000120854551 1413927156 /nfs/dbraw/zinc/92/71/56/1413927156.db2.gz ANPCLYJFQHOOPH-HXUWFJFHSA-N 2 1 387.568 3.145 20 0 GGADMP Cc1nn(C)c(Cl)c1C[NH2+]CCCCN1CC[NH+](Cc2ccccc2)CC1 ZINC000120866109 1413931131 /nfs/dbraw/zinc/93/11/31/1413931131.db2.gz NRHJEIZNXQBOOB-UHFFFAOYSA-N 2 1 389.975 3.070 20 0 GGADMP CCN1CC[NH+](Cc2ccc(C[NH2+]Cc3c[nH]nc3-c3ccc(C)o3)cc2)CC1 ZINC000120996640 1413972392 /nfs/dbraw/zinc/97/23/92/1413972392.db2.gz SSTPDCZMBLCJQQ-UHFFFAOYSA-N 2 1 393.535 3.405 20 0 GGADMP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3nnc(-c4ccccc4)n3C)CC2)C[C@@H](C)O1 ZINC000177500501 1428771402 /nfs/dbraw/zinc/77/14/02/1428771402.db2.gz VYZJHEWORBXQMN-RTBURBONSA-N 2 1 397.567 3.193 20 0 GGADMP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3nnc(-c4ccccc4)n3C)CC2)C[C@H](C)O1 ZINC000177500472 1428771503 /nfs/dbraw/zinc/77/15/03/1428771503.db2.gz VYZJHEWORBXQMN-KDURUIRLSA-N 2 1 397.567 3.193 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3nnc(-c4ccccc4)n3C)CC2)C[C@H](C)O1 ZINC000177500472 1428771510 /nfs/dbraw/zinc/77/15/10/1428771510.db2.gz VYZJHEWORBXQMN-KDURUIRLSA-N 2 1 397.567 3.193 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](CCC(=O)N3CCc4ccccc43)CC2)C[C@H](C)O1 ZINC000177502010 1428772081 /nfs/dbraw/zinc/77/20/81/1428772081.db2.gz KDIJNHDUHWLNCM-BGYRXZFFSA-N 2 1 399.579 3.177 20 0 GGADMP Cc1nn(Cc2ccc(C)cc2)c(C)c1C[N@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000121098106 1414006480 /nfs/dbraw/zinc/00/64/80/1414006480.db2.gz NWDLURFVYABRPF-LJQANCHMSA-N 2 1 398.595 3.381 20 0 GGADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000121114905 1414013182 /nfs/dbraw/zinc/01/31/82/1414013182.db2.gz XBTFFRHKRCYVEE-GOSISDBHSA-N 2 1 389.565 3.110 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1CC[NH+](Cc2cccc3ccccc32)CC1 ZINC000121158191 1414028019 /nfs/dbraw/zinc/02/80/19/1414028019.db2.gz MOPAMQIRZMODQL-IBGZPJMESA-N 2 1 392.547 3.151 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000121164916 1414030287 /nfs/dbraw/zinc/03/02/87/1414030287.db2.gz CQOZCFBEHKUKAL-KRWDZBQOSA-N 2 1 381.586 3.242 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000121164916 1414030292 /nfs/dbraw/zinc/03/02/92/1414030292.db2.gz CQOZCFBEHKUKAL-KRWDZBQOSA-N 2 1 381.586 3.242 20 0 GGADMP C[C@H]1C[NH+](CCC2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)C[C@H](C)O1 ZINC000177509850 1428775723 /nfs/dbraw/zinc/77/57/23/1428775723.db2.gz KWXHGTOEMOTGJU-ROUUACIJSA-N 2 1 384.524 3.448 20 0 GGADMP Cc1ccc(C)c(NC(=O)C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000177510019 1428775850 /nfs/dbraw/zinc/77/58/50/1428775850.db2.gz WWCLZMREBDLDDR-WOJBJXKFSA-N 2 1 387.568 3.453 20 0 GGADMP CNC(=O)c1ccc(C[N@@H+](C)Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000121182964 1414036496 /nfs/dbraw/zinc/03/64/96/1414036496.db2.gz OAZIEJLEOMDTOZ-UHFFFAOYSA-N 2 1 381.520 3.153 20 0 GGADMP C[N@@H+](CCCNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)Cc1ccccc1 ZINC000121185396 1414036934 /nfs/dbraw/zinc/03/69/34/1414036934.db2.gz JBPLWEWCURIYQC-UHFFFAOYSA-N 2 1 398.551 3.408 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)N[C@@H](C)C(C)(C)C[NH+](C)C ZINC000121219784 1414048144 /nfs/dbraw/zinc/04/81/44/1414048144.db2.gz CPIMOPPGYCCBMB-ICSRJNTNSA-N 2 1 389.588 3.054 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N(CC[NH+](C)C)Cc3ccco3)cc2)C[C@@H](C)O1 ZINC000121231890 1414052172 /nfs/dbraw/zinc/05/21/72/1414052172.db2.gz IUDYSOWVLYPHKO-RTBURBONSA-N 2 1 399.535 3.093 20 0 GGADMP CC[C@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)[N@@H+]1CCc2ccccc2C1 ZINC000121251585 1414059387 /nfs/dbraw/zinc/05/93/87/1414059387.db2.gz MQNWJXUXTFNUIA-HXUWFJFHSA-N 2 1 389.503 3.142 20 0 GGADMP CC[C@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)[N@H+]1CCc2ccccc2C1 ZINC000121251585 1414059393 /nfs/dbraw/zinc/05/93/93/1414059393.db2.gz MQNWJXUXTFNUIA-HXUWFJFHSA-N 2 1 389.503 3.142 20 0 GGADMP FC(F)(F)c1ccc2oc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)nc2c1 ZINC000121437996 1414122137 /nfs/dbraw/zinc/12/21/37/1414122137.db2.gz XQHGNNPBJLSNTC-UHFFFAOYSA-N 2 1 383.414 3.391 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000121490723 1414147292 /nfs/dbraw/zinc/14/72/92/1414147292.db2.gz UNXWURKLKFXLSZ-ZIAGYGMSSA-N 2 1 378.904 3.497 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+](C3CC3)[C@H]3CCCc4ccccc43)cn2)CC1 ZINC000121521626 1414161013 /nfs/dbraw/zinc/16/10/13/1414161013.db2.gz IRVDWVNBRQCUAD-QFIPXVFZSA-N 2 1 377.536 3.270 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+](C3CC3)[C@H]3CCCc4ccccc43)cn2)CC1 ZINC000121521626 1414161021 /nfs/dbraw/zinc/16/10/21/1414161021.db2.gz IRVDWVNBRQCUAD-QFIPXVFZSA-N 2 1 377.536 3.270 20 0 GGADMP CCOC(=O)c1cc(C)sc1NC(=O)[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000121642562 1414209918 /nfs/dbraw/zinc/20/99/18/1414209918.db2.gz ABUQQGGKBPGYMK-HNNXBMFYSA-N 2 1 395.569 3.224 20 0 GGADMP CCOC(=O)c1cc(C)sc1NC(=O)[C@@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000121642426 1414210160 /nfs/dbraw/zinc/21/01/60/1414210160.db2.gz ABUQQGGKBPGYMK-OAHLLOKOSA-N 2 1 395.569 3.224 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177557071 1428792512 /nfs/dbraw/zinc/79/25/12/1428792512.db2.gz MDVYGLQWUDTHGK-HXUWFJFHSA-N 2 1 376.589 3.347 20 0 GGADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000121857099 1414280079 /nfs/dbraw/zinc/28/00/79/1414280079.db2.gz ASSLMVTZQSLYHY-LSDHHAIUSA-N 2 1 382.346 3.488 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000121933313 1414312493 /nfs/dbraw/zinc/31/24/93/1414312493.db2.gz BKVJAMOQVPHIBR-RXVVDRJESA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000121933313 1414312501 /nfs/dbraw/zinc/31/25/01/1414312501.db2.gz BKVJAMOQVPHIBR-RXVVDRJESA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000121933191 1414312864 /nfs/dbraw/zinc/31/28/64/1414312864.db2.gz BKVJAMOQVPHIBR-GHTZIAJQSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000121933191 1414312872 /nfs/dbraw/zinc/31/28/72/1414312872.db2.gz BKVJAMOQVPHIBR-GHTZIAJQSA-N 2 1 383.540 3.134 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]CC(C)(C)[NH+]2CCCCC2)c(OC)c1 ZINC000121943568 1414316976 /nfs/dbraw/zinc/31/69/76/1414316976.db2.gz VMRNTEMTTIQFEN-MRXNPFEDSA-N 2 1 377.529 3.275 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]CC(C)(C)[NH+]2CCCCC2)c(OC)c1 ZINC000121943398 1414317181 /nfs/dbraw/zinc/31/71/81/1414317181.db2.gz VMRNTEMTTIQFEN-INIZCTEOSA-N 2 1 377.529 3.275 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](CC(=O)Nc2ccc(C)cc2C)CC1 ZINC000122044061 1414347491 /nfs/dbraw/zinc/34/74/91/1414347491.db2.gz YDVKXFHWTOCTKK-UHFFFAOYSA-N 2 1 375.557 3.312 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2nc3ccccc3c(=O)[nH]2)CC1 ZINC000122054272 1414350519 /nfs/dbraw/zinc/35/05/19/1414350519.db2.gz QKKDYBNBCMXQSE-QGZVFWFLSA-N 2 1 386.540 3.055 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)c2nc3ccccc3c(=O)[nH]2)CC1 ZINC000122054272 1414350528 /nfs/dbraw/zinc/35/05/28/1414350528.db2.gz QKKDYBNBCMXQSE-QGZVFWFLSA-N 2 1 386.540 3.055 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(F)c2)CC1 ZINC000122118163 1414366589 /nfs/dbraw/zinc/36/65/89/1414366589.db2.gz LLAKETLILNRQIS-KRWDZBQOSA-N 2 1 379.520 3.223 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2cc(F)ccc2F)CC1 ZINC000122118612 1414366697 /nfs/dbraw/zinc/36/66/97/1414366697.db2.gz HQEJTMUSCIBCSX-INIZCTEOSA-N 2 1 397.510 3.362 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2cc(F)ccc2F)CC1 ZINC000122118612 1414366704 /nfs/dbraw/zinc/36/67/04/1414366704.db2.gz HQEJTMUSCIBCSX-INIZCTEOSA-N 2 1 397.510 3.362 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](Cc2nc(-c3ccc(F)cc3)no2)CC1 ZINC000122133285 1414370118 /nfs/dbraw/zinc/37/01/18/1414370118.db2.gz MUSOQUWLGZIVBN-UHFFFAOYSA-N 2 1 390.503 3.446 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2nc(-c3ccc(F)cc3)no2)CC1 ZINC000122133285 1414370124 /nfs/dbraw/zinc/37/01/24/1414370124.db2.gz MUSOQUWLGZIVBN-UHFFFAOYSA-N 2 1 390.503 3.446 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)N2CCc3ccccc32)CC1 ZINC000122136149 1414370892 /nfs/dbraw/zinc/37/08/92/1414370892.db2.gz XCCBGBCLDOPDQH-IBGZPJMESA-N 2 1 387.568 3.035 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(Cl)c1COC ZINC000122141523 1414372147 /nfs/dbraw/zinc/37/21/47/1414372147.db2.gz PAXYBIIEDUZERX-INIZCTEOSA-N 2 1 396.963 3.366 20 0 GGADMP O=C(COc1ccccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1)NCC1CC1 ZINC000177583233 1428802991 /nfs/dbraw/zinc/80/29/91/1428802991.db2.gz QMQGRJXOXUVKQG-UHFFFAOYSA-N 2 1 399.579 3.478 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1)C1CC1 ZINC000122264731 1414405535 /nfs/dbraw/zinc/40/55/35/1414405535.db2.gz WKAJZZPWROYKKD-PKTZIBPZSA-N 2 1 399.579 3.169 20 0 GGADMP CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCOCC1 ZINC000122800680 1414568143 /nfs/dbraw/zinc/56/81/43/1414568143.db2.gz WFZXHLNFDAWSTK-PMACEKPBSA-N 2 1 389.540 3.054 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccc3c(c2)OCO3)[C@H](C)C1 ZINC000122815895 1414572099 /nfs/dbraw/zinc/57/20/99/1414572099.db2.gz MBYKHLLMAZSFGO-IEBWSBKVSA-N 2 1 376.541 3.420 20 0 GGADMP CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000122915272 1414595561 /nfs/dbraw/zinc/59/55/61/1414595561.db2.gz XKRNHKCRZUGBIC-ROUUACIJSA-N 2 1 381.561 3.057 20 0 GGADMP Cc1c(C(=O)N(C)CCN(C)C2CC[NH+](C)CC2)sc2cccc(F)c12 ZINC000122939504 1414601378 /nfs/dbraw/zinc/60/13/78/1414601378.db2.gz YDKUNPQRJDNRPP-UHFFFAOYSA-N 2 1 377.529 3.447 20 0 GGADMP O=C(NC1CC[NH+](Cc2cccnc2)CC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000177646011 1428821583 /nfs/dbraw/zinc/82/15/83/1428821583.db2.gz AACRQSKXDLASNM-JOCHJYFZSA-N 2 1 392.547 3.074 20 0 GGADMP COc1ccc2cc([C@H](C)C(=O)N(C)CCN(C)C3CC[NH+](C)CC3)ccc2c1 ZINC000122976531 1414610754 /nfs/dbraw/zinc/61/07/54/1414610754.db2.gz ZJBFGZAGCXOZTF-SFHVURJKSA-N 2 1 397.563 3.436 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000123190214 1414664449 /nfs/dbraw/zinc/66/44/49/1414664449.db2.gz HUWSYMKMYSXKPZ-JOCHJYFZSA-N 2 1 380.536 3.212 20 0 GGADMP Cn1cc[nH+]c1CC1CCN(C(=O)NCCC[N@H+](C)C2CCCCC2)CC1 ZINC000123396134 1414714826 /nfs/dbraw/zinc/71/48/26/1414714826.db2.gz MNJIHELJFKPUDR-UHFFFAOYSA-N 2 1 375.561 3.039 20 0 GGADMP Cn1cc[nH+]c1CC1CCN(C(=O)NCCC[N@@H+](C)C2CCCCC2)CC1 ZINC000123396134 1414714838 /nfs/dbraw/zinc/71/48/38/1414714838.db2.gz MNJIHELJFKPUDR-UHFFFAOYSA-N 2 1 375.561 3.039 20 0 GGADMP C[N@@H+](CCCNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)C1CCCCC1 ZINC000123393811 1414714892 /nfs/dbraw/zinc/71/48/92/1414714892.db2.gz IYZHQYDHJZEEMV-NQIIRXRSSA-N 2 1 376.589 3.299 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C1CCCCC1 ZINC000123393811 1414714903 /nfs/dbraw/zinc/71/49/03/1414714903.db2.gz IYZHQYDHJZEEMV-NQIIRXRSSA-N 2 1 376.589 3.299 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)C1CCCCC1 ZINC000123393811 1414714907 /nfs/dbraw/zinc/71/49/07/1414714907.db2.gz IYZHQYDHJZEEMV-NQIIRXRSSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)[NH+]1CCc2ccccc2C1 ZINC000123441230 1414732752 /nfs/dbraw/zinc/73/27/52/1414732752.db2.gz UDGSMZSBTXMWDN-AAIMPIBUSA-N 2 1 396.579 3.092 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000123441230 1414732767 /nfs/dbraw/zinc/73/27/67/1414732767.db2.gz UDGSMZSBTXMWDN-AAIMPIBUSA-N 2 1 396.579 3.092 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000123441230 1414732778 /nfs/dbraw/zinc/73/27/78/1414732778.db2.gz UDGSMZSBTXMWDN-AAIMPIBUSA-N 2 1 396.579 3.092 20 0 GGADMP C[C@H](C(=O)Nc1ccc(OC(F)F)cc1)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000123555647 1414772835 /nfs/dbraw/zinc/77/28/35/1414772835.db2.gz FTPHAGOMPOVHMK-HUUCEWRRSA-N 2 1 392.450 3.303 20 0 GGADMP C[C@@H](C(=O)Nc1cccc2ncccc21)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123772978 1414822816 /nfs/dbraw/zinc/82/28/16/1414822816.db2.gz JTFHTRRXKUOELO-DLBZAZTESA-N 2 1 377.492 3.250 20 0 GGADMP C[C@@H](C(=O)Nc1cccc2ncccc21)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123772978 1414822818 /nfs/dbraw/zinc/82/28/18/1414822818.db2.gz JTFHTRRXKUOELO-DLBZAZTESA-N 2 1 377.492 3.250 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000123834267 1414831957 /nfs/dbraw/zinc/83/19/57/1414831957.db2.gz YCPNHNYCVPBRML-GGAORHGYSA-N 2 1 396.579 3.093 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000123834267 1414831959 /nfs/dbraw/zinc/83/19/59/1414831959.db2.gz YCPNHNYCVPBRML-GGAORHGYSA-N 2 1 396.579 3.093 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000123834267 1414831965 /nfs/dbraw/zinc/83/19/65/1414831965.db2.gz YCPNHNYCVPBRML-GGAORHGYSA-N 2 1 396.579 3.093 20 0 GGADMP C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123847936 1414834339 /nfs/dbraw/zinc/83/43/39/1414834339.db2.gz YCVLCTJVDZRKEO-JKYHGXDQSA-N 2 1 384.568 3.148 20 0 GGADMP C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123847936 1414834342 /nfs/dbraw/zinc/83/43/42/1414834342.db2.gz YCVLCTJVDZRKEO-JKYHGXDQSA-N 2 1 384.568 3.148 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000123860271 1414836702 /nfs/dbraw/zinc/83/67/02/1414836702.db2.gz FBNZUJJQHVGPHL-GGAORHGYSA-N 2 1 396.579 3.441 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000123860699 1414837389 /nfs/dbraw/zinc/83/73/89/1414837389.db2.gz FBNZUJJQHVGPHL-GMAHTHKFSA-N 2 1 396.579 3.441 20 0 GGADMP CC[C@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000123922161 1414850670 /nfs/dbraw/zinc/85/06/70/1414850670.db2.gz BJMRILBPXDCZQJ-XZOQPEGZSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000123922161 1414850675 /nfs/dbraw/zinc/85/06/75/1414850675.db2.gz BJMRILBPXDCZQJ-XZOQPEGZSA-N 2 1 395.547 3.158 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(NS(C)(=O)=O)cc2)c1 ZINC000123940795 1414853694 /nfs/dbraw/zinc/85/36/94/1414853694.db2.gz JJTKFJSRXOWWPR-MRXNPFEDSA-N 2 1 375.538 3.361 20 0 GGADMP CC(C)[C@@H](CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)[NH+]1CCC(C)CC1 ZINC000124003996 1414866807 /nfs/dbraw/zinc/86/68/07/1414866807.db2.gz OADVOVNKXAMBOJ-HXUWFJFHSA-N 2 1 389.588 3.141 20 0 GGADMP C[C@H](C[NH+]1CCCCC1)NC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000124075249 1414880930 /nfs/dbraw/zinc/88/09/30/1414880930.db2.gz HIKAOQLEXNITSV-MRXNPFEDSA-N 2 1 394.510 3.103 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)N2N=C(c3ccco3)C[C@@H]2c2ccco2)CC1 ZINC000124155009 1414897182 /nfs/dbraw/zinc/89/71/82/1414897182.db2.gz BCFPCTGXNLUXRR-LJQANCHMSA-N 2 1 398.507 3.214 20 0 GGADMP CCC[N@H+]1CCC[C@H]1C(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCC2)cc1 ZINC000124319090 1414938037 /nfs/dbraw/zinc/93/80/37/1414938037.db2.gz HJEAFNUYOOECPB-FQEVSTJZSA-N 2 1 386.540 3.314 20 0 GGADMP COc1cc([C@@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)ccc1OC(F)F ZINC000124373287 1414951391 /nfs/dbraw/zinc/95/13/91/1414951391.db2.gz XVUPYPGJMXKWQH-OAHLLOKOSA-N 2 1 385.499 3.221 20 0 GGADMP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CC1CCN(CC[NH+](C)C)CC1 ZINC000124466083 1414975021 /nfs/dbraw/zinc/97/50/21/1414975021.db2.gz UEWXCJKTNUXLEZ-INIZCTEOSA-N 2 1 387.597 3.438 20 0 GGADMP C[NH+](C)CCN(C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)C1CCCC1 ZINC000124509557 1414984153 /nfs/dbraw/zinc/98/41/53/1414984153.db2.gz POVRNDNDWKDZKW-NRFANRHFSA-N 2 1 386.584 3.067 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C[NH2+]C3CCN(CC(F)F)CC3)cc2)C[C@H](C)O1 ZINC000124610182 1415004802 /nfs/dbraw/zinc/00/48/02/1415004802.db2.gz OPFILKHKEHTSIO-CALCHBBNSA-N 2 1 381.511 3.115 20 0 GGADMP O=C(NCc1ccn2ccnc2c1)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000177791697 1428859341 /nfs/dbraw/zinc/85/93/41/1428859341.db2.gz HWPUFVXDAMXFDQ-UHFFFAOYSA-N 2 1 391.519 3.184 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000124912638 1415071263 /nfs/dbraw/zinc/07/12/63/1415071263.db2.gz GPTRVFFGKZYZNI-PZJWPPBQSA-N 2 1 376.589 3.157 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1 ZINC000125003026 1415090228 /nfs/dbraw/zinc/09/02/28/1415090228.db2.gz USUUVZLWWJWUER-OAQYLSRUSA-N 2 1 376.541 3.372 20 0 GGADMP C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125014351 1415092036 /nfs/dbraw/zinc/09/20/36/1415092036.db2.gz XSAUVQWHTOPGHJ-UUOWRZLLSA-N 2 1 393.531 3.371 20 0 GGADMP CC[C@H](Cc1ccccc1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125033499 1415095595 /nfs/dbraw/zinc/09/55/95/1415095595.db2.gz IZBORGDWBOYZQQ-JOCHJYFZSA-N 2 1 395.547 3.458 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000177818201 1428864266 /nfs/dbraw/zinc/86/42/66/1428864266.db2.gz UICSTGAHBVQGKQ-UHFFFAOYSA-N 2 1 381.586 3.070 20 0 GGADMP C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N2CCC(Cc3[nH+]ccn3C)CC2)C1 ZINC000125277735 1415150600 /nfs/dbraw/zinc/15/06/00/1415150600.db2.gz FMOWBTRJGJWCPB-ROUUACIJSA-N 2 1 389.588 3.141 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000177871260 1428878796 /nfs/dbraw/zinc/87/87/96/1428878796.db2.gz ZJAFRTJRZMJZHB-QFIPXVFZSA-N 2 1 386.584 3.402 20 0 GGADMP O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000125498442 1415214736 /nfs/dbraw/zinc/21/47/36/1415214736.db2.gz XEVCYNKJLMCWJR-NQIIRXRSSA-N 2 1 379.508 3.031 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCn2cnc3ccccc3c2=O)CC1 ZINC000177867815 1428877795 /nfs/dbraw/zinc/87/77/95/1428877795.db2.gz WVGBJZJHFWTLHC-LJQANCHMSA-N 2 1 382.552 3.373 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)C1 ZINC000125633793 1415242257 /nfs/dbraw/zinc/24/22/57/1415242257.db2.gz FMWMIPVBWRMJNZ-FQEVSTJZSA-N 2 1 378.605 3.308 20 0 GGADMP C[N@@H+](CC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)[C@@H]1CCSC1 ZINC000125668947 1415250352 /nfs/dbraw/zinc/25/03/52/1415250352.db2.gz ZSYMGKXSBJSUSX-HXUWFJFHSA-N 2 1 375.582 3.116 20 0 GGADMP C[C@@H]1CN(C(=O)c2ccc(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000177922844 1428892152 /nfs/dbraw/zinc/89/21/52/1428892152.db2.gz XDJBWNUKJQAMRD-HDICACEKSA-N 2 1 387.568 3.289 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125791515 1415281554 /nfs/dbraw/zinc/28/15/54/1415281554.db2.gz PNMOXHKRGRJNBY-OALUTQOASA-N 2 1 395.613 3.488 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125791674 1415282109 /nfs/dbraw/zinc/28/21/09/1415282109.db2.gz PNMOXHKRGRJNBY-RTBURBONSA-N 2 1 395.613 3.488 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000125827586 1415291161 /nfs/dbraw/zinc/29/11/61/1415291161.db2.gz MNOUJGGDJIPXAH-FBBABVLZSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000125827586 1415291164 /nfs/dbraw/zinc/29/11/64/1415291164.db2.gz MNOUJGGDJIPXAH-FBBABVLZSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000125827969 1415291857 /nfs/dbraw/zinc/29/18/57/1415291857.db2.gz MNOUJGGDJIPXAH-DSKINZAPSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000125827969 1415291863 /nfs/dbraw/zinc/29/18/63/1415291863.db2.gz MNOUJGGDJIPXAH-DSKINZAPSA-N 2 1 386.540 3.028 20 0 GGADMP Cc1c(C(=O)N2CCC[N@H+](CC3CCCCC3)CC2)cnn1-c1cc[nH+]cc1 ZINC000126226756 1415388589 /nfs/dbraw/zinc/38/85/89/1415388589.db2.gz XJOUFPPLSAFOLQ-UHFFFAOYSA-N 2 1 381.524 3.304 20 0 GGADMP Cc1c(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)cnn1-c1cc[nH+]cc1 ZINC000126226756 1415388599 /nfs/dbraw/zinc/38/85/99/1415388599.db2.gz XJOUFPPLSAFOLQ-UHFFFAOYSA-N 2 1 381.524 3.304 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1[nH]c(C)c(C(C)=O)c1C(C)C ZINC000126297755 1415409876 /nfs/dbraw/zinc/40/98/76/1415409876.db2.gz WNHDXTHOJPVEIC-GOSISDBHSA-N 2 1 390.572 3.137 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)CC(=O)Nc2cccnc2Cl)cn1 ZINC000126302331 1415412011 /nfs/dbraw/zinc/41/20/11/1415412011.db2.gz QBYZNRXPVHYLLB-CYBMUJFWSA-N 2 1 384.871 3.131 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccc(C)cc3)C2=O)[C@H](C)C1 ZINC000177979233 1428912497 /nfs/dbraw/zinc/91/24/97/1428912497.db2.gz ATERRRXOIBYULA-BAGYTPMASA-N 2 1 387.568 3.217 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccc(C)cc3)C2=O)[C@H](C)C1 ZINC000177979233 1428912507 /nfs/dbraw/zinc/91/25/07/1428912507.db2.gz ATERRRXOIBYULA-BAGYTPMASA-N 2 1 387.568 3.217 20 0 GGADMP O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000126363656 1415427705 /nfs/dbraw/zinc/42/77/05/1415427705.db2.gz YRFRQJWOGFXKHR-JXFKEZNVSA-N 2 1 390.959 3.260 20 0 GGADMP CN(C(=O)[C@@H](c1ccccc1)[NH+](C)C)c1ccc(OCC[NH+]2CCCC2)cc1 ZINC000126381896 1415431859 /nfs/dbraw/zinc/43/18/59/1415431859.db2.gz DYKVVGAFEQMQGS-JOCHJYFZSA-N 2 1 381.520 3.427 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(C(=O)NCC3CC[NH+](Cc4ccccc4)CC3)CC[C@@H]21 ZINC000178000496 1428925459 /nfs/dbraw/zinc/92/54/59/1428925459.db2.gz JLWVEVOSNADQIM-VXKWHMMOSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cc(O)ccc2Br)cc1 ZINC000126564197 1415492615 /nfs/dbraw/zinc/49/26/15/1415492615.db2.gz WPDPMMAKGGDHHS-UHFFFAOYSA-N 2 1 379.298 3.385 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc2c(c1)OCCO2 ZINC000126705472 1415531871 /nfs/dbraw/zinc/53/18/71/1415531871.db2.gz XJKSLARIMMJHSQ-SFHVURJKSA-N 2 1 381.520 3.056 20 0 GGADMP CC[N@H+](C)C[C@@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000178025383 1428942301 /nfs/dbraw/zinc/94/23/01/1428942301.db2.gz SEQUJNHNKMFZTJ-KRWDZBQOSA-N 2 1 376.570 3.041 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000178025383 1428942308 /nfs/dbraw/zinc/94/23/08/1428942308.db2.gz SEQUJNHNKMFZTJ-KRWDZBQOSA-N 2 1 376.570 3.041 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]C3CCN(c4ccccc4)CC3)cc2)CC1 ZINC000126709093 1415534181 /nfs/dbraw/zinc/53/41/81/1415534181.db2.gz DCSWLFJMNKNNBO-UHFFFAOYSA-N 2 1 378.564 3.193 20 0 GGADMP Cc1ccc(NC(=O)C[C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)c1 ZINC000178036340 1428948701 /nfs/dbraw/zinc/94/87/01/1428948701.db2.gz ZHCFGTWBLAMLJG-SLFFLAALSA-N 2 1 375.557 3.500 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c2cccs2)CC1 ZINC000126775606 1415555778 /nfs/dbraw/zinc/55/57/78/1415555778.db2.gz QSHGJCBEVXYOGH-PKOBYXMFSA-N 2 1 390.597 3.305 20 0 GGADMP C[N@@H+](CCCNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)Cc1ccccc1 ZINC000126819170 1415570616 /nfs/dbraw/zinc/57/06/16/1415570616.db2.gz NNKVLXDVANLWEC-FQEVSTJZSA-N 2 1 384.524 3.238 20 0 GGADMP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)nnn1-c1ccc(F)cc1 ZINC000178038170 1428950165 /nfs/dbraw/zinc/95/01/65/1428950165.db2.gz POKQFIFQBWGTFB-BBWFWOEESA-N 2 1 389.519 3.255 20 0 GGADMP COc1cccc([C@H](CNC(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)[NH+](C)C)c1 ZINC000126866806 1415589410 /nfs/dbraw/zinc/58/94/10/1415589410.db2.gz SLQFQLCSTKPKDX-NQIIRXRSSA-N 2 1 390.572 3.109 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(-n2cnnn2)cc1 ZINC000126884268 1415594656 /nfs/dbraw/zinc/59/46/56/1415594656.db2.gz GPOHDTMNAUQCLY-DLBZAZTESA-N 2 1 382.537 3.287 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(-n2cnnn2)cc1 ZINC000126884268 1415594660 /nfs/dbraw/zinc/59/46/60/1415594660.db2.gz GPOHDTMNAUQCLY-DLBZAZTESA-N 2 1 382.537 3.287 20 0 GGADMP CC[NH+](CC)CCn1ccc2cc(NC(=O)C[N@H+](C)[C@@H]3CCSC3)ccc21 ZINC000127008741 1415634711 /nfs/dbraw/zinc/63/47/11/1415634711.db2.gz HHUBFJLIIPYKNX-LJQANCHMSA-N 2 1 388.581 3.359 20 0 GGADMP CC[NH+](CC)CCn1ccc2cc(NC(=O)C[N@@H+](C)[C@@H]3CCSC3)ccc21 ZINC000127008741 1415634730 /nfs/dbraw/zinc/63/47/30/1415634730.db2.gz HHUBFJLIIPYKNX-LJQANCHMSA-N 2 1 388.581 3.359 20 0 GGADMP C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Nc1ccc(OCC[NH+]3CCCCC3)cc1)C2 ZINC000127418891 1415772430 /nfs/dbraw/zinc/77/24/30/1415772430.db2.gz YHXFRGPPTUFNLZ-VQTJNVASSA-N 2 1 386.540 3.252 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)C1 ZINC000127438656 1415778307 /nfs/dbraw/zinc/77/83/07/1415778307.db2.gz NDZNIYAGKZWKQP-LJQANCHMSA-N 2 1 388.556 3.357 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N[C@@H]3CC[N@H+](C4CCCC4)C3)CC2)CC1 ZINC000127653859 1415827069 /nfs/dbraw/zinc/82/70/69/1415827069.db2.gz LLKVSTKMEJZPSC-OBXNSHGQSA-N 2 1 376.589 3.346 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)[C@H]2CCC[N@H+]2C2CCOCC2)CC1 ZINC000178203207 1429017803 /nfs/dbraw/zinc/01/78/03/1429017803.db2.gz UZJKWRUYJNKOFR-HSZRJFAPSA-N 2 1 399.579 3.178 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]C/C=C/c3ccc(F)cc3)c2)C1 ZINC000127821323 1415857076 /nfs/dbraw/zinc/85/70/76/1415857076.db2.gz NZDXSAIOMSXZMQ-FNLFUECCSA-N 2 1 381.495 3.326 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000127935315 1415878230 /nfs/dbraw/zinc/87/82/30/1415878230.db2.gz HRGQRJRNNBWUMG-PXNSSMCTSA-N 2 1 378.536 3.096 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cccc(F)c1 ZINC000127934805 1415878269 /nfs/dbraw/zinc/87/82/69/1415878269.db2.gz HSZULKHBRSZECN-JRGCBEDISA-N 2 1 388.531 3.087 20 0 GGADMP COc1cccc(C[C@@H]([NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)c2ccccc2)c1 ZINC000128004541 1415891694 /nfs/dbraw/zinc/89/16/94/1415891694.db2.gz TUCYACJQBLFYDI-JTHBVZDNSA-N 2 1 395.547 3.156 20 0 GGADMP Cc1nc(-c2cc([C@H](C)[NH2+]CCC[N@@H+]3CCC[C@H](C(N)=O)C3)cs2)cs1 ZINC000128060539 1415903237 /nfs/dbraw/zinc/90/32/37/1415903237.db2.gz BTKGRRPGGFDPTJ-ZFWWWQNUSA-N 2 1 392.594 3.418 20 0 GGADMP Cc1nc(-c2cc([C@H](C)[NH2+]CCC[N@H+]3CCC[C@H](C(N)=O)C3)cs2)cs1 ZINC000128060539 1415903240 /nfs/dbraw/zinc/90/32/40/1415903240.db2.gz BTKGRRPGGFDPTJ-ZFWWWQNUSA-N 2 1 392.594 3.418 20 0 GGADMP Cc1nc(-c2cc([C@@H](C)[NH2+]CCC[N@@H+]3CCC[C@H](C(N)=O)C3)cs2)cs1 ZINC000128060299 1415903252 /nfs/dbraw/zinc/90/32/52/1415903252.db2.gz BTKGRRPGGFDPTJ-HIFRSBDPSA-N 2 1 392.594 3.418 20 0 GGADMP Cc1nc(-c2cc([C@@H](C)[NH2+]CCC[N@H+]3CCC[C@H](C(N)=O)C3)cs2)cs1 ZINC000128060299 1415903255 /nfs/dbraw/zinc/90/32/55/1415903255.db2.gz BTKGRRPGGFDPTJ-HIFRSBDPSA-N 2 1 392.594 3.418 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)C(c1ccccc1)c1ccccc1 ZINC000128118438 1415916715 /nfs/dbraw/zinc/91/67/15/1415916715.db2.gz YDAOTJHWJYHDOK-KNQAVFIVSA-N 2 1 379.548 3.384 20 0 GGADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1 ZINC000128140738 1415922756 /nfs/dbraw/zinc/92/27/56/1415922756.db2.gz MQXKQLFEANYXEP-QAPCUYQASA-N 2 1 386.565 3.357 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000128292992 1415956001 /nfs/dbraw/zinc/95/60/01/1415956001.db2.gz OWKCSKXGFSJOMI-WENLIBGGSA-N 2 1 396.579 3.165 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000128292992 1415956004 /nfs/dbraw/zinc/95/60/04/1415956004.db2.gz OWKCSKXGFSJOMI-WENLIBGGSA-N 2 1 396.579 3.165 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000128292992 1415956008 /nfs/dbraw/zinc/95/60/08/1415956008.db2.gz OWKCSKXGFSJOMI-WENLIBGGSA-N 2 1 396.579 3.165 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000128356506 1415970146 /nfs/dbraw/zinc/97/01/46/1415970146.db2.gz ALCKYGZPJKOPNZ-UHFFFAOYSA-N 2 1 375.561 3.314 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(CN3CCCC3=O)cc2)[C@H](C)C1 ZINC000128496911 1416000323 /nfs/dbraw/zinc/00/03/23/1416000323.db2.gz YRUHEEPFDPYRKS-DENIHFKCSA-N 2 1 387.568 3.036 20 0 GGADMP C[C@@H](CCNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)[N@H+](C)Cc1ccccc1 ZINC000128733546 1416054305 /nfs/dbraw/zinc/05/43/05/1416054305.db2.gz ALSOVPQWTOEGRX-IBGZPJMESA-N 2 1 397.567 3.295 20 0 GGADMP C[C@@H](CCNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)[N@@H+](C)Cc1ccccc1 ZINC000128733546 1416054315 /nfs/dbraw/zinc/05/43/15/1416054315.db2.gz ALSOVPQWTOEGRX-IBGZPJMESA-N 2 1 397.567 3.295 20 0 GGADMP Cc1c(C(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2F)cnn1-c1cc[nH+]cc1 ZINC000128807897 1416073614 /nfs/dbraw/zinc/07/36/14/1416073614.db2.gz IJUROESKTGVSQM-UHFFFAOYSA-N 2 1 399.445 3.058 20 0 GGADMP COc1cc([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)ccc1S(=O)(=O)C(F)F ZINC000178410522 1429072362 /nfs/dbraw/zinc/07/23/62/1429072362.db2.gz CYJZQUMDRMWZSG-CQSZACIVSA-N 2 1 390.496 3.218 20 0 GGADMP C[C@@H](NC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)C(C)(C)C[NH+](C)C ZINC000129079306 1416139801 /nfs/dbraw/zinc/13/98/01/1416139801.db2.gz WKZOTWDQEZKHOA-DLBZAZTESA-N 2 1 376.545 3.178 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000178409596 1429072291 /nfs/dbraw/zinc/07/22/91/1429072291.db2.gz FKHUHKQYPZDTRL-GOSISDBHSA-N 2 1 381.586 3.244 20 0 GGADMP O=C(CC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)NCc1ccccc1 ZINC000129238987 1416177402 /nfs/dbraw/zinc/17/74/02/1416177402.db2.gz JRUCDDDITYWYSA-UHFFFAOYSA-N 2 1 383.511 3.129 20 0 GGADMP C[C@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1cccc(C(F)(F)F)c1 ZINC000129584260 1416232493 /nfs/dbraw/zinc/23/24/93/1416232493.db2.gz QWXIDHGYHBEODR-AWEZNQCLSA-N 2 1 379.430 3.098 20 0 GGADMP C[C@@H]1CC[NH+](C/C=C/C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129594836 1416234465 /nfs/dbraw/zinc/23/44/65/1416234465.db2.gz QRTZKENKHXEOIW-NDNTWHODSA-N 2 1 382.556 3.102 20 0 GGADMP C[C@@H]1CC[N@@H+](C/C=C/C[NH+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129594836 1416234470 /nfs/dbraw/zinc/23/44/70/1416234470.db2.gz QRTZKENKHXEOIW-NDNTWHODSA-N 2 1 382.556 3.102 20 0 GGADMP C[C@@H]1CC[N@H+](C/C=C/C[NH+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129594836 1416234474 /nfs/dbraw/zinc/23/44/74/1416234474.db2.gz QRTZKENKHXEOIW-NDNTWHODSA-N 2 1 382.556 3.102 20 0 GGADMP CC(C)CC[NH+]1CCC(CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000129983752 1416296473 /nfs/dbraw/zinc/29/64/73/1416296473.db2.gz ZDAIMFBMVKQLCS-IFMALSPDSA-N 2 1 390.616 3.403 20 0 GGADMP O=C1C[C@H]([NH+]2CCC(CCC[NH+]3CCCC3)CC2)C(=O)N1c1ccccc1F ZINC000130057181 1416309772 /nfs/dbraw/zinc/30/97/72/1416309772.db2.gz AFDXGDDOBBAMBD-FQEVSTJZSA-N 2 1 387.499 3.046 20 0 GGADMP C[N@@H+](C[C@H](O)COc1ccccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000130098843 1416317538 /nfs/dbraw/zinc/31/75/38/1416317538.db2.gz XONNUXUJEQHRRQ-IBGZPJMESA-N 2 1 389.927 3.323 20 0 GGADMP c1ccc(OCc2cccnc2)c(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c1 ZINC000130337005 1416360395 /nfs/dbraw/zinc/36/03/95/1416360395.db2.gz JYUQVBMNHDMZOX-HXUWFJFHSA-N 2 1 381.520 3.251 20 0 GGADMP c1ccc(OCc2cccnc2)c(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c1 ZINC000130336797 1416360426 /nfs/dbraw/zinc/36/04/26/1416360426.db2.gz JYUQVBMNHDMZOX-FQEVSTJZSA-N 2 1 381.520 3.251 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)c2ccc(C[NH+](C)C)cc2)C[C@@H](C)O1 ZINC000130369499 1416366034 /nfs/dbraw/zinc/36/60/34/1416366034.db2.gz UFENHYXAMBINEG-RTBURBONSA-N 2 1 395.547 3.287 20 0 GGADMP CC[C@@H](C)Oc1cc(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)ccc1OC ZINC000130405621 1416372613 /nfs/dbraw/zinc/37/26/13/1416372613.db2.gz SLPMHHYEVLMMKQ-IEBWSBKVSA-N 2 1 376.541 3.463 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]C3(c4cccc(Cl)c4)CCCC3)cn2)CC1 ZINC000130418384 1416374464 /nfs/dbraw/zinc/37/44/64/1416374464.db2.gz IKBMPQHBKXAMNB-UHFFFAOYSA-N 2 1 385.943 3.441 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)C1 ZINC000130651018 1416417317 /nfs/dbraw/zinc/41/73/17/1416417317.db2.gz AGJFEUWKMFHRJA-HXUWFJFHSA-N 2 1 392.563 3.267 20 0 GGADMP CC(C)C[NH+]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000130684823 1416424473 /nfs/dbraw/zinc/42/44/73/1416424473.db2.gz DVULZSRZMJIDCA-UHFFFAOYSA-N 2 1 376.570 3.041 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000130739486 1416439310 /nfs/dbraw/zinc/43/93/10/1416439310.db2.gz UFJIKSGWEUCPGP-SFHLNBCPSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000130739486 1416439318 /nfs/dbraw/zinc/43/93/18/1416439318.db2.gz UFJIKSGWEUCPGP-SFHLNBCPSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000130739486 1416439324 /nfs/dbraw/zinc/43/93/24/1416439324.db2.gz UFJIKSGWEUCPGP-SFHLNBCPSA-N 2 1 376.589 3.013 20 0 GGADMP CC[NH+](CC)CCNC(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000130825825 1416460931 /nfs/dbraw/zinc/46/09/31/1416460931.db2.gz HFVOFQMYFMOOPT-MAUKXSAKSA-N 2 1 384.927 3.113 20 0 GGADMP C[C@@H](C(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000130832368 1416462957 /nfs/dbraw/zinc/46/29/57/1416462957.db2.gz XVLRNOSJIYNSJG-IBGZPJMESA-N 2 1 392.547 3.203 20 0 GGADMP C[C@@H](C(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000130832368 1416462960 /nfs/dbraw/zinc/46/29/60/1416462960.db2.gz XVLRNOSJIYNSJG-IBGZPJMESA-N 2 1 392.547 3.203 20 0 GGADMP COc1ccccc1C[NH+]1CCC(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000130908029 1416479513 /nfs/dbraw/zinc/47/95/13/1416479513.db2.gz KTBQOKVBEFPSCZ-UHFFFAOYSA-N 2 1 395.547 3.155 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000131396943 1416550718 /nfs/dbraw/zinc/55/07/18/1416550718.db2.gz KAKZQABBFSUOJY-SFTDATJTSA-N 2 1 387.593 3.253 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131399014 1416551009 /nfs/dbraw/zinc/55/10/09/1416551009.db2.gz KJUNIXNEFXXMOO-RTBURBONSA-N 2 1 395.551 3.302 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131399014 1416551015 /nfs/dbraw/zinc/55/10/15/1416551015.db2.gz KJUNIXNEFXXMOO-RTBURBONSA-N 2 1 395.551 3.302 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000131583750 1416580126 /nfs/dbraw/zinc/58/01/26/1416580126.db2.gz NSYWGBKVLWCVNV-UXHICEINSA-N 2 1 376.932 3.287 20 0 GGADMP Cc1nn(C)cc1[C@H](C)[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000178575059 1429111233 /nfs/dbraw/zinc/11/12/33/1429111233.db2.gz LXPDMQJGJQKWGU-KRWDZBQOSA-N 2 1 386.540 3.069 20 0 GGADMP Cc1ccc(C(=O)NCC[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)cc1 ZINC000131853284 1416635265 /nfs/dbraw/zinc/63/52/65/1416635265.db2.gz PBWOSGLLBTZMOA-UHFFFAOYSA-N 2 1 383.511 3.161 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[NH+]1CCCCCC1)[NH+]1CCSCC1 ZINC000132082861 1416690878 /nfs/dbraw/zinc/69/08/78/1416690878.db2.gz KSKOCJHKBNJHFB-SFHVURJKSA-N 2 1 375.582 3.116 20 0 GGADMP CC(C)c1ncc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)s1 ZINC000132277742 1416727734 /nfs/dbraw/zinc/72/77/34/1416727734.db2.gz HDOZPVWSNMAOCG-SFHVURJKSA-N 2 1 386.565 3.254 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc(N4CCCC4)nc3)CC2)oc1C ZINC000132407370 1416754577 /nfs/dbraw/zinc/75/45/77/1416754577.db2.gz ZIVWJSLKJMILKU-UHFFFAOYSA-N 2 1 383.540 3.288 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CN2C(=O)SC(C)(C)C2=O)CC1 ZINC000132551860 1416783893 /nfs/dbraw/zinc/78/38/93/1416783893.db2.gz WMIQCDUZNYZMAO-UHFFFAOYSA-N 2 1 375.538 3.262 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CN2C(=O)SC(C)(C)C2=O)CC1 ZINC000132551860 1416783897 /nfs/dbraw/zinc/78/38/97/1416783897.db2.gz WMIQCDUZNYZMAO-UHFFFAOYSA-N 2 1 375.538 3.262 20 0 GGADMP Cc1cc(NC(=O)CC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)no1 ZINC000178660863 1429131521 /nfs/dbraw/zinc/13/15/21/1429131521.db2.gz BWEQTFVYZLEEPJ-UXHICEINSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)no1 ZINC000178660863 1429131525 /nfs/dbraw/zinc/13/15/25/1429131525.db2.gz BWEQTFVYZLEEPJ-UXHICEINSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)no1 ZINC000178660863 1429131529 /nfs/dbraw/zinc/13/15/29/1429131529.db2.gz BWEQTFVYZLEEPJ-UXHICEINSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)no1 ZINC000178660863 1429131533 /nfs/dbraw/zinc/13/15/33/1429131533.db2.gz BWEQTFVYZLEEPJ-UXHICEINSA-N 2 1 382.508 3.298 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)ccc1OC(F)F ZINC000132852536 1416823215 /nfs/dbraw/zinc/82/32/15/1416823215.db2.gz FPAIVRDHHIYOHE-CABCVRRESA-N 2 1 384.467 3.448 20 0 GGADMP COc1cc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)ccc1OC(F)F ZINC000132852298 1416823355 /nfs/dbraw/zinc/82/33/55/1416823355.db2.gz FPAIVRDHHIYOHE-GJZGRUSLSA-N 2 1 384.467 3.448 20 0 GGADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cnn1-c1ccc(F)cc1 ZINC000132886546 1416827190 /nfs/dbraw/zinc/82/71/90/1416827190.db2.gz FEOSVKXVOAYJDU-WMZOPIPTSA-N 2 1 386.515 3.471 20 0 GGADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cnn1-c1ccc(F)cc1 ZINC000132886334 1416827267 /nfs/dbraw/zinc/82/72/67/1416827267.db2.gz FEOSVKXVOAYJDU-AEFFLSMTSA-N 2 1 386.515 3.471 20 0 GGADMP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000178666821 1429133365 /nfs/dbraw/zinc/13/33/65/1429133365.db2.gz PMSPQLOGFBWEPA-LJQANCHMSA-N 2 1 381.520 3.080 20 0 GGADMP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000178667591 1429133440 /nfs/dbraw/zinc/13/34/40/1429133440.db2.gz DJJGGODJWDUSSV-CQSZACIVSA-N 2 1 389.487 3.156 20 0 GGADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCC(=O)N1CC[NH+](C)CC1 ZINC000178667247 1429133699 /nfs/dbraw/zinc/13/36/99/1429133699.db2.gz HGQCYSBAJAMJLJ-CQSZACIVSA-N 2 1 390.528 3.072 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1 ZINC000133107512 1416852576 /nfs/dbraw/zinc/85/25/76/1416852576.db2.gz SYQKSBFYONRXKV-MNEFBYGVSA-N 2 1 385.474 3.009 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[NH+]1CCSCC1 ZINC000133112612 1416852993 /nfs/dbraw/zinc/85/29/93/1416852993.db2.gz KZDLQQJVUJJFIB-QZTJIDSGSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)[NH+]1CCSCC1 ZINC000133112612 1416852996 /nfs/dbraw/zinc/85/29/96/1416852996.db2.gz KZDLQQJVUJJFIB-QZTJIDSGSA-N 2 1 375.582 3.115 20 0 GGADMP CCC(CC)[C@H](C[NH2+]C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)[NH+](C)C ZINC000133125197 1416854739 /nfs/dbraw/zinc/85/47/39/1416854739.db2.gz IUXSHUMOLRAPGO-NRFANRHFSA-N 2 1 395.613 3.104 20 0 GGADMP O=C(C[C@@H]1CSCC[NH2+]1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000133345952 1416880872 /nfs/dbraw/zinc/88/08/72/1416880872.db2.gz QFFLPKZYAACLLD-OAQYLSRUSA-N 2 1 395.572 3.015 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000133423123 1416888252 /nfs/dbraw/zinc/88/82/52/1416888252.db2.gz ZFMQNMWOPPYGFW-AVRDEDQJSA-N 2 1 399.583 3.171 20 0 GGADMP Cc1c(C(=O)Nc2cccc(OCCC[NH+](C)C)c2)cnn1-c1cc[nH+]cc1 ZINC000133711666 1416948763 /nfs/dbraw/zinc/94/87/63/1416948763.db2.gz XRUSYHKXNXWEGU-UHFFFAOYSA-N 2 1 379.464 3.159 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000133848815 1416977651 /nfs/dbraw/zinc/97/76/51/1416977651.db2.gz IXFFWKJYALGJOS-INIZCTEOSA-N 2 1 398.532 3.282 20 0 GGADMP Cc1csc(N2CC[NH+](Cc3ccccc3N(C)C3CC[NH+](C)CC3)CC2)n1 ZINC000133864379 1416981147 /nfs/dbraw/zinc/98/11/47/1416981147.db2.gz TVYCMKBZAIBNFU-UHFFFAOYSA-N 2 1 399.608 3.304 20 0 GGADMP CCOc1cc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cc(Cl)c1OC ZINC000134059785 1417015941 /nfs/dbraw/zinc/01/59/41/1417015941.db2.gz UQEAKOPYVYNOKN-UHFFFAOYSA-N 2 1 382.932 3.292 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+][C@H]3CCCC[C@H]3Cc3ccccc3)cn2)CC1 ZINC000134277824 1417048857 /nfs/dbraw/zinc/04/88/57/1417048857.db2.gz UPPZTGPOAIICGT-VXKWHMMOSA-N 2 1 379.552 3.120 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cnc(C4CC4)s3)c2)C1 ZINC000134301076 1417052423 /nfs/dbraw/zinc/05/24/23/1417052423.db2.gz VBMHSHAAMRYNJJ-SFHVURJKSA-N 2 1 384.549 3.008 20 0 GGADMP Cc1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)nc1 ZINC000134361443 1417060896 /nfs/dbraw/zinc/06/08/96/1417060896.db2.gz WOTSTOHOEWOJDC-UHFFFAOYSA-N 2 1 378.442 3.450 20 0 GGADMP COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000134383842 1417063131 /nfs/dbraw/zinc/06/31/31/1417063131.db2.gz XVWBYWDXRWKMST-FQEVSTJZSA-N 2 1 383.540 3.114 20 0 GGADMP CS[C@@H]1CCCC[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000134561147 1417087353 /nfs/dbraw/zinc/08/73/53/1417087353.db2.gz GBKMLCSPUTYFBC-HXUWFJFHSA-N 2 1 375.582 3.116 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cccs1 ZINC000178739195 1429157750 /nfs/dbraw/zinc/15/77/50/1429157750.db2.gz VCNPGDCADNWOPN-NXHRZFHOSA-N 2 1 376.570 3.009 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000134733180 1417118193 /nfs/dbraw/zinc/11/81/93/1417118193.db2.gz RJPVOMSOMYBZJA-XPGWFJOJSA-N 2 1 376.932 3.143 20 0 GGADMP CC(=O)Nc1ccc2c(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc(=O)oc2c1 ZINC000134875987 1417137979 /nfs/dbraw/zinc/13/79/79/1417137979.db2.gz SQXORUJXOZBURI-IIBYNOLFSA-N 2 1 395.503 3.200 20 0 GGADMP CC(=O)Nc1ccc2c(C[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc(=O)oc2c1 ZINC000134875987 1417137982 /nfs/dbraw/zinc/13/79/82/1417137982.db2.gz SQXORUJXOZBURI-IIBYNOLFSA-N 2 1 395.503 3.200 20 0 GGADMP CC(=O)Nc1ccc2c(C[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc(=O)oc2c1 ZINC000134875987 1417137984 /nfs/dbraw/zinc/13/79/84/1417137984.db2.gz SQXORUJXOZBURI-IIBYNOLFSA-N 2 1 395.503 3.200 20 0 GGADMP CC(=O)Nc1ccc2c(C[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc(=O)oc2c1 ZINC000134875987 1417137986 /nfs/dbraw/zinc/13/79/86/1417137986.db2.gz SQXORUJXOZBURI-IIBYNOLFSA-N 2 1 395.503 3.200 20 0 GGADMP O[C@H](COCc1ccccc1Cl)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134879762 1417138896 /nfs/dbraw/zinc/13/88/96/1417138896.db2.gz VNAUEJFOJUQDJA-LKUPVBHCSA-N 2 1 378.944 3.166 20 0 GGADMP O[C@H](COCc1ccccc1Cl)C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134879762 1417138901 /nfs/dbraw/zinc/13/89/01/1417138901.db2.gz VNAUEJFOJUQDJA-LKUPVBHCSA-N 2 1 378.944 3.166 20 0 GGADMP O[C@H](COCc1ccccc1Cl)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134879762 1417138904 /nfs/dbraw/zinc/13/89/04/1417138904.db2.gz VNAUEJFOJUQDJA-LKUPVBHCSA-N 2 1 378.944 3.166 20 0 GGADMP Cc1nc(CNC(=O)OC(C)(C)C)ccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000134914547 1417144039 /nfs/dbraw/zinc/14/40/39/1417144039.db2.gz ZJBJIUGEIKSXGV-WBVHZDCISA-N 2 1 376.545 3.407 20 0 GGADMP Cc1nc(CNC(=O)OC(C)(C)C)ccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000134914605 1417144157 /nfs/dbraw/zinc/14/41/57/1417144157.db2.gz ZJBJIUGEIKSXGV-DOTOQJQBSA-N 2 1 376.545 3.407 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000135161503 1417179768 /nfs/dbraw/zinc/17/97/68/1417179768.db2.gz IWXCGYZLQJUQKT-NRFANRHFSA-N 2 1 398.526 3.351 20 0 GGADMP C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C1 ZINC000135195989 1417185482 /nfs/dbraw/zinc/18/54/82/1417185482.db2.gz CHTCCSWZZZDARB-INIZCTEOSA-N 2 1 378.536 3.197 20 0 GGADMP C[C@@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000135266469 1417199850 /nfs/dbraw/zinc/19/98/50/1417199850.db2.gz WJLWBRQGVXUPMS-XLIONFOSSA-N 2 1 394.531 3.271 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000136017084 1417286283 /nfs/dbraw/zinc/28/62/83/1417286283.db2.gz SWOKNTZEQWJMJW-RTBURBONSA-N 2 1 397.567 3.428 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NC[C@H](c3cccs3)[NH+]3CCCC3)CC2)c1 ZINC000136378052 1417312255 /nfs/dbraw/zinc/31/22/55/1417312255.db2.gz ADOBLBQOECNFGG-GOSISDBHSA-N 2 1 399.564 3.120 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c(SC)cc1OC ZINC000136558318 1417326343 /nfs/dbraw/zinc/32/63/43/1417326343.db2.gz NXLGFFDYGDPWFO-MSOLQXFVSA-N 2 1 394.581 3.283 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c(SC)cc1OC ZINC000136558410 1417326429 /nfs/dbraw/zinc/32/64/29/1417326429.db2.gz NXLGFFDYGDPWFO-ZWKOTPCHSA-N 2 1 394.581 3.283 20 0 GGADMP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1 ZINC000136595851 1417330311 /nfs/dbraw/zinc/33/03/11/1417330311.db2.gz KRPXNOHHXWTTBB-ZEQRLZLVSA-N 2 1 396.579 3.406 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@@H]1CCCc2sccc21 ZINC000136623573 1417332889 /nfs/dbraw/zinc/33/28/89/1417332889.db2.gz DWHPLMGEFJTLFD-SJLPKXTDSA-N 2 1 378.586 3.183 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)CC1 ZINC000136745202 1417343419 /nfs/dbraw/zinc/34/34/19/1417343419.db2.gz YZHAURPYADVYRF-IRLDBZIGSA-N 2 1 384.568 3.085 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)Cc1ccccc1 ZINC000136813292 1417347470 /nfs/dbraw/zinc/34/74/70/1417347470.db2.gz RYCYZCUXZORAHA-BHIFYINESA-N 2 1 386.584 3.065 20 0 GGADMP CC1CC[NH+](CC(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2C(F)(F)F)CC1 ZINC000137044044 1417364432 /nfs/dbraw/zinc/36/44/32/1417364432.db2.gz TYGAUJLWYVMYCT-UHFFFAOYSA-N 2 1 398.473 3.128 20 0 GGADMP CC[NH+](CC)CCOc1cc(NC(=O)C[NH+]2CCC(C)CC2)ccc1OC ZINC000137483000 1417387800 /nfs/dbraw/zinc/38/78/00/1417387800.db2.gz NHZQDAZPWXHUMK-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP C[C@@H](CCCOc1ccccc1C(N)=O)[NH2+]CC(C)(C)[N@@H+]1CCC[C@@H](C)C1 ZINC000138191421 1417407368 /nfs/dbraw/zinc/40/73/68/1417407368.db2.gz VBQWMDYAHDGJMT-MSOLQXFVSA-N 2 1 375.557 3.433 20 0 GGADMP C[C@@H](CCCOc1ccccc1C(N)=O)[NH2+]CC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000138191421 1417407371 /nfs/dbraw/zinc/40/73/71/1417407371.db2.gz VBQWMDYAHDGJMT-MSOLQXFVSA-N 2 1 375.557 3.433 20 0 GGADMP C[C@@H](CCCOc1ccccc1C(N)=O)[NH2+]CC(C)(C)[N@@H+]1CCC[C@H](C)C1 ZINC000138191539 1417407605 /nfs/dbraw/zinc/40/76/05/1417407605.db2.gz VBQWMDYAHDGJMT-ROUUACIJSA-N 2 1 375.557 3.433 20 0 GGADMP C[C@@H](CCCOc1ccccc1C(N)=O)[NH2+]CC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000138191539 1417407609 /nfs/dbraw/zinc/40/76/09/1417407609.db2.gz VBQWMDYAHDGJMT-ROUUACIJSA-N 2 1 375.557 3.433 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C)C3)cc(=O)oc2c1 ZINC000139881945 1417478367 /nfs/dbraw/zinc/47/83/67/1417478367.db2.gz JEVQROLYCJEVSB-DNVCBOLYSA-N 2 1 399.491 3.278 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C)C3)cc(=O)oc2c1 ZINC000139881945 1417478373 /nfs/dbraw/zinc/47/83/73/1417478373.db2.gz JEVQROLYCJEVSB-DNVCBOLYSA-N 2 1 399.491 3.278 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C)C3)cc(=O)oc2c1 ZINC000139881945 1417478381 /nfs/dbraw/zinc/47/83/81/1417478381.db2.gz JEVQROLYCJEVSB-DNVCBOLYSA-N 2 1 399.491 3.278 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C)C3)cc(=O)oc2c1 ZINC000139881945 1417478394 /nfs/dbraw/zinc/47/83/94/1417478394.db2.gz JEVQROLYCJEVSB-DNVCBOLYSA-N 2 1 399.491 3.278 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000139912226 1417480247 /nfs/dbraw/zinc/48/02/47/1417480247.db2.gz GTFXXDLCLLLNOC-CTNGQTDRSA-N 2 1 395.551 3.234 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000139912226 1417480255 /nfs/dbraw/zinc/48/02/55/1417480255.db2.gz GTFXXDLCLLLNOC-CTNGQTDRSA-N 2 1 395.551 3.234 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000139912226 1417480256 /nfs/dbraw/zinc/48/02/56/1417480256.db2.gz GTFXXDLCLLLNOC-CTNGQTDRSA-N 2 1 395.551 3.234 20 0 GGADMP C[N@@H+]1CCC[C@H]2C[NH+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@@H]21 ZINC000140020911 1417484981 /nfs/dbraw/zinc/48/49/81/1417484981.db2.gz ZLQDCYGNJFTEIX-CVDCTZTESA-N 2 1 392.547 3.200 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@@H]21 ZINC000140020911 1417484984 /nfs/dbraw/zinc/48/49/84/1417484984.db2.gz ZLQDCYGNJFTEIX-CVDCTZTESA-N 2 1 392.547 3.200 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@@H]21 ZINC000140020911 1417484989 /nfs/dbraw/zinc/48/49/89/1417484989.db2.gz ZLQDCYGNJFTEIX-CVDCTZTESA-N 2 1 392.547 3.200 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@@H]21 ZINC000140020911 1417484994 /nfs/dbraw/zinc/48/49/94/1417484994.db2.gz ZLQDCYGNJFTEIX-CVDCTZTESA-N 2 1 392.547 3.200 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000140094183 1417488449 /nfs/dbraw/zinc/48/84/49/1417488449.db2.gz OIXCELUMRZSCRK-QFIPXVFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000140094183 1417488452 /nfs/dbraw/zinc/48/84/52/1417488452.db2.gz OIXCELUMRZSCRK-QFIPXVFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000140094183 1417488458 /nfs/dbraw/zinc/48/84/58/1417488458.db2.gz OIXCELUMRZSCRK-QFIPXVFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)NCc2cccnc2-n2cc[nH+]c2C)c1 ZINC000141110357 1417526472 /nfs/dbraw/zinc/52/64/72/1417526472.db2.gz RXQSCGVCRZMQTA-UHFFFAOYSA-N 2 1 392.507 3.027 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NCc2cccnc2-n2cc[nH+]c2C)c1 ZINC000141110357 1417526477 /nfs/dbraw/zinc/52/64/77/1417526477.db2.gz RXQSCGVCRZMQTA-UHFFFAOYSA-N 2 1 392.507 3.027 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N(CC[NH+](C)C)Cc2ccccc2)c1 ZINC000141542640 1417543837 /nfs/dbraw/zinc/54/38/37/1417543837.db2.gz OGUJBKJKKFMGMH-UHFFFAOYSA-N 2 1 382.552 3.412 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@H]1[NH2+]CCc2ccccc21 ZINC000178845509 1429192613 /nfs/dbraw/zinc/19/26/13/1429192613.db2.gz WSBXJTPZILSLPT-REWPJTCUSA-N 2 1 377.532 3.244 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000178847878 1429193726 /nfs/dbraw/zinc/19/37/26/1429193726.db2.gz GFQCHJMQTWWARX-GGAORHGYSA-N 2 1 396.579 3.441 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000178847865 1429194065 /nfs/dbraw/zinc/19/40/65/1429194065.db2.gz GFQCHJMQTWWARX-FYYLOGMGSA-N 2 1 396.579 3.441 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)o1 ZINC000144082009 1417655449 /nfs/dbraw/zinc/65/54/49/1417655449.db2.gz RRHQWJBTBJGDKK-SFHVURJKSA-N 2 1 399.535 3.272 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)o1 ZINC000144082009 1417655470 /nfs/dbraw/zinc/65/54/70/1417655470.db2.gz RRHQWJBTBJGDKK-SFHVURJKSA-N 2 1 399.535 3.272 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)NC[C@@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000178862537 1429200796 /nfs/dbraw/zinc/20/07/96/1429200796.db2.gz VKXYBZVCBPSPGQ-MSOLQXFVSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000178862537 1429200807 /nfs/dbraw/zinc/20/08/07/1429200807.db2.gz VKXYBZVCBPSPGQ-MSOLQXFVSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)C1 ZINC000178862537 1429200824 /nfs/dbraw/zinc/20/08/24/1429200824.db2.gz VKXYBZVCBPSPGQ-MSOLQXFVSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)C1 ZINC000178862537 1429200829 /nfs/dbraw/zinc/20/08/29/1429200829.db2.gz VKXYBZVCBPSPGQ-MSOLQXFVSA-N 2 1 392.613 3.162 20 0 GGADMP C[NH+](C)[C@@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000145483208 1417689722 /nfs/dbraw/zinc/68/97/22/1417689722.db2.gz SMQNJRMXDPSRIY-IBGZPJMESA-N 2 1 386.565 3.011 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=S)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000145703332 1417697715 /nfs/dbraw/zinc/69/77/15/1417697715.db2.gz IWALCJUMRMAURU-RBUKOAKNSA-N 2 1 388.625 3.236 20 0 GGADMP C[N@H+]1CCCN(c2ccc(NC(=O)C3(c4ccccc4)CC[NH2+]CC3)cc2)CC1 ZINC000178877262 1429208378 /nfs/dbraw/zinc/20/83/78/1429208378.db2.gz BAIJLWMLRRUBEY-UHFFFAOYSA-N 2 1 392.547 3.088 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)C1 ZINC000150746052 1417796706 /nfs/dbraw/zinc/79/67/06/1417796706.db2.gz IXESIPMKEDIQKN-SFHVURJKSA-N 2 1 396.526 3.016 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(C)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000150764261 1417802658 /nfs/dbraw/zinc/80/26/58/1417802658.db2.gz IIUZWNFMGCPSFZ-FCHUYYIVSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000150764261 1417802662 /nfs/dbraw/zinc/80/26/62/1417802662.db2.gz IIUZWNFMGCPSFZ-FCHUYYIVSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000150764261 1417802663 /nfs/dbraw/zinc/80/26/63/1417802663.db2.gz IIUZWNFMGCPSFZ-FCHUYYIVSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(CC[N@@H+]4CC[C@H](C[NH+]5CCCC5)C4)nc(N)c23)C1 ZINC000150778195 1417805276 /nfs/dbraw/zinc/80/52/76/1417805276.db2.gz GCYQOZXXWMJNEP-HZPDHXFCSA-N 2 1 399.608 3.359 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(CC[N@H+]4CC[C@H](C[NH+]5CCCC5)C4)nc(N)c23)C1 ZINC000150778195 1417805279 /nfs/dbraw/zinc/80/52/79/1417805279.db2.gz GCYQOZXXWMJNEP-HZPDHXFCSA-N 2 1 399.608 3.359 20 0 GGADMP CC[N@@H+](CCNC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)C(C)C ZINC000150788095 1417807003 /nfs/dbraw/zinc/80/70/03/1417807003.db2.gz KEYILTMAMCAPOR-UHFFFAOYSA-N 2 1 378.586 3.130 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CCC[C@H]([NH+]4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000150841501 1417818088 /nfs/dbraw/zinc/81/80/88/1417818088.db2.gz COXUXSOREQIGTG-MZKRTTBSSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CCC[C@H]([NH+]4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000150841501 1417818089 /nfs/dbraw/zinc/81/80/89/1417818089.db2.gz COXUXSOREQIGTG-MZKRTTBSSA-N 2 1 399.579 3.386 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cccnc2N2CCOCC2)cc1 ZINC000151250215 1417903922 /nfs/dbraw/zinc/90/39/22/1417903922.db2.gz JTGFKPJIZHNBNX-QGZVFWFLSA-N 2 1 377.492 3.263 20 0 GGADMP CC[NH+]1CCC(NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000151424233 1417962440 /nfs/dbraw/zinc/96/24/40/1417962440.db2.gz COOLWBDBEUXYPP-IFMALSPDSA-N 2 1 384.568 3.167 20 0 GGADMP CC[C@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000151488435 1417998695 /nfs/dbraw/zinc/99/86/95/1417998695.db2.gz XEMONXXOOICZOS-GOTSBHOMSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000151488435 1417998703 /nfs/dbraw/zinc/99/87/03/1417998703.db2.gz XEMONXXOOICZOS-GOTSBHOMSA-N 2 1 395.547 3.158 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3c[nH]nc3-c3ccccc3F)cc2)CC1 ZINC000151602586 1418037287 /nfs/dbraw/zinc/03/72/87/1418037287.db2.gz MBPWQUJSFVONCE-UHFFFAOYSA-N 2 1 393.510 3.253 20 0 GGADMP CCC[N@@H+](CC(=O)NC1CC[NH+](CC)CC1)[C@H]1C[C@H](OCC)C12CCCC2 ZINC000151651812 1418050977 /nfs/dbraw/zinc/05/09/77/1418050977.db2.gz QEPFVXOZIRZXOO-PMACEKPBSA-N 2 1 379.589 3.037 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[NH+]1C1CCOCC1 ZINC000152097440 1418144856 /nfs/dbraw/zinc/14/48/56/1418144856.db2.gz ASBJPQRNFCQCEB-GGAORHGYSA-N 2 1 399.579 3.000 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[N@@H+]1C1CCOCC1 ZINC000152097440 1418144859 /nfs/dbraw/zinc/14/48/59/1418144859.db2.gz ASBJPQRNFCQCEB-GGAORHGYSA-N 2 1 399.579 3.000 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[N@H+]1C1CCOCC1 ZINC000152097440 1418144867 /nfs/dbraw/zinc/14/48/67/1418144867.db2.gz ASBJPQRNFCQCEB-GGAORHGYSA-N 2 1 399.579 3.000 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000179010776 1429242046 /nfs/dbraw/zinc/24/20/46/1429242046.db2.gz NSCPZWBSXRLCFD-SFHVURJKSA-N 2 1 375.561 3.125 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)N(C)CCCn3cc[nH+]c3C)c(C)c2)CC1 ZINC000179038944 1429248006 /nfs/dbraw/zinc/24/80/06/1429248006.db2.gz FWDXGWCVDLVPIS-UHFFFAOYSA-N 2 1 398.555 3.196 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1 ZINC000179064586 1429253055 /nfs/dbraw/zinc/25/30/55/1429253055.db2.gz OVYHOOKKQOZUMG-UHFFFAOYSA-N 2 1 383.540 3.060 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000179064586 1429253061 /nfs/dbraw/zinc/25/30/61/1429253061.db2.gz OVYHOOKKQOZUMG-UHFFFAOYSA-N 2 1 383.540 3.060 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)NCc1ccccc1F ZINC000179389642 1429354603 /nfs/dbraw/zinc/35/46/03/1429354603.db2.gz OJOWQKGZFAWOFQ-UHFFFAOYSA-N 2 1 384.499 3.075 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(F)cc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179392427 1429355974 /nfs/dbraw/zinc/35/59/74/1429355974.db2.gz UODYUCODAWEFRK-SFHVURJKSA-N 2 1 398.526 3.464 20 0 GGADMP Cc1ccc(CNC(=O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1F ZINC000179393965 1429356636 /nfs/dbraw/zinc/35/66/36/1429356636.db2.gz GPOWFQXHTFZXEP-UHFFFAOYSA-N 2 1 398.526 3.384 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)N1CCc2ccccc2C1 ZINC000179395274 1429357507 /nfs/dbraw/zinc/35/75/07/1429357507.db2.gz ZRZVUTBADUJYAZ-UHFFFAOYSA-N 2 1 392.547 3.205 20 0 GGADMP C[C@H](C(=O)NCc1cccs1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179394359 1429357678 /nfs/dbraw/zinc/35/76/78/1429357678.db2.gz QFPAZDGDKRCACI-QGZVFWFLSA-N 2 1 386.565 3.386 20 0 GGADMP C[N@@H+](CCOc1cccc(C[NH2+]Cc2cccc3nccn32)c1)C1CCOCC1 ZINC000179423120 1429369373 /nfs/dbraw/zinc/36/93/73/1429369373.db2.gz ASGVBOVMDHEZDI-UHFFFAOYSA-N 2 1 394.519 3.114 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000179430867 1429372873 /nfs/dbraw/zinc/37/28/73/1429372873.db2.gz VROAENJVGFSZER-UHFFFAOYSA-N 2 1 395.551 3.249 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]2CCC[C@H]2c2ccncc2)CC1 ZINC000179569267 1429440537 /nfs/dbraw/zinc/44/05/37/1429440537.db2.gz BNEIZVHRUZVHOI-QHCPKHFHSA-N 2 1 392.547 3.308 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@H]2c2ccncc2)CC1 ZINC000179569267 1429440545 /nfs/dbraw/zinc/44/05/45/1429440545.db2.gz BNEIZVHRUZVHOI-QHCPKHFHSA-N 2 1 392.547 3.308 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH+]2CCC[C@@H]2c2ccncc2)CC1 ZINC000179575138 1429445220 /nfs/dbraw/zinc/44/52/20/1429445220.db2.gz PRXCLGALMLHKJS-HSZRJFAPSA-N 2 1 392.547 3.261 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)C[NH+]2CCC[C@@H]2c2ccncc2)CC1 ZINC000179575138 1429445236 /nfs/dbraw/zinc/44/52/36/1429445236.db2.gz PRXCLGALMLHKJS-HSZRJFAPSA-N 2 1 392.547 3.261 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@@H+]2CCC[C@@H]2c2ccncc2)CC1 ZINC000179575138 1429445238 /nfs/dbraw/zinc/44/52/38/1429445238.db2.gz PRXCLGALMLHKJS-HSZRJFAPSA-N 2 1 392.547 3.261 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@H+]2CCC[C@@H]2c2ccncc2)CC1 ZINC000179575138 1429445247 /nfs/dbraw/zinc/44/52/47/1429445247.db2.gz PRXCLGALMLHKJS-HSZRJFAPSA-N 2 1 392.547 3.261 20 0 GGADMP C[NH+](C)C[C@H]1CC[N@H+](Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000179636510 1429483362 /nfs/dbraw/zinc/48/33/62/1429483362.db2.gz CQAZEQVJELXJIO-HXUWFJFHSA-N 2 1 375.520 3.377 20 0 GGADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000179636510 1429483367 /nfs/dbraw/zinc/48/33/67/1429483367.db2.gz CQAZEQVJELXJIO-HXUWFJFHSA-N 2 1 375.520 3.377 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000152305168 1422067662 /nfs/dbraw/zinc/06/76/62/1422067662.db2.gz CWZZLDXOIOPKDV-NHCUHLMSSA-N 2 1 395.551 3.457 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000152305168 1422067669 /nfs/dbraw/zinc/06/76/69/1422067669.db2.gz CWZZLDXOIOPKDV-NHCUHLMSSA-N 2 1 395.551 3.457 20 0 GGADMP C[C@@H]([NH2+]C1(CNCc2ccc(-n3cncn3)cc2)CCOCC1)c1ccccc1 ZINC000152365203 1422084067 /nfs/dbraw/zinc/08/40/67/1422084067.db2.gz JLJVRRIBVHBOMW-LJQANCHMSA-N 2 1 391.519 3.257 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H](C)C[N@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000152482398 1422116013 /nfs/dbraw/zinc/11/60/13/1422116013.db2.gz IFFQHPGEDGPKHS-FCGDIQPGSA-N 2 1 375.561 3.158 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000152482398 1422116017 /nfs/dbraw/zinc/11/60/17/1422116017.db2.gz IFFQHPGEDGPKHS-FCGDIQPGSA-N 2 1 375.561 3.158 20 0 GGADMP C[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C[C@@H]1n1ccnc1 ZINC000152552447 1422140234 /nfs/dbraw/zinc/14/02/34/1422140234.db2.gz RUNHMXXMPZFJTO-UWJYYQICSA-N 2 1 399.514 3.279 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NC3CCC([NH+]4CCC(C)CC4)CC3)CC2)c1 ZINC000152730202 1422228174 /nfs/dbraw/zinc/22/81/74/1422228174.db2.gz OYEVTGYYCIGXBZ-UHFFFAOYSA-N 2 1 399.583 3.265 20 0 GGADMP Cc1c(C(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)cnn1-c1cc[nH+]cc1 ZINC000153020038 1422329280 /nfs/dbraw/zinc/32/92/80/1422329280.db2.gz GBJUORJECBMXRY-GOSISDBHSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1c(C(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)cnn1-c1cc[nH+]cc1 ZINC000153020038 1422329294 /nfs/dbraw/zinc/32/92/94/1422329294.db2.gz GBJUORJECBMXRY-GOSISDBHSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)Nc1ccnn1[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000153039463 1422335693 /nfs/dbraw/zinc/33/56/93/1422335693.db2.gz OHGLIBPHYZKBKJ-HXUWFJFHSA-N 2 1 392.507 3.254 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)Nc1ccnn1[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000153039463 1422335701 /nfs/dbraw/zinc/33/57/01/1422335701.db2.gz OHGLIBPHYZKBKJ-HXUWFJFHSA-N 2 1 392.507 3.254 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1)c1ccc(-n2cncn2)cc1 ZINC000153502567 1422574188 /nfs/dbraw/zinc/57/41/88/1422574188.db2.gz UNJBYMWACTWWOT-OALUTQOASA-N 2 1 391.519 3.339 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1)c1ccc(-n2cncn2)cc1 ZINC000153502567 1422574204 /nfs/dbraw/zinc/57/42/04/1422574204.db2.gz UNJBYMWACTWWOT-OALUTQOASA-N 2 1 391.519 3.339 20 0 GGADMP Cc1c(C(=O)NCC[C@@H](C)[N@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000153536968 1422592706 /nfs/dbraw/zinc/59/27/06/1422592706.db2.gz DOHKELJFHIJYRU-QGZVFWFLSA-N 2 1 377.492 3.216 20 0 GGADMP Cc1c(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000153536968 1422592715 /nfs/dbraw/zinc/59/27/15/1422592715.db2.gz DOHKELJFHIJYRU-QGZVFWFLSA-N 2 1 377.492 3.216 20 0 GGADMP CN(CC[NH+]1CCCC1)C(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000153574875 1422627388 /nfs/dbraw/zinc/62/73/88/1422627388.db2.gz ZZYWGJLJCOTDPF-APWZRJJASA-N 2 1 396.938 3.209 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cccc(NC(=O)OC(C)(C)C)c3)C2)CC1 ZINC000153616110 1422650403 /nfs/dbraw/zinc/65/04/03/1422650403.db2.gz GVYRJHCIJREZMV-FQEVSTJZSA-N 2 1 388.556 3.245 20 0 GGADMP O=C(CC1CCCC1)NCC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000153655206 1422681862 /nfs/dbraw/zinc/68/18/62/1422681862.db2.gz SHEKKVBRYKATMC-UHFFFAOYSA-N 2 1 375.532 3.119 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2cccc(-n3cnnn3)c2)cc1F ZINC000153685156 1422701833 /nfs/dbraw/zinc/70/18/33/1422701833.db2.gz PSPPOAFUDHPKKC-CQSZACIVSA-N 2 1 377.427 3.146 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2cccc(-n3cnnn3)c2)cc1F ZINC000153685061 1422702165 /nfs/dbraw/zinc/70/21/65/1422702165.db2.gz PSPPOAFUDHPKKC-AWEZNQCLSA-N 2 1 377.427 3.146 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000153688577 1422704171 /nfs/dbraw/zinc/70/41/71/1422704171.db2.gz XBSMDYHGYLIWRE-BWKNWUBXSA-N 3 1 392.591 3.439 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000153688662 1422704617 /nfs/dbraw/zinc/70/46/17/1422704617.db2.gz XBSMDYHGYLIWRE-OFVILXPXSA-N 3 1 392.591 3.439 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCN(Cc3cccnc3)CC2)cc1F ZINC000153733560 1422728805 /nfs/dbraw/zinc/72/88/05/1422728805.db2.gz RUPGWKUDYDRIOD-UHFFFAOYSA-N 2 1 379.483 3.469 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CC2(N3CCSCC3)CCCC2)[C@H](C)C1 ZINC000153811622 1422773176 /nfs/dbraw/zinc/77/31/76/1422773176.db2.gz WHWRHEPONILEQM-WOJBJXKFSA-N 2 1 383.646 3.075 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H](NCC2([NH+]3CCSCC3)CCCC2)[C@H](C)C1 ZINC000153811622 1422773196 /nfs/dbraw/zinc/77/31/96/1422773196.db2.gz WHWRHEPONILEQM-WOJBJXKFSA-N 2 1 383.646 3.075 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NCC2([NH+]3CCSCC3)CCCC2)[C@H](C)C1 ZINC000153811622 1422773210 /nfs/dbraw/zinc/77/32/10/1422773210.db2.gz WHWRHEPONILEQM-WOJBJXKFSA-N 2 1 383.646 3.075 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc(CN3CCCC3=O)c2)[C@H](C)C1 ZINC000153920316 1422811077 /nfs/dbraw/zinc/81/10/77/1422811077.db2.gz LSTIBNIBEJIPOR-DENIHFKCSA-N 2 1 387.568 3.036 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](CCC(=O)Nc2cccc(Cl)c2)CC1 ZINC000153927253 1422812073 /nfs/dbraw/zinc/81/20/73/1422812073.db2.gz VSFFBIRYUPCHMB-HDICACEKSA-N 2 1 392.975 3.159 20 0 GGADMP CC[N@@H+](CC(=O)Nc1c(C)cnn1[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CC1 ZINC000154054442 1422832727 /nfs/dbraw/zinc/83/27/27/1422832727.db2.gz SYQRJOFTMMBGAJ-HXUWFJFHSA-N 2 1 381.524 3.061 20 0 GGADMP CC[NH+](CC(=O)Nc1c(C)cnn1[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CC1 ZINC000154054442 1422832728 /nfs/dbraw/zinc/83/27/28/1422832728.db2.gz SYQRJOFTMMBGAJ-HXUWFJFHSA-N 2 1 381.524 3.061 20 0 GGADMP CC[NH+](CC(=O)Nc1c(C)cnn1[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000154054442 1422832729 /nfs/dbraw/zinc/83/27/29/1422832729.db2.gz SYQRJOFTMMBGAJ-HXUWFJFHSA-N 2 1 381.524 3.061 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H]3CCCC[N@H+]3CC(C)C)CC2)cs1 ZINC000154148415 1422846795 /nfs/dbraw/zinc/84/67/95/1422846795.db2.gz LJNNNQLGNSENLB-FQEVSTJZSA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H]3CCCC[N@@H+]3CC(C)C)CC2)cs1 ZINC000154148415 1422846799 /nfs/dbraw/zinc/84/67/99/1422846799.db2.gz LJNNNQLGNSENLB-FQEVSTJZSA-N 2 1 392.613 3.290 20 0 GGADMP O=C(NC[C@H]1CCCO1)c1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000154201428 1422854124 /nfs/dbraw/zinc/85/41/24/1422854124.db2.gz NNPXVUXBFFWNDM-HSZRJFAPSA-N 2 1 399.579 3.482 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000154395773 1422883493 /nfs/dbraw/zinc/88/34/93/1422883493.db2.gz IOCSBEJUKHSHBI-HXUWFJFHSA-N 2 1 384.524 3.017 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@]2(N3CCOCC3)CCSC2)cc1 ZINC000154443747 1422889575 /nfs/dbraw/zinc/88/95/75/1422889575.db2.gz HKXVAGVBHQEFKK-UWJYYQICSA-N 2 1 386.565 3.039 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2ccc(NC(=O)NC3CC3)cc2)CC1 ZINC000154460982 1422891751 /nfs/dbraw/zinc/89/17/51/1422891751.db2.gz ZNTCFLVYKKQTIG-GOSISDBHSA-N 2 1 387.572 3.039 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)C[N@@H+](C)[C@@H]2CCSC2)CCCC1)c1ccccc1 ZINC000154508067 1422898121 /nfs/dbraw/zinc/89/81/21/1422898121.db2.gz XYRGTWJNFCZURU-PKOBYXMFSA-N 2 1 375.582 3.204 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2cc(Cl)c(OC)cc2OC)CC1 ZINC000154530460 1422907046 /nfs/dbraw/zinc/90/70/46/1422907046.db2.gz BPDARNFGRWLNBV-INIZCTEOSA-N 2 1 383.964 3.426 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2cnn(-c3ccc(F)cc3)c2C)CC1 ZINC000154545874 1422918061 /nfs/dbraw/zinc/91/80/61/1422918061.db2.gz IVLXGCXGEACFLX-SFHVURJKSA-N 2 1 387.547 3.388 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4c3cc(F)cc4F)c2)C1 ZINC000154673006 1422996651 /nfs/dbraw/zinc/99/66/51/1422996651.db2.gz VGTABIGBMLZQBL-HTAPYJJXSA-N 2 1 399.485 3.439 20 0 GGADMP COc1ccc(COC[C@@H](O)C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000154736337 1423016267 /nfs/dbraw/zinc/01/62/67/1423016267.db2.gz SWFRHLMXGGLLJG-YADHBBJMSA-N 2 1 390.568 3.017 20 0 GGADMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cc1 ZINC000154881776 1423065923 /nfs/dbraw/zinc/06/59/23/1423065923.db2.gz CUYUSBCVIGLIEO-KRWDZBQOSA-N 2 1 389.565 3.286 20 0 GGADMP CCCS(=O)(=O)N1CCC([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000154920301 1423079993 /nfs/dbraw/zinc/07/99/93/1423079993.db2.gz AHNGNGJGRVGXII-INIZCTEOSA-N 2 1 390.553 3.036 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)[C@H]1C[NH+](C)CCO1 ZINC000155013511 1423115154 /nfs/dbraw/zinc/11/51/54/1423115154.db2.gz UBLFWBYXCUYAID-LAUBAEHRSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[N@@H+](C)C1CCCCC1)[C@H]1C[NH+](C)CCO1 ZINC000155013511 1423115169 /nfs/dbraw/zinc/11/51/69/1423115169.db2.gz UBLFWBYXCUYAID-LAUBAEHRSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@H]1C[N@H+](C)CCO1 ZINC000155013511 1423115183 /nfs/dbraw/zinc/11/51/83/1423115183.db2.gz UBLFWBYXCUYAID-LAUBAEHRSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@H]1C[N@@H+](C)CCO1 ZINC000155013511 1423115191 /nfs/dbraw/zinc/11/51/91/1423115191.db2.gz UBLFWBYXCUYAID-LAUBAEHRSA-N 2 1 388.556 3.292 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)[C@H]3CCC[N@H+]3C3CCOCC3)c2)CC1 ZINC000155171501 1423209956 /nfs/dbraw/zinc/20/99/56/1423209956.db2.gz ZMOMCKJBSKCRBX-HSZRJFAPSA-N 2 1 399.579 3.178 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)[C@@H]3CCC[N@H+]3C3CCOCC3)c2)CC1 ZINC000155171412 1423210045 /nfs/dbraw/zinc/21/00/45/1423210045.db2.gz ZMOMCKJBSKCRBX-QHCPKHFHSA-N 2 1 399.579 3.178 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000155613663 1423446292 /nfs/dbraw/zinc/44/62/92/1423446292.db2.gz AZKLBUCFSAIZEZ-KFKAGJAMSA-N 2 1 381.923 3.463 20 0 GGADMP CC[NH+]1CCCC[C@@H]1C(=O)NC[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000155613663 1423446303 /nfs/dbraw/zinc/44/63/03/1423446303.db2.gz AZKLBUCFSAIZEZ-KFKAGJAMSA-N 2 1 381.923 3.463 20 0 GGADMP CC[NH+]1CCCC[C@@H]1C(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000155613663 1423446311 /nfs/dbraw/zinc/44/63/11/1423446311.db2.gz AZKLBUCFSAIZEZ-KFKAGJAMSA-N 2 1 381.923 3.463 20 0 GGADMP C[N@@H+](CC(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1)[C@H]1CCSC1 ZINC000155666779 1423476319 /nfs/dbraw/zinc/47/63/19/1423476319.db2.gz USYNOOJSCNLMLF-SFHVURJKSA-N 2 1 396.000 3.106 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)c1ccccc1 ZINC000155672616 1423480020 /nfs/dbraw/zinc/48/00/20/1423480020.db2.gz MYCJKPSOONNQGZ-AVRDEDQJSA-N 2 1 380.536 3.416 20 0 GGADMP CC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cc(Br)ccc1O ZINC000155774208 1423529123 /nfs/dbraw/zinc/52/91/23/1423529123.db2.gz YSKNEYKVJDIKPE-NVXWUHKLSA-N 2 1 385.346 3.432 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)NC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000155793090 1423536404 /nfs/dbraw/zinc/53/64/04/1423536404.db2.gz FTDUKCZZFLUKPU-XMSQKQJNSA-N 2 1 384.568 3.308 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@H](C)[N@@H+]2CCC[C@@H](C)C2)c1 ZINC000155943026 1423604195 /nfs/dbraw/zinc/60/41/95/1423604195.db2.gz BWSBKKBHOKGYGK-IKGGRYGDSA-N 2 1 377.529 3.131 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC000155943026 1423604197 /nfs/dbraw/zinc/60/41/97/1423604197.db2.gz BWSBKKBHOKGYGK-IKGGRYGDSA-N 2 1 377.529 3.131 20 0 GGADMP CNS(=O)(=O)c1ccc([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cc1 ZINC000156228418 1423735735 /nfs/dbraw/zinc/73/57/35/1423735735.db2.gz ZEWYQHKGELXWDL-QZTJIDSGSA-N 2 1 389.565 3.156 20 0 GGADMP CNS(=O)(=O)c1ccc([C@@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)cc1 ZINC000156228418 1423735738 /nfs/dbraw/zinc/73/57/38/1423735738.db2.gz ZEWYQHKGELXWDL-QZTJIDSGSA-N 2 1 389.565 3.156 20 0 GGADMP CN(CCC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)CC(F)(F)F ZINC000156379174 1423802338 /nfs/dbraw/zinc/80/23/38/1423802338.db2.gz WUTDLMPRHQHKEL-UHFFFAOYSA-N 2 1 375.454 3.306 20 0 GGADMP Cc1cccc(S(=O)(=O)CCC[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000156473596 1423814804 /nfs/dbraw/zinc/81/48/04/1423814804.db2.gz DPYPQULWZPBNDJ-RTBURBONSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1cccc(S(=O)(=O)CCC[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000156473596 1423814809 /nfs/dbraw/zinc/81/48/09/1423814809.db2.gz DPYPQULWZPBNDJ-RTBURBONSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1cnn(-c2cc[nH+]cc2NC(=O)c2ccc(C[NH+]3CCSCC3)cc2)c1 ZINC000156629053 1423837879 /nfs/dbraw/zinc/83/78/79/1423837879.db2.gz DBSIHWCPUOPCPH-UHFFFAOYSA-N 2 1 393.516 3.377 20 0 GGADMP Cc1cnn(-c2cc[nH+]cc2NC(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000156626034 1423838024 /nfs/dbraw/zinc/83/80/24/1423838024.db2.gz ZJTBWRZUWQMXDD-LJQANCHMSA-N 2 1 375.476 3.426 20 0 GGADMP Cc1cnn(-c2cc[nH+]cc2NC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000156626034 1423838026 /nfs/dbraw/zinc/83/80/26/1423838026.db2.gz ZJTBWRZUWQMXDD-LJQANCHMSA-N 2 1 375.476 3.426 20 0 GGADMP CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]CC2([NH+]3CCCCC3)CCOCC2)C1 ZINC000156670939 1423844641 /nfs/dbraw/zinc/84/46/41/1423844641.db2.gz ZQMREJCGVLPOMB-GOSISDBHSA-N 2 1 381.561 3.011 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000156814975 1423869239 /nfs/dbraw/zinc/86/92/39/1423869239.db2.gz TZYMBBITQKCWLI-FGZHOGPDSA-N 2 1 380.536 3.485 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000156814975 1423869243 /nfs/dbraw/zinc/86/92/43/1423869243.db2.gz TZYMBBITQKCWLI-FGZHOGPDSA-N 2 1 380.536 3.485 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c(F)c1 ZINC000156893273 1423882072 /nfs/dbraw/zinc/88/20/72/1423882072.db2.gz BQQAUTDCGLHPLO-LPHOPBHVSA-N 2 1 399.510 3.382 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c(F)c1 ZINC000156893273 1423882074 /nfs/dbraw/zinc/88/20/74/1423882074.db2.gz BQQAUTDCGLHPLO-LPHOPBHVSA-N 2 1 399.510 3.382 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccnc(Cl)c1 ZINC000156930483 1423888270 /nfs/dbraw/zinc/88/82/70/1423888270.db2.gz OTDOMDXIMMKKMJ-KXBFYZLASA-N 2 1 386.927 3.283 20 0 GGADMP CC(C)n1cc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cn1 ZINC000156958306 1423893092 /nfs/dbraw/zinc/89/30/92/1423893092.db2.gz SQSSSOKJRUNHFE-XLIONFOSSA-N 2 1 383.540 3.012 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CC[N@@H+](CC(C)C)C1)c1ccsc1 ZINC000157322849 1423984559 /nfs/dbraw/zinc/98/45/59/1423984559.db2.gz FDRDUTBQHKWVCS-IEBWSBKVSA-N 2 1 380.602 3.408 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H]1CC[N@@H+](CC(C)C)C1)c1ccsc1 ZINC000157322702 1423984915 /nfs/dbraw/zinc/98/49/15/1423984915.db2.gz FDRDUTBQHKWVCS-MJGOQNOKSA-N 2 1 380.602 3.408 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CC[N@@H+](CC(C)C)C1)c1ccsc1 ZINC000157322547 1423985050 /nfs/dbraw/zinc/98/50/50/1423985050.db2.gz FDRDUTBQHKWVCS-PKOBYXMFSA-N 2 1 380.602 3.408 20 0 GGADMP O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000157413593 1424006034 /nfs/dbraw/zinc/00/60/34/1424006034.db2.gz CJKDQYUHNURSAS-FQEVSTJZSA-N 2 1 376.589 3.301 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000157567717 1424039777 /nfs/dbraw/zinc/03/97/77/1424039777.db2.gz LECATVBIUXPXON-IBGZPJMESA-N 2 1 390.547 3.067 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(Cl)ccc1OC ZINC000157638645 1424054050 /nfs/dbraw/zinc/05/40/50/1424054050.db2.gz VJOOILJKNDSEJV-MRXNPFEDSA-N 2 1 382.936 3.228 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(Cl)ccc1OC ZINC000157638794 1424055537 /nfs/dbraw/zinc/05/55/37/1424055537.db2.gz VJOOILJKNDSEJV-INIZCTEOSA-N 2 1 382.936 3.228 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)cc1F ZINC000157716725 1424072663 /nfs/dbraw/zinc/07/26/63/1424072663.db2.gz UMOPCSOPGNXHSI-IBGZPJMESA-N 2 1 399.514 3.480 20 0 GGADMP C(CN1CCC[C@@H]1C[NH+]1CCCCC1)C[N@@H+]1CCC[C@@H]1CN1CCCCC1 ZINC000157813564 1424094132 /nfs/dbraw/zinc/09/41/32/1424094132.db2.gz XCTXALRGXARTFV-DHIUTWEWSA-N 2 1 376.633 3.277 20 0 GGADMP C(CN1CCC[C@@H]1C[NH+]1CCCCC1)C[N@H+]1CCC[C@@H]1CN1CCCCC1 ZINC000157813564 1424094134 /nfs/dbraw/zinc/09/41/34/1424094134.db2.gz XCTXALRGXARTFV-DHIUTWEWSA-N 2 1 376.633 3.277 20 0 GGADMP CNC(=O)c1cccc(CC[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)c1 ZINC000157839285 1424099876 /nfs/dbraw/zinc/09/98/76/1424099876.db2.gz JUDJRFNJSQPGOC-UHFFFAOYSA-N 2 1 383.511 3.025 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(OC(F)F)c1 ZINC000157896004 1424115431 /nfs/dbraw/zinc/11/54/31/1424115431.db2.gz SPSZRIIVSVOGAK-MRXNPFEDSA-N 2 1 384.471 3.168 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(C)C)cc1F ZINC000158115919 1424170911 /nfs/dbraw/zinc/17/09/11/1424170911.db2.gz TZZUEXJZYOLSLK-QGZVFWFLSA-N 2 1 394.535 3.493 20 0 GGADMP C[N@H+](CCCN1C(=O)c2ccccc2C1=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000158155383 1424180893 /nfs/dbraw/zinc/18/08/93/1424180893.db2.gz BRAHTSDUFYZHDD-UHFFFAOYSA-N 2 1 391.515 3.269 20 0 GGADMP C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000158155383 1424180896 /nfs/dbraw/zinc/18/08/96/1424180896.db2.gz BRAHTSDUFYZHDD-UHFFFAOYSA-N 2 1 391.515 3.269 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)CC1 ZINC000158197788 1424192533 /nfs/dbraw/zinc/19/25/33/1424192533.db2.gz ZOBXAMOPHMIUBQ-GOSISDBHSA-N 2 1 388.556 3.418 20 0 GGADMP Cc1[nH+]c(N2CCOCC2)ccc1N[C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000180045168 1429711246 /nfs/dbraw/zinc/71/12/46/1429711246.db2.gz DXVCWKPCYCGPPU-QGZVFWFLSA-N 2 1 384.524 3.340 20 0 GGADMP CN(CC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C(=O)OC(C)(C)C ZINC000158657395 1424312409 /nfs/dbraw/zinc/31/24/09/1424312409.db2.gz UHUAOZZCGAIJDZ-UHFFFAOYSA-N 2 1 379.520 3.289 20 0 GGADMP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000158665985 1424314021 /nfs/dbraw/zinc/31/40/21/1424314021.db2.gz OBMYPBRUTYXLHW-KSZLIROESA-N 2 1 381.586 3.467 20 0 GGADMP CN(c1ccccc1)C1CC[NH+](CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)CC1 ZINC000158814791 1424349498 /nfs/dbraw/zinc/34/94/98/1424349498.db2.gz NTIXCLXJPRNTTD-QHCPKHFHSA-N 2 1 394.563 3.006 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCCCC2)cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158854723 1424357854 /nfs/dbraw/zinc/35/78/54/1424357854.db2.gz VWBDTAHYUZUROA-WOIUINJBSA-N 2 1 384.568 3.420 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CCN(Cc2ccc(S(=O)(=O)N(C)C)o2)CC1 ZINC000158859518 1424358673 /nfs/dbraw/zinc/35/86/73/1424358673.db2.gz SOOVVZQSDYSEDI-QGZVFWFLSA-N 2 1 397.585 3.006 20 0 GGADMP Cc1cccc2nc(C[NH+]3CCC(CC[N@@H+]4CCCC[C@H]4C)CC3)cc(=O)n12 ZINC000158912899 1424370734 /nfs/dbraw/zinc/37/07/34/1424370734.db2.gz JXVCTWWTEVDNLP-GOSISDBHSA-N 2 1 382.552 3.479 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CCN([C@@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000159017339 1424395943 /nfs/dbraw/zinc/39/59/43/1424395943.db2.gz XNNRBIPBRIVHQE-NVXWUHKLSA-N 2 1 375.479 3.126 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+]([C@@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000159017339 1424395953 /nfs/dbraw/zinc/39/59/53/1424395953.db2.gz XNNRBIPBRIVHQE-NVXWUHKLSA-N 2 1 375.479 3.126 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+]([C@@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000159017339 1424395965 /nfs/dbraw/zinc/39/59/65/1424395965.db2.gz XNNRBIPBRIVHQE-NVXWUHKLSA-N 2 1 375.479 3.126 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@H](C)[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000159057721 1424406961 /nfs/dbraw/zinc/40/69/61/1424406961.db2.gz HUKVBUICGLLHMS-LPHOPBHVSA-N 2 1 389.588 3.340 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@H](C)[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000159057721 1424406968 /nfs/dbraw/zinc/40/69/68/1424406968.db2.gz HUKVBUICGLLHMS-LPHOPBHVSA-N 2 1 389.588 3.340 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000159210296 1424444092 /nfs/dbraw/zinc/44/40/92/1424444092.db2.gz RWXFDHNMZRASFQ-CYBMUJFWSA-N 2 1 384.402 3.439 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000159210296 1424444093 /nfs/dbraw/zinc/44/40/93/1424444093.db2.gz RWXFDHNMZRASFQ-CYBMUJFWSA-N 2 1 384.402 3.439 20 0 GGADMP CC(C)c1nc(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCCC3)CC2)cs1 ZINC000159330663 1424487571 /nfs/dbraw/zinc/48/75/71/1424487571.db2.gz PUGWUDIYRRCBEP-UHFFFAOYSA-N 2 1 392.613 3.471 20 0 GGADMP CCCc1nc(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCCC3)CC2)cs1 ZINC000159340063 1424489768 /nfs/dbraw/zinc/48/97/68/1424489768.db2.gz WNJRGGBCOXHDMK-UHFFFAOYSA-N 2 1 392.613 3.300 20 0 GGADMP C[NH+](C)CCCC1CC[NH+](CN2C(=O)NC3(CCCCCCC3)C2=O)CC1 ZINC000160012202 1424562940 /nfs/dbraw/zinc/56/29/40/1424562940.db2.gz YAFRVMDWWMYHQO-UHFFFAOYSA-N 2 1 378.561 3.033 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1cccc(N2CCOC2=O)c1 ZINC000160568745 1424615397 /nfs/dbraw/zinc/61/53/97/1424615397.db2.gz FACYGRYKWVEJPJ-SFHVURJKSA-N 2 1 395.503 3.326 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(F)c(Cl)c3)c2)C1 ZINC000162078128 1424814282 /nfs/dbraw/zinc/81/42/82/1424814282.db2.gz BFAVUEXKRBQGRF-GOSISDBHSA-N 2 1 389.902 3.466 20 0 GGADMP COC(=O)c1ccc2[nH]cc(C(=O)C[NH+]3CCC(CCC[NH+](C)C)CC3)c2c1 ZINC000162180778 1424823942 /nfs/dbraw/zinc/82/39/42/1424823942.db2.gz WVVGDXMHVMHQDW-UHFFFAOYSA-N 2 1 385.508 3.191 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)CC2)nc(C)[nH+]1 ZINC000162253577 1424831519 /nfs/dbraw/zinc/83/15/19/1424831519.db2.gz UNMGOAOSGLALIL-GOSISDBHSA-N 3 1 397.567 3.353 20 0 GGADMP COCCOc1ccc([C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)cc1 ZINC000162252989 1424831715 /nfs/dbraw/zinc/83/17/15/1424831715.db2.gz BTQRNYUWCUHTMN-QGZVFWFLSA-N 2 1 384.524 3.438 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000162897840 1424901234 /nfs/dbraw/zinc/90/12/34/1424901234.db2.gz BHZGVROWCGIJNU-NRFANRHFSA-N 2 1 386.584 3.318 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(-n2cnnn2)c1 ZINC000163219742 1424961162 /nfs/dbraw/zinc/96/11/62/1424961162.db2.gz WZAZGMSGCCAKAI-WFXMLNOXSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(-n2cnnn2)c1 ZINC000163219742 1424961167 /nfs/dbraw/zinc/96/11/67/1424961167.db2.gz WZAZGMSGCCAKAI-WFXMLNOXSA-N 2 1 376.508 3.366 20 0 GGADMP Cn1cc([C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)c2cccc(F)c2)cn1 ZINC000180152055 1429763553 /nfs/dbraw/zinc/76/35/53/1429763553.db2.gz DEPJUPYSSRHSNK-QFIPXVFZSA-N 2 1 382.483 3.379 20 0 GGADMP O=C(CC1CC[NH2+]CC1)NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000165147790 1425166899 /nfs/dbraw/zinc/16/68/99/1425166899.db2.gz ODSLJTFOJJFRKH-FQEVSTJZSA-N 2 1 383.561 3.353 20 0 GGADMP O=C(CC1CC[NH2+]CC1)NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000165147790 1425166907 /nfs/dbraw/zinc/16/69/07/1425166907.db2.gz ODSLJTFOJJFRKH-FQEVSTJZSA-N 2 1 383.561 3.353 20 0 GGADMP C[C@H](CC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)C1CC[NH2+]CC1 ZINC000165479174 1425180637 /nfs/dbraw/zinc/18/06/37/1425180637.db2.gz WAPHOMRNPSZLBR-OAHLLOKOSA-N 2 1 379.495 3.071 20 0 GGADMP C[C@H]1C[C@H](NCc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)CC[N@H+]1C ZINC000165579508 1425186490 /nfs/dbraw/zinc/18/64/90/1425186490.db2.gz HRFHGQVQMILADD-MAUKXSAKSA-N 2 1 384.490 3.030 20 0 GGADMP CC[NH+](CC)CCOc1ccc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000166220338 1425208534 /nfs/dbraw/zinc/20/85/34/1425208534.db2.gz DMMCZMUYHWEPMT-VQTJNVASSA-N 2 1 375.557 3.132 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1OC ZINC000166220338 1425208538 /nfs/dbraw/zinc/20/85/38/1425208538.db2.gz DMMCZMUYHWEPMT-VQTJNVASSA-N 3 1 375.557 3.132 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000166220338 1425208540 /nfs/dbraw/zinc/20/85/40/1425208540.db2.gz DMMCZMUYHWEPMT-VQTJNVASSA-N 3 1 375.557 3.132 20 0 GGADMP FC(F)(F)c1ccc([C@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)N2CCOCC2)cc1 ZINC000166419926 1425212809 /nfs/dbraw/zinc/21/28/09/1425212809.db2.gz UCKDBRBPRAYJIE-ZCNNSNEGSA-N 2 1 397.485 3.295 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)Nc1cccc(C[NH+]2CCSCC2)c1C ZINC000166724267 1425216621 /nfs/dbraw/zinc/21/66/21/1425216621.db2.gz NNXOZOATEZDSLM-HXUWFJFHSA-N 2 1 385.533 3.191 20 0 GGADMP Cc1nc(C[NH+]2CCC(CNC(=O)CC[C@H]([NH3+])c3ccccc3)CC2)oc1C ZINC000168625028 1425239878 /nfs/dbraw/zinc/23/98/78/1425239878.db2.gz VRPFAZBDGSKHMI-FQEVSTJZSA-N 2 1 384.524 3.100 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)Nc1ccc(N2CCC(C[NH+](C)C)CC2)cc1 ZINC000169207199 1425243867 /nfs/dbraw/zinc/24/38/67/1425243867.db2.gz RXUDVDJXHUBUPU-JOCHJYFZSA-N 2 1 396.535 3.112 20 0 GGADMP Cn1cccc1[C@H]1CCCN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000170643118 1425272371 /nfs/dbraw/zinc/27/23/71/1425272371.db2.gz ROEVREWTEIBBCR-OAQYLSRUSA-N 2 1 398.576 3.350 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)CCCC[NH+]3CCOCC3)cc2)CC1 ZINC000170684102 1425297046 /nfs/dbraw/zinc/29/70/46/1425297046.db2.gz JOKXXHYDOKVNLL-UHFFFAOYSA-N 2 1 387.568 3.037 20 0 GGADMP Cc1nc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)cs1 ZINC000170823696 1425354698 /nfs/dbraw/zinc/35/46/98/1425354698.db2.gz JZCMZRSMOYFIIS-UHFFFAOYSA-N 2 1 375.538 3.231 20 0 GGADMP Cc1nc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cs1 ZINC000170823696 1425354706 /nfs/dbraw/zinc/35/47/06/1425354706.db2.gz JZCMZRSMOYFIIS-UHFFFAOYSA-N 2 1 375.538 3.231 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)CC1 ZINC000171043400 1425451854 /nfs/dbraw/zinc/45/18/54/1425451854.db2.gz KDZKPOHEUGCERC-MRXNPFEDSA-N 2 1 378.586 3.011 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)CC1 ZINC000171043400 1425451863 /nfs/dbraw/zinc/45/18/63/1425451863.db2.gz KDZKPOHEUGCERC-MRXNPFEDSA-N 2 1 378.586 3.011 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)NC2CC[NH+](CC3CC3)CC2)CC1 ZINC000171159051 1425516484 /nfs/dbraw/zinc/51/64/84/1425516484.db2.gz NHWHYQFWFGDLBW-UHFFFAOYSA-N 2 1 398.595 3.414 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC[N@@H+](C)Cc2ccccc2)cc1F ZINC000171169838 1425523502 /nfs/dbraw/zinc/52/35/02/1425523502.db2.gz FRJMBUWJLZULIM-UHFFFAOYSA-N 2 1 395.482 3.251 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC[N@H+](C)Cc2ccccc2)cc1F ZINC000171169838 1425523515 /nfs/dbraw/zinc/52/35/15/1425523515.db2.gz FRJMBUWJLZULIM-UHFFFAOYSA-N 2 1 395.482 3.251 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@@H](c1ccc(C)cc1)[NH+]1CCCC1 ZINC000171211918 1425542695 /nfs/dbraw/zinc/54/26/95/1425542695.db2.gz UNNGGLCEHRSLQU-RXVVDRJESA-N 2 1 383.540 3.272 20 0 GGADMP C[C@@H](C(=O)N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000171276756 1425589543 /nfs/dbraw/zinc/58/95/43/1425589543.db2.gz GKYMTZVJHCTPDV-HLNWXESRSA-N 2 1 385.552 3.352 20 0 GGADMP CCc1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000171305673 1425606050 /nfs/dbraw/zinc/60/60/50/1425606050.db2.gz LORJHKODUVCHGQ-CEXWTWQISA-N 2 1 387.568 3.397 20 0 GGADMP CCc1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000171305673 1425606057 /nfs/dbraw/zinc/60/60/57/1425606057.db2.gz LORJHKODUVCHGQ-CEXWTWQISA-N 2 1 387.568 3.397 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC1 ZINC000171309278 1425608937 /nfs/dbraw/zinc/60/89/37/1425608937.db2.gz OUAHEDXOKZYRNF-NRFANRHFSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000171309278 1425608945 /nfs/dbraw/zinc/60/89/45/1425608945.db2.gz OUAHEDXOKZYRNF-NRFANRHFSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC1 ZINC000171309278 1425608947 /nfs/dbraw/zinc/60/89/47/1425608947.db2.gz OUAHEDXOKZYRNF-NRFANRHFSA-N 2 1 384.568 3.024 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)[nH+]c1 ZINC000171474427 1425695622 /nfs/dbraw/zinc/69/56/22/1425695622.db2.gz XGEGWBBIOKOJLH-NRFANRHFSA-N 2 1 395.551 3.056 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)[nH+]c1 ZINC000171474427 1425695630 /nfs/dbraw/zinc/69/56/30/1425695630.db2.gz XGEGWBBIOKOJLH-NRFANRHFSA-N 2 1 395.551 3.056 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(OCc4ccccc4)cc3)C2)CC1 ZINC000171527244 1425717592 /nfs/dbraw/zinc/71/75/92/1425717592.db2.gz OZPLXEFWDOOLFR-HSZRJFAPSA-N 2 1 379.548 3.477 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(OCc4ccccc4)cc3)C2)CC1 ZINC000171527248 1425717951 /nfs/dbraw/zinc/71/79/51/1425717951.db2.gz OZPLXEFWDOOLFR-QHCPKHFHSA-N 2 1 379.548 3.477 20 0 GGADMP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000171587941 1425749044 /nfs/dbraw/zinc/74/90/44/1425749044.db2.gz RSPNMEVMCNBXIL-LPHOPBHVSA-N 2 1 380.964 3.362 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000171587941 1425749047 /nfs/dbraw/zinc/74/90/47/1425749047.db2.gz RSPNMEVMCNBXIL-LPHOPBHVSA-N 2 1 380.964 3.362 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+]1CC1CCCCC1)NC1CC[NH+](CC2CC2)CC1 ZINC000171768009 1425815268 /nfs/dbraw/zinc/81/52/68/1425815268.db2.gz QNNAQPRAFPAKMN-NRFANRHFSA-N 2 1 376.589 3.205 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000171768811 1425815570 /nfs/dbraw/zinc/81/55/70/1425815570.db2.gz VMOLKZLNJVFWMG-UHFFFAOYSA-N 2 1 387.568 3.181 20 0 GGADMP CC(C)n1cc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)cn1 ZINC000171841364 1425833179 /nfs/dbraw/zinc/83/31/79/1425833179.db2.gz NNBAOAGXAWEHNL-UHFFFAOYSA-N 2 1 386.540 3.243 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCC[NH+](C)CC2)cc1)[N@@H+]1CCc2ccccc2C1 ZINC000171864315 1425838251 /nfs/dbraw/zinc/83/82/51/1425838251.db2.gz ZXOCQQDWGZVMIT-LJQANCHMSA-N 2 1 392.547 3.214 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCC[NH+](C)CC2)cc1)[N@H+]1CCc2ccccc2C1 ZINC000171864315 1425838252 /nfs/dbraw/zinc/83/82/52/1425838252.db2.gz ZXOCQQDWGZVMIT-LJQANCHMSA-N 2 1 392.547 3.214 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCC[N@H+](C)CC2)cc1)[NH+]1CCc2ccccc2C1 ZINC000171864315 1425838254 /nfs/dbraw/zinc/83/82/54/1425838254.db2.gz ZXOCQQDWGZVMIT-LJQANCHMSA-N 2 1 392.547 3.214 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCC[N@@H+](C)CC2)cc1)[NH+]1CCc2ccccc2C1 ZINC000171864315 1425838257 /nfs/dbraw/zinc/83/82/57/1425838257.db2.gz ZXOCQQDWGZVMIT-LJQANCHMSA-N 2 1 392.547 3.214 20 0 GGADMP C[C@@H]([NH2+]C1(CNC(=O)CCCC[NH+]2CCOCC2)CCCC1)c1ccccc1 ZINC000172036301 1425879779 /nfs/dbraw/zinc/87/97/79/1425879779.db2.gz ZKZQWRUFBQSJNG-HXUWFJFHSA-N 2 1 387.568 3.269 20 0 GGADMP Cc1cc(NC(=O)C[NH+]2CCC(CC[NH+](C)C)CC2)n(-c2ccc(C)cc2)n1 ZINC000172359453 1426013678 /nfs/dbraw/zinc/01/36/78/1426013678.db2.gz XLZCQTNYIGZUMV-UHFFFAOYSA-N 2 1 383.540 3.091 20 0 GGADMP Cc1ccc(NCCCNC(=O)c2ccc(N3CC[NH+](C(C)C)CC3)cc2)[nH+]c1 ZINC000172364131 1426015478 /nfs/dbraw/zinc/01/54/78/1426015478.db2.gz ULVQDSKVSWOKAS-UHFFFAOYSA-N 2 1 395.551 3.152 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)CCCC[NH+]2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000172411822 1426030243 /nfs/dbraw/zinc/03/02/43/1426030243.db2.gz KNCVNKKELPKMCC-IRLDBZIGSA-N 2 1 387.568 3.000 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)CCCC[NH+]2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000172411822 1426030255 /nfs/dbraw/zinc/03/02/55/1426030255.db2.gz KNCVNKKELPKMCC-IRLDBZIGSA-N 2 1 387.568 3.000 20 0 GGADMP O=C(NC1CC[NH+](CCc2ccccc2)CC1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172537257 1426077500 /nfs/dbraw/zinc/07/75/00/1426077500.db2.gz FJENWQQJLMEFJN-UHFFFAOYSA-N 2 1 398.595 3.353 20 0 GGADMP O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172543030 1426080150 /nfs/dbraw/zinc/08/01/50/1426080150.db2.gz BELDZEWWDIFESJ-JOCHJYFZSA-N 2 1 384.568 3.483 20 0 GGADMP CC(C)(CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000172549384 1426082677 /nfs/dbraw/zinc/08/26/77/1426082677.db2.gz AIJQEDCDDDNDKZ-QFIPXVFZSA-N 2 1 398.595 3.483 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@@H+]1CCc2sccc2C1 ZINC000172550466 1426083028 /nfs/dbraw/zinc/08/30/28/1426083028.db2.gz MDUUWDPIZRSPNN-HKUYNNGSSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2sccc2C1 ZINC000172550466 1426083034 /nfs/dbraw/zinc/08/30/34/1426083034.db2.gz MDUUWDPIZRSPNN-HKUYNNGSSA-N 2 1 390.597 3.155 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[NH+](C2CCCC2)CC1 ZINC000172582247 1426097519 /nfs/dbraw/zinc/09/75/19/1426097519.db2.gz KVTNVIQOTBOCQZ-JOCHJYFZSA-N 2 1 398.595 3.211 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000172582247 1426097526 /nfs/dbraw/zinc/09/75/26/1426097526.db2.gz KVTNVIQOTBOCQZ-JOCHJYFZSA-N 2 1 398.595 3.211 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172582247 1426097533 /nfs/dbraw/zinc/09/75/33/1426097533.db2.gz KVTNVIQOTBOCQZ-JOCHJYFZSA-N 2 1 398.595 3.211 20 0 GGADMP C(CCN1CCC[C@@H]1C[NH+]1CCCC1)CC[N@H+]1CCC[C@@H]1CN1CCCC1 ZINC000172655326 1426129385 /nfs/dbraw/zinc/12/93/85/1426129385.db2.gz DDJMYFPGJACHSS-DHIUTWEWSA-N 2 1 376.633 3.277 20 0 GGADMP C(CC[NH+]1CCC[C@@H]1CN1CCCC1)CC[N@@H+]1CCC[C@@H]1CN1CCCC1 ZINC000172655326 1426129389 /nfs/dbraw/zinc/12/93/89/1426129389.db2.gz DDJMYFPGJACHSS-DHIUTWEWSA-N 2 1 376.633 3.277 20 0 GGADMP C(CC[NH+]1CCC[C@@H]1CN1CCCC1)CC[N@H+]1CCC[C@@H]1CN1CCCC1 ZINC000172655326 1426129395 /nfs/dbraw/zinc/12/93/95/1426129395.db2.gz DDJMYFPGJACHSS-DHIUTWEWSA-N 2 1 376.633 3.277 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000172694752 1426147328 /nfs/dbraw/zinc/14/73/28/1426147328.db2.gz ISNSWGOCIZZTDV-IBGZPJMESA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[C@H](C[NH+]4CCCCC4)C3)cc2)C[C@@H](C)O1 ZINC000172706884 1426152645 /nfs/dbraw/zinc/15/26/45/1426152645.db2.gz HASPWAMVIYRJLH-KCZVDYSFSA-N 2 1 399.579 3.244 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000173141323 1426362213 /nfs/dbraw/zinc/36/22/13/1426362213.db2.gz WHVWJQXHUNZBDI-SFHVURJKSA-N 2 1 376.545 3.213 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173300556 1426481278 /nfs/dbraw/zinc/48/12/78/1426481278.db2.gz IXAONGWERWSLQJ-SFHVURJKSA-N 2 1 389.565 3.110 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173300556 1426481293 /nfs/dbraw/zinc/48/12/93/1426481293.db2.gz IXAONGWERWSLQJ-SFHVURJKSA-N 2 1 389.565 3.110 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173300572 1426481586 /nfs/dbraw/zinc/48/15/86/1426481586.db2.gz IXAONGWERWSLQJ-GOSISDBHSA-N 2 1 389.565 3.110 20 0 GGADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173300572 1426481591 /nfs/dbraw/zinc/48/15/91/1426481591.db2.gz IXAONGWERWSLQJ-GOSISDBHSA-N 2 1 389.565 3.110 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NCC1([NH+]2CCCCC2)CCCCC1 ZINC000173346411 1426525086 /nfs/dbraw/zinc/52/50/86/1426525086.db2.gz XKSSQXRDGHCRJA-UHFFFAOYSA-N 2 1 375.561 3.460 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1 ZINC000173387713 1426565781 /nfs/dbraw/zinc/56/57/81/1426565781.db2.gz UXKNAXKCBCYONX-QGZVFWFLSA-N 2 1 389.565 3.239 20 0 GGADMP C[NH+]1CCC(N(Cc2ccco2)C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000173407452 1426590282 /nfs/dbraw/zinc/59/02/82/1426590282.db2.gz ILRUSESPLZCCGB-IBGZPJMESA-N 2 1 388.556 3.150 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000173430191 1426612126 /nfs/dbraw/zinc/61/21/26/1426612126.db2.gz GRDVQLLLYAVGHE-IBGZPJMESA-N 2 1 383.540 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000173430191 1426612136 /nfs/dbraw/zinc/61/21/36/1426612136.db2.gz GRDVQLLLYAVGHE-IBGZPJMESA-N 2 1 383.540 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000173436213 1426617805 /nfs/dbraw/zinc/61/78/05/1426617805.db2.gz YEWWPFAJHVFKBG-UHFFFAOYSA-N 2 1 397.567 3.322 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000173436213 1426617815 /nfs/dbraw/zinc/61/78/15/1426617815.db2.gz YEWWPFAJHVFKBG-UHFFFAOYSA-N 2 1 397.567 3.322 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cn2ccc(=O)c3cccc(Br)c32)C1 ZINC000173446054 1426625760 /nfs/dbraw/zinc/62/57/60/1426625760.db2.gz INCRHTVDXMADGM-OAHLLOKOSA-N 2 1 392.341 3.385 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cn2ccc(=O)c3cccc(Br)c32)C1 ZINC000173446054 1426625770 /nfs/dbraw/zinc/62/57/70/1426625770.db2.gz INCRHTVDXMADGM-OAHLLOKOSA-N 2 1 392.341 3.385 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cn2ccc(=O)c3cccc(Br)c32)C1 ZINC000173446054 1426625781 /nfs/dbraw/zinc/62/57/81/1426625781.db2.gz INCRHTVDXMADGM-OAHLLOKOSA-N 2 1 392.341 3.385 20 0 GGADMP C[NH+](C)CCC1CC[NH+](Cc2csc(CC(=O)Nc3ccccc3)n2)CC1 ZINC000173477881 1426652392 /nfs/dbraw/zinc/65/23/92/1426652392.db2.gz GCZHGJBJYJATHV-UHFFFAOYSA-N 2 1 386.565 3.488 20 0 GGADMP CSc1ccc(OCC[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000173596617 1426762746 /nfs/dbraw/zinc/76/27/46/1426762746.db2.gz XMWASQRDIMFLGU-KDURUIRLSA-N 2 1 377.598 3.278 20 0 GGADMP CSc1ccc(OCC[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000173596617 1426762758 /nfs/dbraw/zinc/76/27/58/1426762758.db2.gz XMWASQRDIMFLGU-KDURUIRLSA-N 2 1 377.598 3.278 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)CC1([NH+]2CCOCC2)CCCC1)c1ccccc1Cl ZINC000173663869 1426813774 /nfs/dbraw/zinc/81/37/74/1426813774.db2.gz VFQQFHOLTRCPTD-IBGZPJMESA-N 2 1 393.959 3.094 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000173785179 1426851076 /nfs/dbraw/zinc/85/10/76/1426851076.db2.gz LZEPYNHTJZPLMA-HXUWFJFHSA-N 2 1 397.567 3.481 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1 ZINC000173792878 1426852647 /nfs/dbraw/zinc/85/26/47/1426852647.db2.gz GPBZNZGYJKQCKR-HNNXBMFYSA-N 2 1 397.947 3.350 20 0 GGADMP C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000173868216 1426876375 /nfs/dbraw/zinc/87/63/75/1426876375.db2.gz BKZXWMDXQMDSAK-OAHLLOKOSA-N 2 1 390.915 3.495 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCN(c2ccn(C)n2)C1=O ZINC000173923829 1426893890 /nfs/dbraw/zinc/89/38/90/1426893890.db2.gz ZYZSIBKXAHZHKZ-GHTZIAJQSA-N 2 1 395.551 3.080 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)Nc2ccn(CC[NH+](C)C)n2)cc1 ZINC000173930694 1426897403 /nfs/dbraw/zinc/89/74/03/1426897403.db2.gz YXEOUVFVQPEOOM-GOSISDBHSA-N 2 1 398.555 3.141 20 0 GGADMP Cc1c(Cl)cccc1NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173945262 1426903370 /nfs/dbraw/zinc/90/33/70/1426903370.db2.gz PMMXEZYNLDPHPN-UHFFFAOYSA-N 2 1 379.932 3.164 20 0 GGADMP Cc1ccc(F)cc1NC(=O)[C@H](C)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173948824 1426905107 /nfs/dbraw/zinc/90/51/07/1426905107.db2.gz GQXLLVIHUGFVGO-KRWDZBQOSA-N 2 1 377.504 3.038 20 0 GGADMP C[C@@H](c1nc(-c2cccs2)no1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173950680 1426906466 /nfs/dbraw/zinc/90/64/66/1426906466.db2.gz OAXZJHMORSQYMV-HNNXBMFYSA-N 2 1 376.526 3.436 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1F ZINC000173950624 1426906696 /nfs/dbraw/zinc/90/66/96/1426906696.db2.gz KHLDIQDBNJIODU-KRWDZBQOSA-N 2 1 377.504 3.038 20 0 GGADMP CSc1ccc(NC(=O)[C@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000173962795 1426912796 /nfs/dbraw/zinc/91/27/96/1426912796.db2.gz YONGRZYMAUYHHX-KRWDZBQOSA-N 2 1 391.581 3.312 20 0 GGADMP COc1ccc(NC(=O)CC[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000173976982 1426921670 /nfs/dbraw/zinc/92/16/70/1426921670.db2.gz FALRUHRPWHKSCY-FQEVSTJZSA-N 2 1 381.520 3.478 20 0 GGADMP COc1ccc(NC(=O)CC[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000173976982 1426921679 /nfs/dbraw/zinc/92/16/79/1426921679.db2.gz FALRUHRPWHKSCY-FQEVSTJZSA-N 2 1 381.520 3.478 20 0 GGADMP COc1ccc(NC(=O)CC[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000173976982 1426921687 /nfs/dbraw/zinc/92/16/87/1426921687.db2.gz FALRUHRPWHKSCY-FQEVSTJZSA-N 2 1 381.520 3.478 20 0 GGADMP C[C@H](CNC(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1)C[NH+]1CCCC1 ZINC000174111226 1427006801 /nfs/dbraw/zinc/00/68/01/1427006801.db2.gz UOQTYPDVBUEPCO-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP C[C@H](CNC(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1)C[NH+]1CCCC1 ZINC000174111226 1427006808 /nfs/dbraw/zinc/00/68/08/1427006808.db2.gz UOQTYPDVBUEPCO-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH+]2CCC(C(F)(F)F)CC2)CC1 ZINC000174184542 1427037214 /nfs/dbraw/zinc/03/72/14/1427037214.db2.gz OSWXTEITBMFKTN-UHFFFAOYSA-N 2 1 397.485 3.350 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174220480 1427057582 /nfs/dbraw/zinc/05/75/82/1427057582.db2.gz QTYZTGRXTOFXLX-RXVVDRJESA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174220480 1427057590 /nfs/dbraw/zinc/05/75/90/1427057590.db2.gz QTYZTGRXTOFXLX-RXVVDRJESA-N 2 1 383.540 3.134 20 0 GGADMP Cc1cc(Cl)ccc1NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174241413 1427065537 /nfs/dbraw/zinc/06/55/37/1427065537.db2.gz WZKJJJQIAMOGFP-UHFFFAOYSA-N 2 1 379.932 3.164 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174241303 1427065703 /nfs/dbraw/zinc/06/57/03/1427065703.db2.gz WXPWBJZNUXLVCN-INIZCTEOSA-N 2 1 379.932 3.244 20 0 GGADMP CCCC[C@@H](C(=O)Nc1cc(C)on1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174240945 1427065898 /nfs/dbraw/zinc/06/58/98/1427065898.db2.gz DMMYHXPQDNDDSP-IBGZPJMESA-N 2 1 392.544 3.057 20 0 GGADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)C(=O)N(C)CCOc2ccc(Cl)cc2)CC1 ZINC000174296134 1427090242 /nfs/dbraw/zinc/09/02/42/1427090242.db2.gz DRDYADFREOJYLB-INIZCTEOSA-N 2 1 381.948 3.028 20 0 GGADMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000174335589 1427107562 /nfs/dbraw/zinc/10/75/62/1427107562.db2.gz PWJICHCDRKNZFZ-QZTJIDSGSA-N 2 1 385.487 3.088 20 0 GGADMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000174335589 1427107566 /nfs/dbraw/zinc/10/75/66/1427107566.db2.gz PWJICHCDRKNZFZ-QZTJIDSGSA-N 2 1 385.487 3.088 20 0 GGADMP Cc1ncsc1C[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000174344289 1427112185 /nfs/dbraw/zinc/11/21/85/1427112185.db2.gz JNNQSISANBHKOX-UHFFFAOYSA-N 2 1 375.538 3.231 20 0 GGADMP CC(C)[NH+](CCCNC(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)C(C)C ZINC000174359643 1427119286 /nfs/dbraw/zinc/11/92/86/1427119286.db2.gz FTLGFIXRGVOUJL-UHFFFAOYSA-N 2 1 390.572 3.192 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000174460422 1427167053 /nfs/dbraw/zinc/16/70/53/1427167053.db2.gz SFVCHDVQAAXZBM-OALUTQOASA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000174460422 1427167064 /nfs/dbraw/zinc/16/70/64/1427167064.db2.gz SFVCHDVQAAXZBM-OALUTQOASA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000174460422 1427167074 /nfs/dbraw/zinc/16/70/74/1427167074.db2.gz SFVCHDVQAAXZBM-OALUTQOASA-N 2 1 392.613 3.476 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000174496719 1427182424 /nfs/dbraw/zinc/18/24/24/1427182424.db2.gz LPCHPXIAXZDMBC-MOPGFXCFSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CC[C@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC000174496719 1427182429 /nfs/dbraw/zinc/18/24/29/1427182429.db2.gz LPCHPXIAXZDMBC-MOPGFXCFSA-N 2 1 383.540 3.134 20 0 GGADMP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](C)Cn1cc[nH+]c1C ZINC000174501012 1427186109 /nfs/dbraw/zinc/18/61/09/1427186109.db2.gz KWILNNSLGCDTSG-DENIHFKCSA-N 2 1 397.567 3.381 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](C)Cn1cc[nH+]c1C ZINC000174501012 1427186112 /nfs/dbraw/zinc/18/61/12/1427186112.db2.gz KWILNNSLGCDTSG-DENIHFKCSA-N 2 1 397.567 3.381 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](CCC(=O)Nc3c(Cl)cccc3Cl)C2)CC1 ZINC000174545360 1427215947 /nfs/dbraw/zinc/21/59/47/1427215947.db2.gz OLCWNIBGKMITPH-OAHLLOKOSA-N 2 1 399.366 3.034 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H](c2ccc(C)o2)[NH+]2CCCC2)C1 ZINC000174568184 1427228256 /nfs/dbraw/zinc/22/82/56/1427228256.db2.gz HXFMMUOFAYEEQR-OALUTQOASA-N 2 1 376.545 3.098 20 0 GGADMP O=C([C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000174568889 1427229335 /nfs/dbraw/zinc/22/93/35/1427229335.db2.gz XPXNHSZBASBEJE-NHCUHLMSSA-N 2 1 387.543 3.372 20 0 GGADMP O=C([C@@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000174568965 1427229957 /nfs/dbraw/zinc/22/99/57/1427229957.db2.gz RFBKZXHEXSBNAC-PZJWPPBQSA-N 2 1 387.593 3.111 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000174598545 1427249228 /nfs/dbraw/zinc/24/92/28/1427249228.db2.gz MRZJOBZJZYCJIP-IBGZPJMESA-N 2 1 387.572 3.085 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)NCCCCn3cc[nH+]c3C)c(C)c2)CC1 ZINC000174606744 1427257606 /nfs/dbraw/zinc/25/76/06/1427257606.db2.gz OZRBKSJTTPECPI-UHFFFAOYSA-N 2 1 398.555 3.244 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](C(C)C)CC1 ZINC000174689425 1427311025 /nfs/dbraw/zinc/31/10/25/1427311025.db2.gz WMFFRIPTVICOCC-OAQYLSRUSA-N 2 1 386.584 3.413 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NCCC1CC[NH+](C)CC1 ZINC000174710750 1427323599 /nfs/dbraw/zinc/32/35/99/1427323599.db2.gz SDUXKIUHISPXHF-UHFFFAOYSA-N 2 1 398.551 3.443 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NCCC1CC[NH+](C)CC1 ZINC000174710750 1427323607 /nfs/dbraw/zinc/32/36/07/1427323607.db2.gz SDUXKIUHISPXHF-UHFFFAOYSA-N 2 1 398.551 3.443 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCCC1CC[NH+](C)CC1 ZINC000174712845 1427324732 /nfs/dbraw/zinc/32/47/32/1427324732.db2.gz HFWIKQXYFIOPES-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000174712253 1427325051 /nfs/dbraw/zinc/32/50/51/1427325051.db2.gz QSBYUIUXWFUAGX-UHFFFAOYSA-N 2 1 380.536 3.008 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(CNC(=O)CC2([NH+]3CCOCC3)CCCC2)c1 ZINC000174767513 1427355973 /nfs/dbraw/zinc/35/59/73/1427355973.db2.gz SZSZOAWXIVBJDQ-UHFFFAOYSA-N 2 1 387.568 3.178 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCc1ccc(C[NH+](C)C)cc1 ZINC000174781021 1427363595 /nfs/dbraw/zinc/36/35/95/1427363595.db2.gz KXZGAEQPARQRER-HSZRJFAPSA-N 2 1 394.563 3.412 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000174803759 1427378019 /nfs/dbraw/zinc/37/80/19/1427378019.db2.gz PFHGHKRQAXGNAB-IBGZPJMESA-N 2 1 386.584 3.459 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](c1ncccc1C)C(C)C ZINC000174981891 1427478121 /nfs/dbraw/zinc/47/81/21/1427478121.db2.gz XDMCQTQCQHUHLP-VQTJNVASSA-N 2 1 389.588 3.145 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NC(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000175112528 1427552760 /nfs/dbraw/zinc/55/27/60/1427552760.db2.gz CUCJJHLBCGYODJ-IBGZPJMESA-N 2 1 394.519 3.037 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000175112528 1427552762 /nfs/dbraw/zinc/55/27/62/1427552762.db2.gz CUCJJHLBCGYODJ-IBGZPJMESA-N 2 1 394.519 3.037 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NC(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000175112509 1427552801 /nfs/dbraw/zinc/55/28/01/1427552801.db2.gz CUCJJHLBCGYODJ-LJQANCHMSA-N 2 1 394.519 3.037 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000175112509 1427552804 /nfs/dbraw/zinc/55/28/04/1427552804.db2.gz CUCJJHLBCGYODJ-LJQANCHMSA-N 2 1 394.519 3.037 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000175233336 1427615829 /nfs/dbraw/zinc/61/58/29/1427615829.db2.gz CRUWQGRKFBBUSK-OAQYLSRUSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@H]1CCN(C(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000175237033 1427618902 /nfs/dbraw/zinc/61/89/02/1427618902.db2.gz MKQNTSVVLDMHNQ-IBGZPJMESA-N 2 1 384.568 3.167 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000175237083 1427618954 /nfs/dbraw/zinc/61/89/54/1427618954.db2.gz HMRCQMVPZBXTGN-QFIPXVFZSA-N 2 1 398.595 3.414 20 0 GGADMP CC[NH+](CC)[C@H]1CCN(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)C1 ZINC000175252537 1427626484 /nfs/dbraw/zinc/62/64/84/1427626484.db2.gz LLVHCIGSZJSEMK-SFHVURJKSA-N 2 1 394.510 3.055 20 0 GGADMP C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000175251040 1427626548 /nfs/dbraw/zinc/62/65/48/1427626548.db2.gz ZULJEAHXVNKELS-INIZCTEOSA-N 2 1 392.588 3.449 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000175299808 1427659188 /nfs/dbraw/zinc/65/91/88/1427659188.db2.gz UYRGTACBESCWDI-HOJAQTOUSA-N 2 1 384.524 3.235 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@H+]1Cc1ccccc1 ZINC000175299808 1427659202 /nfs/dbraw/zinc/65/92/02/1427659202.db2.gz UYRGTACBESCWDI-HOJAQTOUSA-N 2 1 384.524 3.235 20 0 GGADMP C[C@H](CCNC(=O)NCc1cccc(C[NH+](C)C)c1)[N@@H+](C)Cc1ccccc1 ZINC000175301781 1427661265 /nfs/dbraw/zinc/66/12/65/1427661265.db2.gz HWHUPHYJDKUYAC-LJQANCHMSA-N 2 1 382.552 3.458 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)CC1 ZINC000175354856 1427701234 /nfs/dbraw/zinc/70/12/34/1427701234.db2.gz JOWUIAXLMGRJDV-HXUWFJFHSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000175391483 1427727565 /nfs/dbraw/zinc/72/75/65/1427727565.db2.gz PJNWYOWDBUDUCK-UHFFFAOYSA-N 2 1 383.540 3.244 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000175455860 1427764389 /nfs/dbraw/zinc/76/43/89/1427764389.db2.gz WHGVYHRJLHVWLP-HXUWFJFHSA-N 2 1 384.524 3.147 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000175455860 1427764393 /nfs/dbraw/zinc/76/43/93/1427764393.db2.gz WHGVYHRJLHVWLP-HXUWFJFHSA-N 2 1 384.524 3.147 20 0 GGADMP Cc1nccn1C[C@@H](C)CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473677 1427773887 /nfs/dbraw/zinc/77/38/87/1427773887.db2.gz NYMWLGUDMUHPIF-WAOWUJCRSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473677 1427773893 /nfs/dbraw/zinc/77/38/93/1427773893.db2.gz NYMWLGUDMUHPIF-WAOWUJCRSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473677 1427773897 /nfs/dbraw/zinc/77/38/97/1427773897.db2.gz NYMWLGUDMUHPIF-WAOWUJCRSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1nccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473734 1427774065 /nfs/dbraw/zinc/77/40/65/1427774065.db2.gz NYMWLGUDMUHPIF-OPYAIIAOSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473734 1427774074 /nfs/dbraw/zinc/77/40/74/1427774074.db2.gz NYMWLGUDMUHPIF-OPYAIIAOSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473734 1427774082 /nfs/dbraw/zinc/77/40/82/1427774082.db2.gz NYMWLGUDMUHPIF-OPYAIIAOSA-N 2 1 383.540 3.180 20 0 GGADMP CCC[N@@H+]1CC[C@@H](CNC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000175552218 1427812491 /nfs/dbraw/zinc/81/24/91/1427812491.db2.gz HUCMQZXJEZXQPZ-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000175552218 1427812492 /nfs/dbraw/zinc/81/24/92/1427812492.db2.gz HUCMQZXJEZXQPZ-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000175552218 1427812494 /nfs/dbraw/zinc/81/24/94/1427812494.db2.gz HUCMQZXJEZXQPZ-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000175552218 1427812495 /nfs/dbraw/zinc/81/24/95/1427812495.db2.gz HUCMQZXJEZXQPZ-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000175632496 1427838353 /nfs/dbraw/zinc/83/83/53/1427838353.db2.gz STNZSXQEGHTJMS-NNWRFLSQSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000175636011 1427839282 /nfs/dbraw/zinc/83/92/82/1427839282.db2.gz CLQPLYGOMNDZOB-BAGYTPMASA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000175636011 1427839285 /nfs/dbraw/zinc/83/92/85/1427839285.db2.gz CLQPLYGOMNDZOB-BAGYTPMASA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000175636011 1427839288 /nfs/dbraw/zinc/83/92/88/1427839288.db2.gz CLQPLYGOMNDZOB-BAGYTPMASA-N 2 1 386.584 3.413 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)N[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000175869794 1427942973 /nfs/dbraw/zinc/94/29/73/1427942973.db2.gz GPJKNPYWWJTLCF-RTWAWAEBSA-N 2 1 381.524 3.030 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000175869794 1427942976 /nfs/dbraw/zinc/94/29/76/1427942976.db2.gz GPJKNPYWWJTLCF-RTWAWAEBSA-N 2 1 381.524 3.030 20 0 GGADMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)N[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000175869814 1427943423 /nfs/dbraw/zinc/94/34/23/1427943423.db2.gz GPJKNPYWWJTLCF-NHCUHLMSSA-N 2 1 381.524 3.030 20 0 GGADMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000175869814 1427943432 /nfs/dbraw/zinc/94/34/32/1427943432.db2.gz GPJKNPYWWJTLCF-NHCUHLMSSA-N 2 1 381.524 3.030 20 0 GGADMP C[NH+](C)[C@H]1CCC[C@H](NC(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)C1 ZINC000175923388 1427974347 /nfs/dbraw/zinc/97/43/47/1427974347.db2.gz LKXQTLNVIIKSFD-ROUUACIJSA-N 2 1 394.510 3.101 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000176099804 1428082254 /nfs/dbraw/zinc/08/22/54/1428082254.db2.gz KOZFETJURYNNND-UHFFFAOYSA-N 2 1 389.569 3.245 20 0 GGADMP CC[NH+](CC)[C@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000176129121 1428102530 /nfs/dbraw/zinc/10/25/30/1428102530.db2.gz UZJMZEBCIXYLID-MSOLQXFVSA-N 2 1 378.586 3.086 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000176140002 1428113482 /nfs/dbraw/zinc/11/34/82/1428113482.db2.gz ZMYITHFYAXNLRT-NRFANRHFSA-N 2 1 386.584 3.413 20 0 GGADMP C[NH+](C)CCOc1ccccc1CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000176146374 1428117179 /nfs/dbraw/zinc/11/71/79/1428117179.db2.gz VZNXZSORJDMRNS-OAQYLSRUSA-N 2 1 399.510 3.047 20 0 GGADMP C[NH+](C)CCOc1ccccc1CNC(=O)[C@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000176146374 1428117181 /nfs/dbraw/zinc/11/71/81/1428117181.db2.gz VZNXZSORJDMRNS-OAQYLSRUSA-N 2 1 399.510 3.047 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000180293560 1429827421 /nfs/dbraw/zinc/82/74/21/1429827421.db2.gz SBBXCTJRMCGYQC-HSZRJFAPSA-N 2 1 392.547 3.469 20 0 GGADMP CCC[C@H]1CN(C(=O)NC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000180340290 1429839894 /nfs/dbraw/zinc/83/98/94/1429839894.db2.gz HGFYGKUORCKLLN-QFIPXVFZSA-N 2 1 384.568 3.309 20 0 GGADMP CCC[C@@H]1CN(C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000180383553 1429852310 /nfs/dbraw/zinc/85/23/10/1429852310.db2.gz DGFCJBQHFRQQIW-RBBKRZOGSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[C@@H]1CN(C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000180383553 1429852312 /nfs/dbraw/zinc/85/23/12/1429852312.db2.gz DGFCJBQHFRQQIW-RBBKRZOGSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[C@@H]1CN(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000180383553 1429852315 /nfs/dbraw/zinc/85/23/15/1429852315.db2.gz DGFCJBQHFRQQIW-RBBKRZOGSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N(C)CCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180396996 1429856577 /nfs/dbraw/zinc/85/65/77/1429856577.db2.gz QDWGSRDAHNSRTK-FQEVSTJZSA-N 2 1 387.572 3.061 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[N@@H+](C)C[C@H]1C(C)C ZINC000180622156 1429937954 /nfs/dbraw/zinc/93/79/54/1429937954.db2.gz IRCDJQCALBXOCG-IBGZPJMESA-N 2 1 376.545 3.211 20 0 GGADMP CC(C)OC(=O)C1(C(=O)OC(C)C)CC([NH2+]C2CC[NH+](C3CCCC3)CC2)C1 ZINC000180670160 1429966562 /nfs/dbraw/zinc/96/65/62/1429966562.db2.gz HUALPEGRWWJUTR-UHFFFAOYSA-N 2 1 394.556 3.035 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+]([C@H]2CC(=O)N(c3ccccc3F)C2=O)CC1 ZINC000180725866 1430002394 /nfs/dbraw/zinc/00/23/94/1430002394.db2.gz COWNIZMVCKYRAY-FQEVSTJZSA-N 2 1 389.515 3.292 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CCN1CC(F)(F)F ZINC000180834766 1430062911 /nfs/dbraw/zinc/06/29/11/1430062911.db2.gz QYLGJHHCJWERLB-QGZVFWFLSA-N 2 1 398.517 3.285 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CCN1CC(F)(F)F ZINC000180834766 1430062920 /nfs/dbraw/zinc/06/29/20/1430062920.db2.gz QYLGJHHCJWERLB-QGZVFWFLSA-N 2 1 398.517 3.285 20 0 GGADMP CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180879847 1430085578 /nfs/dbraw/zinc/08/55/78/1430085578.db2.gz WENFADWJYNZQJL-RBUKOAKNSA-N 2 1 395.588 3.305 20 0 GGADMP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000180907106 1430102459 /nfs/dbraw/zinc/10/24/59/1430102459.db2.gz LISPEYCDDBOFLO-QHCPKHFHSA-N 2 1 388.515 3.252 20 0 GGADMP CN(CC[N@@H+](C)Cc1ccc(C(=O)OC(C)(C)C)cc1)C1CC[NH+](C)CC1 ZINC000180934077 1430122947 /nfs/dbraw/zinc/12/29/47/1430122947.db2.gz IWYKZRBZNKLQAU-UHFFFAOYSA-N 2 1 375.557 3.100 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1nc2c(s1)CCCC2 ZINC000180996791 1430158645 /nfs/dbraw/zinc/15/86/45/1430158645.db2.gz YLFDPHXVTPEZJS-HNNXBMFYSA-N 2 1 386.565 3.164 20 0 GGADMP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000181244360 1430255378 /nfs/dbraw/zinc/25/53/78/1430255378.db2.gz PANKFJJSMHPECH-QFIPXVFZSA-N 2 1 380.536 3.449 20 0 GGADMP COc1ccc([C@H](CNC(=O)C[NH2+][C@H](C)c2cccnc2)[NH+]2CCCCC2)cc1 ZINC000181345969 1430278765 /nfs/dbraw/zinc/27/87/65/1430278765.db2.gz LWIMXGZOOAPDHM-GCJKJVERSA-N 2 1 396.535 3.084 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCCCC[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000181369166 1430282860 /nfs/dbraw/zinc/28/28/60/1430282860.db2.gz ZJZYRCIPJPFLLD-LJQANCHMSA-N 2 1 383.536 3.261 20 0 GGADMP COCCc1nc(C)c([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCOCC2)s1 ZINC000181371677 1430283285 /nfs/dbraw/zinc/28/32/85/1430283285.db2.gz ZPBLZDLFILYQKL-INIZCTEOSA-N 2 1 389.565 3.323 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)C[NH2+][C@H](C)c2cccc(O)c2)CC1 ZINC000181489129 1430309431 /nfs/dbraw/zinc/30/94/31/1430309431.db2.gz FZGYDUMZNCCIJZ-LJQANCHMSA-N 2 1 381.520 3.086 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH2+][C@H](C)c2cccc(O)c2)CC1 ZINC000181489129 1430309433 /nfs/dbraw/zinc/30/94/33/1430309433.db2.gz FZGYDUMZNCCIJZ-LJQANCHMSA-N 2 1 381.520 3.086 20 0 GGADMP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000181494885 1430310523 /nfs/dbraw/zinc/31/05/23/1430310523.db2.gz WSUFGIRFUFAOSK-HXUWFJFHSA-N 2 1 399.539 3.225 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000181518876 1430314116 /nfs/dbraw/zinc/31/41/16/1430314116.db2.gz QBPCILDHEGQLQQ-ZWKOTPCHSA-N 2 1 391.556 3.379 20 0 GGADMP Cc1ccc(C[N@H+]2CCCN(C(=O)C[NH2+][C@@H](C)c3cccc(O)c3)CC2)cc1 ZINC000181577509 1430322568 /nfs/dbraw/zinc/32/25/68/1430322568.db2.gz NSYBFIVMZWYCNT-IBGZPJMESA-N 2 1 381.520 3.086 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)C[NH2+][C@@H](C)c3cccc(O)c3)CC2)cc1 ZINC000181577509 1430322571 /nfs/dbraw/zinc/32/25/71/1430322571.db2.gz NSYBFIVMZWYCNT-IBGZPJMESA-N 2 1 381.520 3.086 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000181624759 1430329944 /nfs/dbraw/zinc/32/99/44/1430329944.db2.gz VHHAPXRECZNTPW-FRQCXROJSA-N 2 1 387.474 3.395 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N[C@@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)CC2)[nH+]c1 ZINC000181644331 1430333687 /nfs/dbraw/zinc/33/36/87/1430333687.db2.gz GFRRRFJBSQXYEG-ICSRJNTNSA-N 2 1 384.568 3.376 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N[C@@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)CC2)[nH+]c1 ZINC000181644331 1430333689 /nfs/dbraw/zinc/33/36/89/1430333689.db2.gz GFRRRFJBSQXYEG-ICSRJNTNSA-N 2 1 384.568 3.376 20 0 GGADMP CC(C)(C[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccccc1 ZINC000181782301 1430359039 /nfs/dbraw/zinc/35/90/39/1430359039.db2.gz NHDANPLSBZCXJL-OAQYLSRUSA-N 2 1 379.548 3.451 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCSCC1)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000181806806 1430364644 /nfs/dbraw/zinc/36/46/44/1430364644.db2.gz GYYTVNPQRWPQQE-GOSISDBHSA-N 2 1 388.581 3.185 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCC(O)CC1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000182069662 1430405586 /nfs/dbraw/zinc/40/55/86/1430405586.db2.gz UGIGOCMONFEJHG-LJQANCHMSA-N 2 1 385.552 3.236 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCC(O)CC1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000182069684 1430405601 /nfs/dbraw/zinc/40/56/01/1430405601.db2.gz UGIGOCMONFEJHG-IBGZPJMESA-N 2 1 385.552 3.236 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(F)c(F)c1 ZINC000182225123 1430432897 /nfs/dbraw/zinc/43/28/97/1430432897.db2.gz NPKICKCZRZXCPO-DENIHFKCSA-N 2 1 390.474 3.399 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc(F)c(F)c1 ZINC000182225123 1430432902 /nfs/dbraw/zinc/43/29/02/1430432902.db2.gz NPKICKCZRZXCPO-DENIHFKCSA-N 2 1 390.474 3.399 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000182226131 1430433018 /nfs/dbraw/zinc/43/30/18/1430433018.db2.gz VMQMKTVBIYIECV-HHXXYDBFSA-N 2 1 398.469 3.394 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000182226131 1430433020 /nfs/dbraw/zinc/43/30/20/1430433020.db2.gz VMQMKTVBIYIECV-HHXXYDBFSA-N 2 1 398.469 3.394 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000182226131 1430433022 /nfs/dbraw/zinc/43/30/22/1430433022.db2.gz VMQMKTVBIYIECV-HHXXYDBFSA-N 2 1 398.469 3.394 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc(-n2cncn2)cc1 ZINC000182225444 1430433038 /nfs/dbraw/zinc/43/30/38/1430433038.db2.gz QAPAYXJMDIJOIR-FDDCHVKYSA-N 2 1 391.519 3.075 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(F)c(F)c1 ZINC000182225107 1430433116 /nfs/dbraw/zinc/43/31/16/1430433116.db2.gz NPKICKCZRZXCPO-KNQAVFIVSA-N 2 1 390.474 3.399 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc(F)c(F)c1 ZINC000182225107 1430433118 /nfs/dbraw/zinc/43/31/18/1430433118.db2.gz NPKICKCZRZXCPO-KNQAVFIVSA-N 2 1 390.474 3.399 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc([S@@](C)=O)cc1 ZINC000182235415 1430434673 /nfs/dbraw/zinc/43/46/73/1430434673.db2.gz BRWLWVHTOQOPDS-NWBLWUIWSA-N 2 1 386.561 3.232 20 0 GGADMP Cc1cc2ncc([C@@H](C)[NH2+]Cc3ccccc3C[N@H+]3CCC[C@@H]3CO)c(C)n2n1 ZINC000182244564 1430436079 /nfs/dbraw/zinc/43/60/79/1430436079.db2.gz YJXJGXLQASWXJB-DYESRHJHSA-N 2 1 393.535 3.154 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)c(F)c1 ZINC000182256951 1430438432 /nfs/dbraw/zinc/43/84/32/1430438432.db2.gz RAAVDASMDYQWIW-GHTZIAJQSA-N 2 1 376.447 3.009 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(F)c(F)c1 ZINC000182256951 1430438433 /nfs/dbraw/zinc/43/84/33/1430438433.db2.gz RAAVDASMDYQWIW-GHTZIAJQSA-N 2 1 376.447 3.009 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(N2CCOC2=O)cc1 ZINC000182263237 1430439320 /nfs/dbraw/zinc/43/93/20/1430439320.db2.gz GPMUIOXNDBGDNF-JTSKRJEESA-N 2 1 395.503 3.061 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(N2CCCC2=O)cc1 ZINC000182272530 1430440714 /nfs/dbraw/zinc/44/07/14/1430440714.db2.gz AUYNSLLSKHZKKK-MBSDFSHPSA-N 2 1 393.531 3.231 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cccc(N2CCOC2=O)c1 ZINC000182271982 1430440899 /nfs/dbraw/zinc/44/08/99/1430440899.db2.gz KULAYPASGQARJV-JTSKRJEESA-N 2 1 395.503 3.061 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)CC1 ZINC000182302357 1430445050 /nfs/dbraw/zinc/44/50/50/1430445050.db2.gz SGUIEGBXNZQKMC-RBBKRZOGSA-N 2 1 384.568 3.085 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1cccc(F)c1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182363509 1430453734 /nfs/dbraw/zinc/45/37/34/1430453734.db2.gz BRESNHLXKXOMQT-MDKPJZGXSA-N 2 1 390.547 3.381 20 0 GGADMP C[C@H](NC(=O)NCCC[N@@H+](C)Cc1ccccc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182376165 1430455344 /nfs/dbraw/zinc/45/53/44/1430455344.db2.gz AYSAREHKFUXIAH-FPOVZHCZSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+](C)Cc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182376165 1430455345 /nfs/dbraw/zinc/45/53/45/1430455345.db2.gz AYSAREHKFUXIAH-FPOVZHCZSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+](C)Cc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182376165 1430455346 /nfs/dbraw/zinc/45/53/46/1430455346.db2.gz AYSAREHKFUXIAH-FPOVZHCZSA-N 2 1 386.584 3.461 20 0 GGADMP CC[C@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1c(C)noc1C ZINC000182392880 1430458743 /nfs/dbraw/zinc/45/87/43/1430458743.db2.gz ZHOSYBAMBIBDFJ-FQEVSTJZSA-N 2 1 384.524 3.244 20 0 GGADMP C[C@@H](NC(=O)NCCC[N@H+]1CCc2ccccc2C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182401803 1430460602 /nfs/dbraw/zinc/46/06/02/1430460602.db2.gz QDWXSJOPDGNYOC-TZIWHRDSSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+]1CCc2ccccc2C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182401803 1430460604 /nfs/dbraw/zinc/46/06/04/1430460604.db2.gz QDWXSJOPDGNYOC-TZIWHRDSSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+]1CCc2ccccc2C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182401803 1430460605 /nfs/dbraw/zinc/46/06/05/1430460605.db2.gz QDWXSJOPDGNYOC-TZIWHRDSSA-N 2 1 398.595 3.387 20 0 GGADMP COc1ccccc1CCC[NH+]1CCN(CC[N@@H+](C)Cc2ccccc2)CC1 ZINC000182469070 1430472786 /nfs/dbraw/zinc/47/27/86/1430472786.db2.gz MMESKSPIRURANW-UHFFFAOYSA-N 2 1 381.564 3.377 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)[NH+]1CCc2ccccc2C1 ZINC000182471439 1430473354 /nfs/dbraw/zinc/47/33/54/1430473354.db2.gz NCYSACUVMIKOTD-IRFCIJBXSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000182471439 1430473356 /nfs/dbraw/zinc/47/33/56/1430473356.db2.gz NCYSACUVMIKOTD-IRFCIJBXSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000182471439 1430473360 /nfs/dbraw/zinc/47/33/60/1430473360.db2.gz NCYSACUVMIKOTD-IRFCIJBXSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)[C@H]1CCCCN1C(=O)OC(C)(C)C ZINC000182633504 1430506249 /nfs/dbraw/zinc/50/62/49/1430506249.db2.gz OEXPTPMYNZOSEU-UYAOXDASSA-N 2 1 396.620 3.028 20 0 GGADMP C[C@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)[C@@H]1CCCCN1C(=O)OC(C)(C)C ZINC000182633456 1430506339 /nfs/dbraw/zinc/50/63/39/1430506339.db2.gz OEXPTPMYNZOSEU-ICSRJNTNSA-N 2 1 396.620 3.028 20 0 GGADMP C[C@@H](CCNC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)[NH+]1CCCCC1 ZINC000182673050 1430514652 /nfs/dbraw/zinc/51/46/52/1430514652.db2.gz HDWHROCJDFRWIC-IBGZPJMESA-N 2 1 390.547 3.308 20 0 GGADMP C[C@@H](CCNC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)[NH+]1CCCCC1 ZINC000182673050 1430514654 /nfs/dbraw/zinc/51/46/54/1430514654.db2.gz HDWHROCJDFRWIC-IBGZPJMESA-N 2 1 390.547 3.308 20 0 GGADMP C[C@H](NC(=O)NCC[N@@H+](C)Cc1ccc(F)cc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182689835 1430518140 /nfs/dbraw/zinc/51/81/40/1430518140.db2.gz GIRVAHAKTUDLJP-PKOBYXMFSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@H](NC(=O)NCC[NH+](C)Cc1ccc(F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182689835 1430518149 /nfs/dbraw/zinc/51/81/49/1430518149.db2.gz GIRVAHAKTUDLJP-PKOBYXMFSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@H](NC(=O)NCC[NH+](C)Cc1ccc(F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182689835 1430518159 /nfs/dbraw/zinc/51/81/59/1430518159.db2.gz GIRVAHAKTUDLJP-PKOBYXMFSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@H](CCNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCCCC1 ZINC000182712852 1430524622 /nfs/dbraw/zinc/52/46/22/1430524622.db2.gz YSCGEGDFXBWAHU-IFMALSPDSA-N 2 1 386.584 3.414 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+](CC(=O)Nc2ccc3c(c2)OCCO3)CC1 ZINC000182764356 1430536232 /nfs/dbraw/zinc/53/62/32/1430536232.db2.gz LVZQUMWPEZYOMI-UHFFFAOYSA-N 2 1 389.540 3.230 20 0 GGADMP C[C@H](NC(=O)N1CC[N@H+](C)C[C@@H]1c1ccccc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182834920 1430550073 /nfs/dbraw/zinc/55/00/73/1430550073.db2.gz PIQCLKUTBRCNFC-CZTZKLFOSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[N@@H+](C)C[C@@H]1c1ccccc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182834920 1430550074 /nfs/dbraw/zinc/55/00/74/1430550074.db2.gz PIQCLKUTBRCNFC-CZTZKLFOSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C)C[C@@H]1c1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182834920 1430550076 /nfs/dbraw/zinc/55/00/76/1430550076.db2.gz PIQCLKUTBRCNFC-CZTZKLFOSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C)C[C@@H]1c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182834920 1430550078 /nfs/dbraw/zinc/55/00/78/1430550078.db2.gz PIQCLKUTBRCNFC-CZTZKLFOSA-N 2 1 384.568 3.338 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)C1 ZINC000182861624 1430555838 /nfs/dbraw/zinc/55/58/38/1430555838.db2.gz VNZMGUVQIQXCQJ-QWFCFKBJSA-N 2 1 387.572 3.445 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000182861624 1430555845 /nfs/dbraw/zinc/55/58/45/1430555845.db2.gz VNZMGUVQIQXCQJ-QWFCFKBJSA-N 2 1 387.572 3.445 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)o1 ZINC000182866016 1430556688 /nfs/dbraw/zinc/55/66/88/1430556688.db2.gz SVFAHKCXOPJFRL-MOPGFXCFSA-N 2 1 390.572 3.314 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182869707 1430557878 /nfs/dbraw/zinc/55/78/78/1430557878.db2.gz GBHLWHCWLAZWHG-CTNGQTDRSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182869650 1430558160 /nfs/dbraw/zinc/55/81/60/1430558160.db2.gz GBHLWHCWLAZWHG-PZJWPPBQSA-N 2 1 386.584 3.413 20 0 GGADMP CS(=O)(=O)[C@H]1CCCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000182884752 1430561867 /nfs/dbraw/zinc/56/18/67/1430561867.db2.gz ROIHWAOJMNLHLO-PMACEKPBSA-N 2 1 399.000 3.497 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1cccs1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182914026 1430570246 /nfs/dbraw/zinc/57/02/46/1430570246.db2.gz TUBUGNKQHRJHOS-ROUUACIJSA-N 2 1 392.613 3.474 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182924611 1430573098 /nfs/dbraw/zinc/57/30/98/1430573098.db2.gz WRPRBIOWIXRIKC-FPOVZHCZSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182924611 1430573106 /nfs/dbraw/zinc/57/31/06/1430573106.db2.gz WRPRBIOWIXRIKC-FPOVZHCZSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182925476 1430573627 /nfs/dbraw/zinc/57/36/27/1430573627.db2.gz BKKJYRKKZQBYKF-PSHVLCQKSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182925476 1430573631 /nfs/dbraw/zinc/57/36/31/1430573631.db2.gz BKKJYRKKZQBYKF-PSHVLCQKSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182925476 1430573636 /nfs/dbraw/zinc/57/36/36/1430573636.db2.gz BKKJYRKKZQBYKF-PSHVLCQKSA-N 2 1 388.600 3.298 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1ccc(OCc2ccc(F)cc2)cc1 ZINC000182956002 1430580320 /nfs/dbraw/zinc/58/03/20/1430580320.db2.gz GXWYQPOKYIAAMN-UHFFFAOYSA-N 2 1 385.527 3.474 20 0 GGADMP COc1ccc([C@H](C)NCC2([NH+](C)C)CCOCC2)cc1C[NH+]1CCCCC1 ZINC000182967596 1430582213 /nfs/dbraw/zinc/58/22/13/1430582213.db2.gz XCTCBPMWUXWXLV-IBGZPJMESA-N 2 1 389.584 3.443 20 0 GGADMP COc1ccc([C@@H](C)NCC2([NH+](C)C)CCOCC2)cc1C[NH+]1CCCCC1 ZINC000182967611 1430582476 /nfs/dbraw/zinc/58/24/76/1430582476.db2.gz XCTCBPMWUXWXLV-LJQANCHMSA-N 2 1 389.584 3.443 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(F)c(F)c1 ZINC000183078794 1430607461 /nfs/dbraw/zinc/60/74/61/1430607461.db2.gz AKQKKKKLOOZOSP-JOCHJYFZSA-N 2 1 390.474 3.399 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCC[C@@H](C)[NH+]3CCCCC3)CC2)cs1 ZINC000183125883 1430621326 /nfs/dbraw/zinc/62/13/26/1430621326.db2.gz LWIYKEPBIQLOTN-MRXNPFEDSA-N 2 1 378.586 3.044 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183128741 1430623134 /nfs/dbraw/zinc/62/31/34/1430623134.db2.gz GVZHGFXDBFAOOF-CCDWMCETSA-N 3 1 398.639 3.294 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183128741 1430623140 /nfs/dbraw/zinc/62/31/40/1430623140.db2.gz GVZHGFXDBFAOOF-CCDWMCETSA-N 3 1 398.639 3.294 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183128741 1430623145 /nfs/dbraw/zinc/62/31/45/1430623145.db2.gz GVZHGFXDBFAOOF-CCDWMCETSA-N 3 1 398.639 3.294 20 0 GGADMP CC(C)(C)S(=O)(=O)CC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000183151125 1430629759 /nfs/dbraw/zinc/62/97/59/1430629759.db2.gz KQXKHXUEZVZUAB-HSALFYBXSA-N 2 1 378.582 3.090 20 0 GGADMP CC(C)(C)S(=O)(=O)CC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000183151125 1430629764 /nfs/dbraw/zinc/62/97/64/1430629764.db2.gz KQXKHXUEZVZUAB-HSALFYBXSA-N 2 1 378.582 3.090 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000183189145 1430643256 /nfs/dbraw/zinc/64/32/56/1430643256.db2.gz YTOCVRUREQPYNL-JENIJYKNSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000183197638 1430645344 /nfs/dbraw/zinc/64/53/44/1430645344.db2.gz DRYPZUBVQCTVNF-ZHALLVOQSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000183197638 1430645350 /nfs/dbraw/zinc/64/53/50/1430645350.db2.gz DRYPZUBVQCTVNF-ZHALLVOQSA-N 2 1 393.597 3.241 20 0 GGADMP Cn1ccnc1[C@H]([NH2+]CCCCN1CC[NH+](Cc2ccccc2)CC1)C1CC1 ZINC000183250766 1430659539 /nfs/dbraw/zinc/65/95/39/1430659539.db2.gz CWTRAYDXRKFVSF-JOCHJYFZSA-N 2 1 381.568 3.059 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@@H]4C[N@@H+](C)CC[C@H]43)CC2)CC1 ZINC000183376443 1430694758 /nfs/dbraw/zinc/69/47/58/1430694758.db2.gz SJVVISBRHXMHLZ-WCHWRFHJSA-N 2 1 376.589 3.155 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cn1 ZINC000183433390 1430710995 /nfs/dbraw/zinc/71/09/95/1430710995.db2.gz PXTZQRHRJYQCSE-GOSISDBHSA-N 2 1 385.512 3.455 20 0 GGADMP CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]CC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC000183600856 1430751854 /nfs/dbraw/zinc/75/18/54/1430751854.db2.gz UQHJFCLGSIQUEP-IBGZPJMESA-N 2 1 395.588 3.401 20 0 GGADMP COc1ccccc1CCNC(=O)C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000183685914 1430772488 /nfs/dbraw/zinc/77/24/88/1430772488.db2.gz HVPFJOOHBWFUIN-QGZVFWFLSA-N 2 1 392.503 3.199 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]C3(Cc4ccccc4)CCCCC3)cn2)CC1 ZINC000183769777 1430790625 /nfs/dbraw/zinc/79/06/25/1430790625.db2.gz VAEKJIRJTRXEOV-UHFFFAOYSA-N 2 1 379.552 3.264 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(C(F)F)cc3)CC2)CC1 ZINC000183943641 1430816119 /nfs/dbraw/zinc/81/61/19/1430816119.db2.gz AADWJKOSLNFDHT-UHFFFAOYSA-N 2 1 379.495 3.390 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCC2(C[NH+](C)C)CCCC2)cc1)[NH+]1CCOCC1 ZINC000184014747 1430829205 /nfs/dbraw/zinc/82/92/05/1430829205.db2.gz HAMTZANXCNHHJW-GOSISDBHSA-N 2 1 388.556 3.323 20 0 GGADMP O=C1C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)CN1Cc1ccccc1C(F)(F)F ZINC000184670743 1430937507 /nfs/dbraw/zinc/93/75/07/1430937507.db2.gz YKSNBGJCLBUYRV-YESZJQIVSA-N 2 1 381.442 3.023 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 ZINC000184672351 1430937881 /nfs/dbraw/zinc/93/78/81/1430937881.db2.gz IBTPXJLTSRPOOM-GZOSKZMVSA-N 2 1 383.458 3.125 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)NC(=O)Nc1ccccc1 ZINC000184740291 1430960562 /nfs/dbraw/zinc/96/05/62/1430960562.db2.gz CKANSMQURBJSSK-QZTJIDSGSA-N 2 1 394.519 3.081 20 0 GGADMP COc1cccc(NC(=O)C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000184740682 1430960693 /nfs/dbraw/zinc/96/06/93/1430960693.db2.gz WCEYEYKWQGCKQC-ROUUACIJSA-N 2 1 381.520 3.380 20 0 GGADMP Cc1ccsc1CNC(=O)C[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000184747296 1430963817 /nfs/dbraw/zinc/96/38/17/1430963817.db2.gz WDRPKXAZABQPKV-ROUUACIJSA-N 2 1 385.577 3.419 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)N1CCc2ccccc21 ZINC000184753540 1430966522 /nfs/dbraw/zinc/96/65/22/1430966522.db2.gz HFFMXMROKXMLRO-RTBURBONSA-N 2 1 377.532 3.322 20 0 GGADMP CCOc1cc2[nH+]ccc(N[C@@H](C)CCN3CC[NH+](C)CC3)c2cc1OCC ZINC000184826361 1430992580 /nfs/dbraw/zinc/99/25/80/1430992580.db2.gz JBXWHMBUOPCGQP-KRWDZBQOSA-N 2 1 386.540 3.470 20 0 GGADMP C[C@H](CCNC(=O)NC[C@@H](C)[N@@H+]1CCc2sccc2C1)[NH+]1CCCCC1 ZINC000184869405 1431008299 /nfs/dbraw/zinc/00/82/99/1431008299.db2.gz SPKGBJACIWKWAS-IAGOWNOFSA-N 2 1 378.586 3.058 20 0 GGADMP C[C@H](CCNC(=O)NC[C@@H](C)[N@H+]1CCc2sccc2C1)[NH+]1CCCCC1 ZINC000184869405 1431008309 /nfs/dbraw/zinc/00/83/09/1431008309.db2.gz SPKGBJACIWKWAS-IAGOWNOFSA-N 2 1 378.586 3.058 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1cccc(N2CC[NH+](CC)CC2)c1 ZINC000184885794 1431012660 /nfs/dbraw/zinc/01/26/60/1431012660.db2.gz HWUWQVADAHARGV-FQEVSTJZSA-N 2 1 387.572 3.215 20 0 GGADMP CN(C(=O)NC1Cc2ccccc2C1)[C@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000184923979 1431022380 /nfs/dbraw/zinc/02/23/80/1431022380.db2.gz QNILRIVDDHHPMI-PKTZIBPZSA-N 2 1 398.595 3.132 20 0 GGADMP CN(C(=O)NC1Cc2ccccc2C1)[C@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000184923999 1431022444 /nfs/dbraw/zinc/02/24/44/1431022444.db2.gz QNILRIVDDHHPMI-GOTSBHOMSA-N 2 1 398.595 3.132 20 0 GGADMP Cc1nc2c(s1)[C@H]([N@@H+](C)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)CCC2 ZINC000184984639 1431036247 /nfs/dbraw/zinc/03/62/47/1431036247.db2.gz NFBBDXLDYFPIFX-MOPGFXCFSA-N 2 1 386.565 3.180 20 0 GGADMP Cc1nc2c(s1)[C@H]([N@H+](C)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)CCC2 ZINC000184984639 1431036254 /nfs/dbraw/zinc/03/62/54/1431036254.db2.gz NFBBDXLDYFPIFX-MOPGFXCFSA-N 2 1 386.565 3.180 20 0 GGADMP CC(C)[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000185082605 1431056603 /nfs/dbraw/zinc/05/66/03/1431056603.db2.gz SNHDWPPRSVHHIX-IFMALSPDSA-N 2 1 379.552 3.278 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000185363310 1431126627 /nfs/dbraw/zinc/12/66/27/1431126627.db2.gz FGEZWOWZYGWIHI-UHFFFAOYSA-N 2 1 392.975 3.288 20 0 GGADMP CC[C@@H]1CN(C(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000185472767 1431152961 /nfs/dbraw/zinc/15/29/61/1431152961.db2.gz NZZWJGVENZSEAJ-JOCHJYFZSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCc1ccc(Cl)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185660034 1431198636 /nfs/dbraw/zinc/19/86/36/1431198636.db2.gz RYZHOOUNSQYIDE-AEFFLSMTSA-N 2 1 377.960 3.241 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185660034 1431198641 /nfs/dbraw/zinc/19/86/41/1431198641.db2.gz RYZHOOUNSQYIDE-AEFFLSMTSA-N 2 1 377.960 3.241 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCc1ccc(Cl)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185660003 1431198925 /nfs/dbraw/zinc/19/89/25/1431198925.db2.gz RYZHOOUNSQYIDE-SJLPKXTDSA-N 2 1 377.960 3.241 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185660003 1431198928 /nfs/dbraw/zinc/19/89/28/1431198928.db2.gz RYZHOOUNSQYIDE-SJLPKXTDSA-N 2 1 377.960 3.241 20 0 GGADMP Cc1cccc(C)c1OCCNC(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185668855 1431201051 /nfs/dbraw/zinc/20/10/51/1431201051.db2.gz NGAZKXHUNKFLPW-WOJBJXKFSA-N 2 1 387.568 3.041 20 0 GGADMP Cc1cccc(C)c1OCCNC(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185668855 1431201054 /nfs/dbraw/zinc/20/10/54/1431201054.db2.gz NGAZKXHUNKFLPW-WOJBJXKFSA-N 2 1 387.568 3.041 20 0 GGADMP Cc1cccc(C)c1OCCNC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185668834 1431201206 /nfs/dbraw/zinc/20/12/06/1431201206.db2.gz NGAZKXHUNKFLPW-VQTJNVASSA-N 2 1 387.568 3.041 20 0 GGADMP Cc1cccc(C)c1OCCNC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185668834 1431201209 /nfs/dbraw/zinc/20/12/09/1431201209.db2.gz NGAZKXHUNKFLPW-VQTJNVASSA-N 2 1 387.568 3.041 20 0 GGADMP CCOC(=O)c1ccc(NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185669597 1431201351 /nfs/dbraw/zinc/20/13/51/1431201351.db2.gz UFJRBYGGHAXBJE-SJLPKXTDSA-N 2 1 387.524 3.044 20 0 GGADMP CCOC(=O)c1ccc(NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185669597 1431201353 /nfs/dbraw/zinc/20/13/53/1431201353.db2.gz UFJRBYGGHAXBJE-SJLPKXTDSA-N 2 1 387.524 3.044 20 0 GGADMP CCN(Cc1cccc(F)c1)C(=O)C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185688850 1431206438 /nfs/dbraw/zinc/20/64/38/1431206438.db2.gz PQHZZCFKMMWDFG-MJGOQNOKSA-N 2 1 375.532 3.417 20 0 GGADMP CCN(Cc1cccc(F)c1)C(=O)C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185688850 1431206443 /nfs/dbraw/zinc/20/64/43/1431206443.db2.gz PQHZZCFKMMWDFG-MJGOQNOKSA-N 2 1 375.532 3.417 20 0 GGADMP CCN(Cc1cccc(F)c1)C(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185688795 1431206824 /nfs/dbraw/zinc/20/68/24/1431206824.db2.gz PQHZZCFKMMWDFG-PKOBYXMFSA-N 2 1 375.532 3.417 20 0 GGADMP CCN(Cc1cccc(F)c1)C(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185688795 1431206830 /nfs/dbraw/zinc/20/68/30/1431206830.db2.gz PQHZZCFKMMWDFG-PKOBYXMFSA-N 2 1 375.532 3.417 20 0 GGADMP C[C@@H]([NH2+]CCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185691022 1431207063 /nfs/dbraw/zinc/20/70/63/1431207063.db2.gz SLXIXBUFNKTDGH-MSOLQXFVSA-N 2 1 383.536 3.305 20 0 GGADMP C[C@H]([NH2+]CCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185690968 1431207328 /nfs/dbraw/zinc/20/73/28/1431207328.db2.gz SLXIXBUFNKTDGH-ZWKOTPCHSA-N 2 1 383.536 3.305 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000185697961 1431209426 /nfs/dbraw/zinc/20/94/26/1431209426.db2.gz XIVPWUFMATXLRU-ZWKOTPCHSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC000185697961 1431209429 /nfs/dbraw/zinc/20/94/29/1431209429.db2.gz XIVPWUFMATXLRU-ZWKOTPCHSA-N 2 1 386.540 3.194 20 0 GGADMP CCOCc1ccccc1CNC(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185711943 1431212675 /nfs/dbraw/zinc/21/26/75/1431212675.db2.gz LWTDUIQSCSIJGM-ICSRJNTNSA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccccc1CNC(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185711943 1431212680 /nfs/dbraw/zinc/21/26/80/1431212680.db2.gz LWTDUIQSCSIJGM-ICSRJNTNSA-N 2 1 387.568 3.082 20 0 GGADMP CCCOc1ccc(CNC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185712045 1431212944 /nfs/dbraw/zinc/21/29/44/1431212944.db2.gz CDDGVDPAYANFPC-QUCCMNQESA-N 2 1 387.568 3.334 20 0 GGADMP CCCOc1ccc(CNC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185712045 1431212948 /nfs/dbraw/zinc/21/29/48/1431212948.db2.gz CDDGVDPAYANFPC-QUCCMNQESA-N 2 1 387.568 3.334 20 0 GGADMP CCOCc1ccccc1CNC(=O)C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185711960 1431212989 /nfs/dbraw/zinc/21/29/89/1431212989.db2.gz LWTDUIQSCSIJGM-QUCCMNQESA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccccc1CNC(=O)C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185711960 1431212990 /nfs/dbraw/zinc/21/29/90/1431212990.db2.gz LWTDUIQSCSIJGM-QUCCMNQESA-N 2 1 387.568 3.082 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)C(=O)NC(=O)Nc1ccccc1F ZINC000185714801 1431213831 /nfs/dbraw/zinc/21/38/31/1431213831.db2.gz YWYKCGSAUVKCDK-JYJNAYRXSA-N 2 1 390.503 3.105 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C(=O)NC(=O)Nc1ccccc1F ZINC000185714801 1431213832 /nfs/dbraw/zinc/21/38/32/1431213832.db2.gz YWYKCGSAUVKCDK-JYJNAYRXSA-N 2 1 390.503 3.105 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185740930 1431220333 /nfs/dbraw/zinc/22/03/33/1431220333.db2.gz UHOCLLFACFPBLO-LSDHHAIUSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185740930 1431220338 /nfs/dbraw/zinc/22/03/38/1431220338.db2.gz UHOCLLFACFPBLO-LSDHHAIUSA-N 2 1 381.467 3.469 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000185741880 1431220646 /nfs/dbraw/zinc/22/06/46/1431220646.db2.gz MIINHHASKUSBMM-YESZJQIVSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1OC ZINC000185741880 1431220649 /nfs/dbraw/zinc/22/06/49/1431220649.db2.gz MIINHHASKUSBMM-YESZJQIVSA-N 2 1 389.540 3.273 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC000185742100 1431221183 /nfs/dbraw/zinc/22/11/83/1431221183.db2.gz UAUPUEWCEGAJFU-MSOLQXFVSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC000185742100 1431221194 /nfs/dbraw/zinc/22/11/94/1431221194.db2.gz UAUPUEWCEGAJFU-MSOLQXFVSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(S(=O)(=O)CCC[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185744037 1431221686 /nfs/dbraw/zinc/22/16/86/1431221686.db2.gz QOVSAFGHCMIUGO-MOPGFXCFSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1ccc(S(=O)(=O)CCC[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185744037 1431221695 /nfs/dbraw/zinc/22/16/95/1431221695.db2.gz QOVSAFGHCMIUGO-MOPGFXCFSA-N 2 1 378.582 3.401 20 0 GGADMP COc1ccc(CN(C(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)C2CC2)cc1 ZINC000185745574 1431222131 /nfs/dbraw/zinc/22/21/31/1431222131.db2.gz ALLDBANTJVAVIS-UYAOXDASSA-N 2 1 399.579 3.429 20 0 GGADMP COc1ccc(CN(C(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C2CC2)cc1 ZINC000185745574 1431222133 /nfs/dbraw/zinc/22/21/33/1431222133.db2.gz ALLDBANTJVAVIS-UYAOXDASSA-N 2 1 399.579 3.429 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185748082 1431222682 /nfs/dbraw/zinc/22/26/82/1431222682.db2.gz GQCLEYNUFOQIKX-OEMYIYORSA-N 2 1 385.552 3.258 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185748082 1431222686 /nfs/dbraw/zinc/22/26/86/1431222686.db2.gz GQCLEYNUFOQIKX-OEMYIYORSA-N 2 1 385.552 3.258 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185752358 1431224558 /nfs/dbraw/zinc/22/45/58/1431224558.db2.gz CMQHFWFOCKSKKC-KBPBESRZSA-N 2 1 394.903 3.429 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185752358 1431224564 /nfs/dbraw/zinc/22/45/64/1431224564.db2.gz CMQHFWFOCKSKKC-KBPBESRZSA-N 2 1 394.903 3.429 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccccc1OC(F)F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185757125 1431225988 /nfs/dbraw/zinc/22/59/88/1431225988.db2.gz GFUQHYLMKJWAHJ-LSDHHAIUSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccccc1OC(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185757125 1431225999 /nfs/dbraw/zinc/22/59/99/1431225999.db2.gz GFUQHYLMKJWAHJ-LSDHHAIUSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccccc1OC(F)F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185757169 1431226114 /nfs/dbraw/zinc/22/61/14/1431226114.db2.gz GFUQHYLMKJWAHJ-GJZGRUSLSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccccc1OC(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185757169 1431226118 /nfs/dbraw/zinc/22/61/18/1431226118.db2.gz GFUQHYLMKJWAHJ-GJZGRUSLSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCOc1ccc(Cl)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185757704 1431226491 /nfs/dbraw/zinc/22/64/91/1431226491.db2.gz BNJXUZQNJGSUIA-SJORKVTESA-N 2 1 393.959 3.078 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCOc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185757704 1431226495 /nfs/dbraw/zinc/22/64/95/1431226495.db2.gz BNJXUZQNJGSUIA-SJORKVTESA-N 2 1 393.959 3.078 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCCC2)nc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185766720 1431229096 /nfs/dbraw/zinc/22/90/96/1431229096.db2.gz IZSVWLZKLBJOGY-MOPGFXCFSA-N 2 1 399.583 3.253 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCCC2)nc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766720 1431229101 /nfs/dbraw/zinc/22/91/01/1431229101.db2.gz IZSVWLZKLBJOGY-MOPGFXCFSA-N 2 1 399.583 3.253 20 0 GGADMP COc1ccsc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000186158968 1431344085 /nfs/dbraw/zinc/34/40/85/1431344085.db2.gz XUMZNSYRSKQPOT-QAPCUYQASA-N 2 1 387.549 3.305 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCC3(C[NH+](C)C)CCCC3)cc2)C[C@@H](C)O1 ZINC000186181809 1431347947 /nfs/dbraw/zinc/34/79/47/1431347947.db2.gz NNFCXSOATJNGMM-RTBURBONSA-N 2 1 387.568 3.148 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCC3(C[NH+](C)C)CCCC3)cc2)C[C@H](C)O1 ZINC000186181771 1431347973 /nfs/dbraw/zinc/34/79/73/1431347973.db2.gz NNFCXSOATJNGMM-KDURUIRLSA-N 2 1 387.568 3.148 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCC3(C[NH+](C)C)CCCC3)cc2)C[C@H](C)O1 ZINC000186181771 1431347977 /nfs/dbraw/zinc/34/79/77/1431347977.db2.gz NNFCXSOATJNGMM-KDURUIRLSA-N 2 1 387.568 3.148 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)C1CC1 ZINC000186281938 1431370797 /nfs/dbraw/zinc/37/07/97/1431370797.db2.gz GJRKXJMSRXGCRU-IRLDBZIGSA-N 2 1 384.568 3.024 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000186310896 1431378865 /nfs/dbraw/zinc/37/88/65/1431378865.db2.gz SFQWBMQQJNUHED-QZTJIDSGSA-N 2 1 398.551 3.365 20 0 GGADMP CCO[C@H]1C[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C12CCOCC2 ZINC000186316315 1431380262 /nfs/dbraw/zinc/38/02/62/1431380262.db2.gz IASQMALAVNTNNE-YADHBBJMSA-N 2 1 390.543 3.396 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3ccc4c(c3)COC(C)(C)O4)CC2)nc(C)[nH+]1 ZINC000186408028 1431405918 /nfs/dbraw/zinc/40/59/18/1431405918.db2.gz YSCUGVUQPWSTBK-UHFFFAOYSA-N 2 1 382.508 3.497 20 0 GGADMP COC(=O)N1CCC([C@H](C)[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000186765513 1431511120 /nfs/dbraw/zinc/51/11/20/1431511120.db2.gz NEAVJKHJGXTGDB-KRWDZBQOSA-N 2 1 391.531 3.289 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)NCc2ccc(Cl)cc2)[C@H](C)C1 ZINC000187014164 1431590085 /nfs/dbraw/zinc/59/00/85/1431590085.db2.gz MMMZMEPGJQABJV-UWVAXJGDSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)NCc2ccc(Cl)cc2)[C@H](C)C1 ZINC000187014164 1431590087 /nfs/dbraw/zinc/59/00/87/1431590087.db2.gz MMMZMEPGJQABJV-UWVAXJGDSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(CC)cc2)[C@@H](C)C1 ZINC000187014706 1431590156 /nfs/dbraw/zinc/59/01/56/1431590156.db2.gz SLGAKIXQQJVSGF-UEXGIBASSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(CC)cc2)[C@@H](C)C1 ZINC000187014706 1431590163 /nfs/dbraw/zinc/59/01/63/1431590163.db2.gz SLGAKIXQQJVSGF-UEXGIBASSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2c(C)cccc2C)[C@H](C)C1 ZINC000187014211 1431590436 /nfs/dbraw/zinc/59/04/36/1431590436.db2.gz HFOZFFUSFLZDPF-AABGKKOBSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2c(C)cccc2C)[C@H](C)C1 ZINC000187014211 1431590440 /nfs/dbraw/zinc/59/04/40/1431590440.db2.gz HFOZFFUSFLZDPF-AABGKKOBSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)NCc2ccccc2Cl)[C@H](C)C1 ZINC000187019010 1431591743 /nfs/dbraw/zinc/59/17/43/1431591743.db2.gz GOWQWCDNCJZXRE-FUHIMQAGSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)NCc2ccccc2Cl)[C@H](C)C1 ZINC000187019010 1431591746 /nfs/dbraw/zinc/59/17/46/1431591746.db2.gz GOWQWCDNCJZXRE-FUHIMQAGSA-N 2 1 395.975 3.071 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2ccc3c(c2)CCC(=O)N3C)CC1 ZINC000187064010 1431603404 /nfs/dbraw/zinc/60/34/04/1431603404.db2.gz QIJMIIOWTXTZTI-UHFFFAOYSA-N 2 1 387.568 3.166 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc4c(c3)COC(C)(C)O4)cc2)CC1 ZINC000187103423 1431616360 /nfs/dbraw/zinc/61/63/60/1431616360.db2.gz YVRQTNXWTSVYDP-UHFFFAOYSA-N 2 1 395.547 3.369 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000187134385 1431627259 /nfs/dbraw/zinc/62/72/59/1431627259.db2.gz JVJCNJWVLYDXCI-KSSFIOAISA-N 2 1 398.473 3.092 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc4nc(C)ccc4c3)CC2)CC1 ZINC000187195295 1431643633 /nfs/dbraw/zinc/64/36/33/1431643633.db2.gz OHIUTEUBJFICOC-UHFFFAOYSA-N 2 1 394.563 3.309 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)[NH+](C)C)[N@@H+](C)C1CC1 ZINC000187256730 1431668611 /nfs/dbraw/zinc/66/86/11/1431668611.db2.gz BQOIXQRHNUAZFS-DYVFJYSZSA-N 2 1 386.462 3.090 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)[NH+](C)C)C[N@H+]1C1CC1 ZINC000187355649 1431707060 /nfs/dbraw/zinc/70/70/60/1431707060.db2.gz DLJUUKRZLHKFIN-SKDZVZGDSA-N 2 1 398.473 3.233 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)NC1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000187445734 1431732357 /nfs/dbraw/zinc/73/23/57/1431732357.db2.gz XXFDVAPTJJWHSF-QFIPXVFZSA-N 2 1 384.568 3.071 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000187473696 1431742429 /nfs/dbraw/zinc/74/24/29/1431742429.db2.gz YSQWFMBCQAKSNH-QFIPXVFZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000187478170 1431743903 /nfs/dbraw/zinc/74/39/03/1431743903.db2.gz DKSDJZYKJQPODZ-YADHBBJMSA-N 2 1 386.584 3.270 20 0 GGADMP CC1(C)OCc2cc(C[NH2+]Cc3ccccc3C[N@H+]3CC[C@H](O)C3)ccc2O1 ZINC000187512310 1431752826 /nfs/dbraw/zinc/75/28/26/1431752826.db2.gz INOPBFHKMCOWEN-NRFANRHFSA-N 2 1 382.504 3.188 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000187707132 1431802353 /nfs/dbraw/zinc/80/23/53/1431802353.db2.gz JODUXYCRWQLJRQ-SFHVURJKSA-N 2 1 396.597 3.222 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000187707132 1431802354 /nfs/dbraw/zinc/80/23/54/1431802354.db2.gz JODUXYCRWQLJRQ-SFHVURJKSA-N 2 1 396.597 3.222 20 0 GGADMP C[C@H](C[N@@H+]1CCC[C@@H](C)C1)[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000187826761 1431817061 /nfs/dbraw/zinc/81/70/61/1431817061.db2.gz INFBWLKACDACCB-YYZRRKBYSA-N 2 1 383.536 3.304 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000187826761 1431817062 /nfs/dbraw/zinc/81/70/62/1431817062.db2.gz INFBWLKACDACCB-YYZRRKBYSA-N 2 1 383.536 3.304 20 0 GGADMP COc1ccc2c(c1)[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)CCCS2 ZINC000187962282 1431831673 /nfs/dbraw/zinc/83/16/73/1431831673.db2.gz ZTDGKIMZNJIHNQ-FQEVSTJZSA-N 2 1 377.598 3.485 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1)c1ccco1 ZINC000188172461 1431856648 /nfs/dbraw/zinc/85/66/48/1431856648.db2.gz SPRPBSGTWAMDAC-UXHICEINSA-N 2 1 384.524 3.092 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1)c1ccco1 ZINC000188172461 1431856649 /nfs/dbraw/zinc/85/66/49/1431856649.db2.gz SPRPBSGTWAMDAC-UXHICEINSA-N 2 1 384.524 3.092 20 0 GGADMP CCn1nccc1N1CCC[C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)C1=O ZINC000188570814 1431896194 /nfs/dbraw/zinc/89/61/94/1431896194.db2.gz VEGIQPPRTINBLU-IHPCNDPISA-N 2 1 387.572 3.031 20 0 GGADMP CCCN(CCC[NH+](C)C)C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000188835544 1431993366 /nfs/dbraw/zinc/99/33/66/1431993366.db2.gz DMPGQBADLMKPIB-UHFFFAOYSA-N 2 1 396.526 3.303 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCC(=O)N3CCc4ccccc4C3)C2)CC1 ZINC000188985443 1432022240 /nfs/dbraw/zinc/02/22/40/1432022240.db2.gz LWASNBJTSLXKEC-OAQYLSRUSA-N 2 1 383.580 3.405 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2cc(F)ccc2Cl)CC1 ZINC000189026933 1432029389 /nfs/dbraw/zinc/02/93/89/1432029389.db2.gz MJJWHOCKZNRUNE-UHFFFAOYSA-N 2 1 383.939 3.395 20 0 GGADMP C[N@@H+](CCC(=O)N1CCc2ccccc2C1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000189057163 1432036650 /nfs/dbraw/zinc/03/66/50/1432036650.db2.gz URWZEAAZBNRKQT-JOCHJYFZSA-N 2 1 391.559 3.415 20 0 GGADMP C[NH+](CCC(=O)N1CCc2ccccc2C1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000189057163 1432036653 /nfs/dbraw/zinc/03/66/53/1432036653.db2.gz URWZEAAZBNRKQT-JOCHJYFZSA-N 2 1 391.559 3.415 20 0 GGADMP C[NH+](CCC(=O)N1CCc2ccccc2C1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000189057163 1432036660 /nfs/dbraw/zinc/03/66/60/1432036660.db2.gz URWZEAAZBNRKQT-JOCHJYFZSA-N 2 1 391.559 3.415 20 0 GGADMP Cc1ccc(CN2CC[C@@H]([NH2+]C3CC[NH+](CCc4ccccc4)CC3)C2=O)cc1 ZINC000189098778 1432044817 /nfs/dbraw/zinc/04/48/17/1432044817.db2.gz ZOFLVOVMIHSZEX-XMMPIXPASA-N 2 1 391.559 3.393 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(Cl)cc3F)c2)C1 ZINC000189328984 1432087277 /nfs/dbraw/zinc/08/72/77/1432087277.db2.gz JZAIOTPRHPCZLR-GOSISDBHSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(Cl)cc3F)c2)C1 ZINC000189328984 1432087281 /nfs/dbraw/zinc/08/72/81/1432087281.db2.gz JZAIOTPRHPCZLR-GOSISDBHSA-N 2 1 389.902 3.466 20 0 GGADMP CC(C)OC1CC([NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)C1 ZINC000189530111 1432149844 /nfs/dbraw/zinc/14/98/44/1432149844.db2.gz YJICBRXFXPUBMZ-UHFFFAOYSA-N 2 1 376.541 3.222 20 0 GGADMP C[NH+](C)CCNC(=O)C1CC[NH+](Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000189818154 1432244139 /nfs/dbraw/zinc/24/41/39/1432244139.db2.gz RXTXPWBGJMAUCN-UHFFFAOYSA-N 2 1 391.865 3.249 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCC(=O)Nc2cccc(Cl)c2)[C@H](C)C1 ZINC000190000251 1432302504 /nfs/dbraw/zinc/30/25/04/1432302504.db2.gz ZVXWMIKCGNVJBV-APWZRJJASA-N 2 1 381.948 3.395 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000190004883 1432302960 /nfs/dbraw/zinc/30/29/60/1432302960.db2.gz UNJXKVAVGONJTE-FUHIMQAGSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000190004883 1432302964 /nfs/dbraw/zinc/30/29/64/1432302964.db2.gz UNJXKVAVGONJTE-FUHIMQAGSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)cc(C)c2)[C@H](C)C1 ZINC000190007811 1432303857 /nfs/dbraw/zinc/30/38/57/1432303857.db2.gz RTJRFGDUHSVLRE-DYXWJJEUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)cc(C)c2)[C@H](C)C1 ZINC000190007811 1432303864 /nfs/dbraw/zinc/30/38/64/1432303864.db2.gz RTJRFGDUHSVLRE-DYXWJJEUSA-N 2 1 375.557 3.357 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000190147840 1432327943 /nfs/dbraw/zinc/32/79/43/1432327943.db2.gz YIOBIFXJOYJQBI-IBGZPJMESA-N 2 1 392.613 3.478 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000190147857 1432328018 /nfs/dbraw/zinc/32/80/18/1432328018.db2.gz YIOBIFXJOYJQBI-LJQANCHMSA-N 2 1 392.613 3.478 20 0 GGADMP Fc1ccc(-n2ccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)n2)c(F)c1 ZINC000190261025 1432350381 /nfs/dbraw/zinc/35/03/81/1432350381.db2.gz IKXTXTCRYPWZAH-UHFFFAOYSA-N 2 1 390.478 3.227 20 0 GGADMP CCN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(N(C)C(C)C)nc3)cc2)CC1 ZINC000190778194 1432476066 /nfs/dbraw/zinc/47/60/66/1432476066.db2.gz UFAGNWPRLROZJF-UHFFFAOYSA-N 2 1 395.595 3.354 20 0 GGADMP CCN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cn1 ZINC000190833860 1432500014 /nfs/dbraw/zinc/50/00/14/1432500014.db2.gz PNLAPUMRBSSQKN-KDURUIRLSA-N 2 1 382.552 3.437 20 0 GGADMP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3nccn3-c3ccccc3)cc2)CC1 ZINC000190967990 1432539842 /nfs/dbraw/zinc/53/98/42/1432539842.db2.gz XAIXVEUTYFWEQN-UHFFFAOYSA-N 2 1 376.504 3.119 20 0 GGADMP Cc1cc(C)c(N2CC[C@@H]([N@H+]3CCC[C@H](Cc4nccn4C)C3)C2=O)c(C)c1 ZINC000191019581 1432550829 /nfs/dbraw/zinc/55/08/29/1432550829.db2.gz JGNOSLMWTSWSJE-WOJBJXKFSA-N 2 1 380.536 3.405 20 0 GGADMP Cc1cc(C)c(N2CC[C@@H]([N@@H+]3CCC[C@H](Cc4[nH+]ccn4C)C3)C2=O)c(C)c1 ZINC000191019581 1432550830 /nfs/dbraw/zinc/55/08/30/1432550830.db2.gz JGNOSLMWTSWSJE-WOJBJXKFSA-N 2 1 380.536 3.405 20 0 GGADMP Cc1c([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cnn1C(C)C ZINC000191275997 1432618241 /nfs/dbraw/zinc/61/82/41/1432618241.db2.gz IBDZSJAGAVMXPS-UWJYYQICSA-N 2 1 397.567 3.321 20 0 GGADMP COCCN(C)c1ccc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cn1 ZINC000191352099 1432638937 /nfs/dbraw/zinc/63/89/37/1432638937.db2.gz FLOIQZLXHSTADZ-QFIPXVFZSA-N 2 1 382.552 3.118 20 0 GGADMP COCCN(C)c1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cn1 ZINC000191352099 1432638944 /nfs/dbraw/zinc/63/89/44/1432638944.db2.gz FLOIQZLXHSTADZ-QFIPXVFZSA-N 2 1 382.552 3.118 20 0 GGADMP COCCN(C)c1ccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cn1 ZINC000191352099 1432638949 /nfs/dbraw/zinc/63/89/49/1432638949.db2.gz FLOIQZLXHSTADZ-QFIPXVFZSA-N 2 1 382.552 3.118 20 0 GGADMP COCCN(C)c1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000191352099 1432638955 /nfs/dbraw/zinc/63/89/55/1432638955.db2.gz FLOIQZLXHSTADZ-QFIPXVFZSA-N 2 1 382.552 3.118 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](Cc2cccc(F)c2)C[C@H]2CCCO2)CC1 ZINC000191466041 1432666941 /nfs/dbraw/zinc/66/69/41/1432666941.db2.gz CMVFRCGRUZNYJQ-JOCHJYFZSA-N 2 1 377.548 3.223 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](Cc2cccc(F)c2)C[C@@H]2CCCO2)CC1 ZINC000191466024 1432667103 /nfs/dbraw/zinc/66/71/03/1432667103.db2.gz CMVFRCGRUZNYJQ-QFIPXVFZSA-N 2 1 377.548 3.223 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)NC(=O)Nc1ccccc1F ZINC000191472486 1432668434 /nfs/dbraw/zinc/66/84/34/1432668434.db2.gz HTOHEEUAIGVNJE-OAHLLOKOSA-N 2 1 389.475 3.033 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)NC(=O)Nc1ccccc1F ZINC000191472486 1432668437 /nfs/dbraw/zinc/66/84/37/1432668437.db2.gz HTOHEEUAIGVNJE-OAHLLOKOSA-N 2 1 389.475 3.033 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000191479121 1432668940 /nfs/dbraw/zinc/66/89/40/1432668940.db2.gz GIQVUOVROLYKNT-INIZCTEOSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000191479121 1432668949 /nfs/dbraw/zinc/66/89/49/1432668949.db2.gz GIQVUOVROLYKNT-INIZCTEOSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc(OC)c(OC)c1 ZINC000191490796 1432671237 /nfs/dbraw/zinc/67/12/37/1432671237.db2.gz QINKSHWREMHBQA-INIZCTEOSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(OC)c(OC)c1 ZINC000191490796 1432671245 /nfs/dbraw/zinc/67/12/45/1432671245.db2.gz QINKSHWREMHBQA-INIZCTEOSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)NC(=O)Nc1ccc(C)c(C)c1 ZINC000191490893 1432671274 /nfs/dbraw/zinc/67/12/74/1432671274.db2.gz SUEVOIRXVGMBMB-UHFFFAOYSA-N 2 1 385.512 3.123 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)NC(=O)Nc1ccc(C)c(C)c1 ZINC000191490893 1432671279 /nfs/dbraw/zinc/67/12/79/1432671279.db2.gz SUEVOIRXVGMBMB-UHFFFAOYSA-N 2 1 385.512 3.123 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000191498068 1432673072 /nfs/dbraw/zinc/67/30/72/1432673072.db2.gz QNOHRBHEOLGXGS-UHFFFAOYSA-N 2 1 394.422 3.118 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000191498068 1432673080 /nfs/dbraw/zinc/67/30/80/1432673080.db2.gz QNOHRBHEOLGXGS-UHFFFAOYSA-N 2 1 394.422 3.118 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)CC1 ZINC000191504667 1432674751 /nfs/dbraw/zinc/67/47/51/1432674751.db2.gz PZSDJTVAROUEFM-HXUWFJFHSA-N 2 1 375.532 3.137 20 0 GGADMP CC(C)C[N@@H+](CCCN1CC[NH+](C(C)C)CC1)C[C@H](O)c1ccc(F)cc1 ZINC000191510625 1432675846 /nfs/dbraw/zinc/67/58/46/1432675846.db2.gz MNVOHBKRXFIKAE-QFIPXVFZSA-N 2 1 379.564 3.233 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](Cc2ccccc2)C[C@H](O)c2ccco2)CC1 ZINC000191543201 1432680355 /nfs/dbraw/zinc/68/03/55/1432680355.db2.gz OAFNBUMXOAWVGE-QFIPXVFZSA-N 2 1 385.552 3.231 20 0 GGADMP CCOC(=O)c1csc(CC[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)n1 ZINC000191561838 1432683171 /nfs/dbraw/zinc/68/31/71/1432683171.db2.gz FBYGYJXUZMREGB-CEXWTWQISA-N 2 1 399.560 3.363 20 0 GGADMP Cc1ccc2[nH]c([C@@H]3CCC[N@H+](CCCN4CC[NH+](C(C)C)CC4)C3)nc2c1 ZINC000191602641 1432690476 /nfs/dbraw/zinc/69/04/76/1432690476.db2.gz SYCFYEDHHBKUIP-HXUWFJFHSA-N 2 1 383.584 3.467 20 0 GGADMP Cc1ccc2nc([C@@H]3CCC[N@@H+](CCCN4CC[NH+](C(C)C)CC4)C3)[nH]c2c1 ZINC000191602641 1432690481 /nfs/dbraw/zinc/69/04/81/1432690481.db2.gz SYCFYEDHHBKUIP-HXUWFJFHSA-N 2 1 383.584 3.467 20 0 GGADMP Cc1ccc2nc([C@@H]3CCC[N@H+](CCCN4CC[NH+](C(C)C)CC4)C3)[nH]c2c1 ZINC000191602641 1432690485 /nfs/dbraw/zinc/69/04/85/1432690485.db2.gz SYCFYEDHHBKUIP-HXUWFJFHSA-N 2 1 383.584 3.467 20 0 GGADMP Cc1ccc2[nH]c([C@H]3CCC[N@H+](CCCN4CC[NH+](C(C)C)CC4)C3)nc2c1 ZINC000191602655 1432690513 /nfs/dbraw/zinc/69/05/13/1432690513.db2.gz SYCFYEDHHBKUIP-FQEVSTJZSA-N 2 1 383.584 3.467 20 0 GGADMP Cc1ccc2nc([C@H]3CCC[N@@H+](CCCN4CC[NH+](C(C)C)CC4)C3)[nH]c2c1 ZINC000191602655 1432690517 /nfs/dbraw/zinc/69/05/17/1432690517.db2.gz SYCFYEDHHBKUIP-FQEVSTJZSA-N 2 1 383.584 3.467 20 0 GGADMP Cc1ccc2nc([C@H]3CCC[N@H+](CCCN4CC[NH+](C(C)C)CC4)C3)[nH]c2c1 ZINC000191602655 1432690521 /nfs/dbraw/zinc/69/05/21/1432690521.db2.gz SYCFYEDHHBKUIP-FQEVSTJZSA-N 2 1 383.584 3.467 20 0 GGADMP O=C1c2ccccc2CCN1CC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000191622700 1432694890 /nfs/dbraw/zinc/69/48/90/1432694890.db2.gz ALCDTZOCMXWFFV-UHFFFAOYSA-N 2 1 395.522 3.121 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]C3CCC(C(=O)OC)CC3)CC2)cs1 ZINC000192442354 1432845181 /nfs/dbraw/zinc/84/51/81/1432845181.db2.gz WEFIPDQIHXXJQX-UHFFFAOYSA-N 2 1 379.570 3.239 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCCCC[C@H]2C[C@H](O)c2ccco2)CC1 ZINC000192758154 1432885539 /nfs/dbraw/zinc/88/55/39/1432885539.db2.gz OQJHEZMUAMZWSG-SFTDATJTSA-N 2 1 377.573 3.364 20 0 GGADMP CC(C)[NH+]1CCN(CCCN2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000192760231 1432886134 /nfs/dbraw/zinc/88/61/34/1432886134.db2.gz YGUUTWRBJFBEJT-JWQCQUIFSA-N 2 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000192760231 1432886135 /nfs/dbraw/zinc/88/61/35/1432886135.db2.gz YGUUTWRBJFBEJT-JWQCQUIFSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000192760231 1432886136 /nfs/dbraw/zinc/88/61/36/1432886136.db2.gz YGUUTWRBJFBEJT-JWQCQUIFSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)CC1 ZINC000192760231 1432886137 /nfs/dbraw/zinc/88/61/37/1432886137.db2.gz YGUUTWRBJFBEJT-JWQCQUIFSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000192760231 1432886138 /nfs/dbraw/zinc/88/61/38/1432886138.db2.gz YGUUTWRBJFBEJT-JWQCQUIFSA-N 3 1 398.639 3.389 20 0 GGADMP C[C@@H]1C[N@H+](CCN2CCC([NH+](C)Cc3cccc(C(F)(F)F)c3)CC2)CCO1 ZINC000192776210 1432889043 /nfs/dbraw/zinc/88/90/43/1432889043.db2.gz VIAPKOBHZRWDMS-QGZVFWFLSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@@H]1C[N@@H+](CCN2CCC([NH+](C)Cc3cccc(C(F)(F)F)c3)CC2)CCO1 ZINC000192776210 1432889044 /nfs/dbraw/zinc/88/90/44/1432889044.db2.gz VIAPKOBHZRWDMS-QGZVFWFLSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@@H]1C[NH+](CCN2CCC([N@H+](C)Cc3cccc(C(F)(F)F)c3)CC2)CCO1 ZINC000192776210 1432889045 /nfs/dbraw/zinc/88/90/45/1432889045.db2.gz VIAPKOBHZRWDMS-QGZVFWFLSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@@H]1C[NH+](CCN2CCC([N@@H+](C)Cc3cccc(C(F)(F)F)c3)CC2)CCO1 ZINC000192776210 1432889046 /nfs/dbraw/zinc/88/90/46/1432889046.db2.gz VIAPKOBHZRWDMS-QGZVFWFLSA-N 2 1 399.501 3.322 20 0 GGADMP CCC[C@@H]1CN(CCCN2CC[NH+](C(C)C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000192791746 1432891494 /nfs/dbraw/zinc/89/14/94/1432891494.db2.gz SAJZZOXKPPLVOQ-XMMPIXPASA-N 2 1 386.628 3.389 20 0 GGADMP CCC[C@@H]1C[N@H+](CCCN2CC[NH+](C(C)C)CC2)CCN1Cc1ccccc1 ZINC000192791746 1432891496 /nfs/dbraw/zinc/89/14/96/1432891496.db2.gz SAJZZOXKPPLVOQ-XMMPIXPASA-N 2 1 386.628 3.389 20 0 GGADMP CCC[C@@H]1C[N@@H+](CCCN2CC[NH+](C(C)C)CC2)CCN1Cc1ccccc1 ZINC000192791746 1432891497 /nfs/dbraw/zinc/89/14/97/1432891497.db2.gz SAJZZOXKPPLVOQ-XMMPIXPASA-N 2 1 386.628 3.389 20 0 GGADMP CCC[C@H]1CN(CCCN2CC[NH+](C(C)C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000192791758 1432891514 /nfs/dbraw/zinc/89/15/14/1432891514.db2.gz SAJZZOXKPPLVOQ-DEOSSOPVSA-N 2 1 386.628 3.389 20 0 GGADMP CCC[C@H]1C[N@H+](CCCN2CC[NH+](C(C)C)CC2)CCN1Cc1ccccc1 ZINC000192791758 1432891516 /nfs/dbraw/zinc/89/15/16/1432891516.db2.gz SAJZZOXKPPLVOQ-DEOSSOPVSA-N 2 1 386.628 3.389 20 0 GGADMP CCC[C@H]1C[N@@H+](CCCN2CC[NH+](C(C)C)CC2)CCN1Cc1ccccc1 ZINC000192791758 1432891518 /nfs/dbraw/zinc/89/15/18/1432891518.db2.gz SAJZZOXKPPLVOQ-DEOSSOPVSA-N 2 1 386.628 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)CCOc2ccc(C(F)(F)F)cc2)CC1 ZINC000192843324 1432898105 /nfs/dbraw/zinc/89/81/05/1432898105.db2.gz GCVRABFMQIHPKY-UHFFFAOYSA-N 2 1 387.490 3.432 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCCNc4ccccc43)c2)C1 ZINC000192846378 1432898248 /nfs/dbraw/zinc/89/82/48/1432898248.db2.gz ZKGFAVMMVSJWDA-REWPJTCUSA-N 2 1 392.547 3.421 20 0 GGADMP CCOC(=O)c1oc2c(c1C)[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CCOC3)CC1)CCC2 ZINC000192880809 1432902351 /nfs/dbraw/zinc/90/23/51/1432902351.db2.gz GQSYZMAAYKWHSD-WMZOPIPTSA-N 2 1 390.524 3.233 20 0 GGADMP COC(=O)[C@@H](C)Oc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192929937 1432909638 /nfs/dbraw/zinc/90/96/38/1432909638.db2.gz IFDITCBEDLHOOS-NQIIRXRSSA-N 2 1 382.504 3.239 20 0 GGADMP COC(=O)[C@H](C)Oc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192929953 1432909648 /nfs/dbraw/zinc/90/96/48/1432909648.db2.gz IFDITCBEDLHOOS-GHTZIAJQSA-N 2 1 382.504 3.239 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)[nH+]c1 ZINC000192978147 1432916076 /nfs/dbraw/zinc/91/60/76/1432916076.db2.gz PIVKOWJYORJMQL-UHFFFAOYSA-N 2 1 381.524 3.156 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)CC1 ZINC000193193423 1432955080 /nfs/dbraw/zinc/95/50/80/1432955080.db2.gz ZJYOVAZQTKILJI-LJQANCHMSA-N 2 1 380.964 3.362 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000193307506 1432976816 /nfs/dbraw/zinc/97/68/16/1432976816.db2.gz RFVDZLSKPLGQDH-HXUWFJFHSA-N 2 1 386.584 3.257 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC1CC[NH+](CC2CC2)CC1)c1ccccc1Cl ZINC000193621557 1433029927 /nfs/dbraw/zinc/02/99/27/1433029927.db2.gz XHDRNIYJIATIRJ-IBGZPJMESA-N 2 1 378.948 3.116 20 0 GGADMP COC[C@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)c1ccc(Cl)cc1 ZINC000193684094 1433040241 /nfs/dbraw/zinc/04/02/41/1433040241.db2.gz BLCDASLPSLVXOA-PMACEKPBSA-N 2 1 389.927 3.036 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCC(C)CC1)[N@@H+]1CCc2sccc2C1 ZINC000193742023 1433050567 /nfs/dbraw/zinc/05/05/67/1433050567.db2.gz VRTROCJTCHAHHI-GOSISDBHSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCC(C)CC1)[N@H+]1CCc2sccc2C1 ZINC000193742023 1433050570 /nfs/dbraw/zinc/05/05/70/1433050570.db2.gz VRTROCJTCHAHHI-GOSISDBHSA-N 2 1 392.613 3.306 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@H+]2CCC[C@@H]2c2cccn2C)CC1 ZINC000193795877 1433061380 /nfs/dbraw/zinc/06/13/80/1433061380.db2.gz HBBOAUQCXLCEEE-HSZRJFAPSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@@H+]2CCC[C@@H]2c2cccn2C)CC1 ZINC000193795877 1433061384 /nfs/dbraw/zinc/06/13/84/1433061384.db2.gz HBBOAUQCXLCEEE-HSZRJFAPSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)C[NH+]2CCC[C@@H]2c2cccn2C)CC1 ZINC000193795877 1433061388 /nfs/dbraw/zinc/06/13/88/1433061388.db2.gz HBBOAUQCXLCEEE-HSZRJFAPSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH+]2CCC[C@@H]2c2cccn2C)CC1 ZINC000193795877 1433061392 /nfs/dbraw/zinc/06/13/92/1433061392.db2.gz HBBOAUQCXLCEEE-HSZRJFAPSA-N 2 1 394.563 3.205 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000193824852 1433067545 /nfs/dbraw/zinc/06/75/45/1433067545.db2.gz BXUYCDCTXWAXQZ-GGAORHGYSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000193824852 1433067551 /nfs/dbraw/zinc/06/75/51/1433067551.db2.gz BXUYCDCTXWAXQZ-GGAORHGYSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CCC[NH+]1Cc1ccc(F)cc1 ZINC000193824852 1433067554 /nfs/dbraw/zinc/06/75/54/1433067554.db2.gz BXUYCDCTXWAXQZ-GGAORHGYSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCC[NH+]1Cc1ccc(F)cc1 ZINC000193824852 1433067559 /nfs/dbraw/zinc/06/75/59/1433067559.db2.gz BXUYCDCTXWAXQZ-GGAORHGYSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000193840983 1433070809 /nfs/dbraw/zinc/07/08/09/1433070809.db2.gz XGGRLVVASJIPGJ-UHFFFAOYSA-N 2 1 398.576 3.201 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000193840983 1433070812 /nfs/dbraw/zinc/07/08/12/1433070812.db2.gz XGGRLVVASJIPGJ-UHFFFAOYSA-N 2 1 398.576 3.201 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000193927825 1433086416 /nfs/dbraw/zinc/08/64/16/1433086416.db2.gz RHMOGFHCWDSOBB-RTBURBONSA-N 2 1 386.565 3.172 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000193927809 1433086439 /nfs/dbraw/zinc/08/64/39/1433086439.db2.gz RHMOGFHCWDSOBB-MOPGFXCFSA-N 2 1 386.565 3.172 20 0 GGADMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193928433 1433086529 /nfs/dbraw/zinc/08/65/29/1433086529.db2.gz TYUSMPZDYXCXCP-RTWAWAEBSA-N 2 1 396.535 3.238 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000193929658 1433086703 /nfs/dbraw/zinc/08/67/03/1433086703.db2.gz ZVJWHHCVGOHNSD-UGKGYDQZSA-N 2 1 398.526 3.250 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)[nH+]c1 ZINC000194026702 1433103557 /nfs/dbraw/zinc/10/35/57/1433103557.db2.gz XORMRTNMHDCUHD-FQEVSTJZSA-N 2 1 381.524 3.013 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)[nH+]c1 ZINC000194026702 1433103560 /nfs/dbraw/zinc/10/35/60/1433103560.db2.gz XORMRTNMHDCUHD-FQEVSTJZSA-N 2 1 381.524 3.013 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000194031736 1433104484 /nfs/dbraw/zinc/10/44/84/1433104484.db2.gz YTLXICJRXLXUQE-QFIPXVFZSA-N 2 1 380.536 3.070 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NCCC[N@@H+](C)Cc3ccccc3)CC2)[nH+]c1 ZINC000194073885 1433112385 /nfs/dbraw/zinc/11/23/85/1433112385.db2.gz TYALPYKLMDMXKS-UHFFFAOYSA-N 2 1 380.536 3.245 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NCCC[N@H+](C)Cc3ccccc3)CC2)[nH+]c1 ZINC000194073885 1433112389 /nfs/dbraw/zinc/11/23/89/1433112389.db2.gz TYALPYKLMDMXKS-UHFFFAOYSA-N 2 1 380.536 3.245 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000194106562 1433118802 /nfs/dbraw/zinc/11/88/02/1433118802.db2.gz FHOQJCHTURJERF-LEWJYISDSA-N 2 1 398.551 3.484 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000194116216 1433120407 /nfs/dbraw/zinc/12/04/07/1433120407.db2.gz AQVXAFAXSVKMQG-HSZRJFAPSA-N 2 1 394.563 3.460 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000194116216 1433120411 /nfs/dbraw/zinc/12/04/11/1433120411.db2.gz AQVXAFAXSVKMQG-HSZRJFAPSA-N 2 1 394.563 3.460 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000194116216 1433120414 /nfs/dbraw/zinc/12/04/14/1433120414.db2.gz AQVXAFAXSVKMQG-HSZRJFAPSA-N 2 1 394.563 3.460 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N[C@@H]1CC[NH+](CC2CCCC2)C1 ZINC000194210975 1433139904 /nfs/dbraw/zinc/13/99/04/1433139904.db2.gz UVCZJTQSQQIERR-FCHUYYIVSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC000194210975 1433139907 /nfs/dbraw/zinc/13/99/07/1433139907.db2.gz UVCZJTQSQQIERR-FCHUYYIVSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000194210975 1433139910 /nfs/dbraw/zinc/13/99/10/1433139910.db2.gz UVCZJTQSQQIERR-FCHUYYIVSA-N 2 1 384.568 3.072 20 0 GGADMP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000194413587 1433174152 /nfs/dbraw/zinc/17/41/52/1433174152.db2.gz OJGAMHVXZUGARE-NRFANRHFSA-N 2 1 376.504 3.323 20 0 GGADMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000194413587 1433174153 /nfs/dbraw/zinc/17/41/53/1433174153.db2.gz OJGAMHVXZUGARE-NRFANRHFSA-N 2 1 376.504 3.323 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000194416000 1433174721 /nfs/dbraw/zinc/17/47/21/1433174721.db2.gz NREOVSOPTYOARR-NRFANRHFSA-N 2 1 398.551 3.183 20 0 GGADMP O=C(NC[C@H]1CC[N@H+](Cc2ccccc2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000194433621 1433177229 /nfs/dbraw/zinc/17/72/29/1433177229.db2.gz MZCZWXKRLWASHJ-HSZRJFAPSA-N 2 1 392.547 3.036 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000194433621 1433177230 /nfs/dbraw/zinc/17/72/30/1433177230.db2.gz MZCZWXKRLWASHJ-HSZRJFAPSA-N 2 1 392.547 3.036 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000194437666 1433178120 /nfs/dbraw/zinc/17/81/20/1433178120.db2.gz HURPXMDZWHGOPC-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP O=C(C1CC[NH+](C2CC2)CC1)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000194767663 1433228050 /nfs/dbraw/zinc/22/80/50/1433228050.db2.gz ZSRNQGZUOCXWNJ-GMAHTHKFSA-N 2 1 381.564 3.374 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H](C)Cn1cc[nH+]c1C)c1ccsc1 ZINC000194891615 1433258256 /nfs/dbraw/zinc/25/82/56/1433258256.db2.gz PMTXCPLGTIJNLK-QAPCUYQASA-N 2 1 377.558 3.271 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@H](C)Cn1cc[nH+]c1C)c1ccsc1 ZINC000194891664 1433258503 /nfs/dbraw/zinc/25/85/03/1433258503.db2.gz PMTXCPLGTIJNLK-MAUKXSAKSA-N 2 1 377.558 3.271 20 0 GGADMP COCC[NH+]1CCC(NC(=O)Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)CC1 ZINC000195038361 1433283991 /nfs/dbraw/zinc/28/39/91/1433283991.db2.gz RROGEACEOQQANZ-UHFFFAOYSA-N 2 1 399.539 3.287 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C1(c2ccccc2)CC[NH2+]CC1)c1ccccc1Cl ZINC000195133894 1433297418 /nfs/dbraw/zinc/29/74/18/1433297418.db2.gz XRGGVBNXRPGJMB-FQEVSTJZSA-N 2 1 385.939 3.380 20 0 GGADMP C[NH+](C)[C@H](C(=O)NCCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000195305105 1433317105 /nfs/dbraw/zinc/31/71/05/1433317105.db2.gz BNOVCCRONLNWEI-QHCPKHFHSA-N 2 1 394.563 3.008 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(OC2CCCC2)CC1 ZINC000195325512 1433319443 /nfs/dbraw/zinc/31/94/43/1433319443.db2.gz XIXROCWJGYVEPH-CTNGQTDRSA-N 2 1 399.579 3.189 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(OC2CCCC2)CC1 ZINC000195325512 1433319445 /nfs/dbraw/zinc/31/94/45/1433319445.db2.gz XIXROCWJGYVEPH-CTNGQTDRSA-N 2 1 399.579 3.189 20 0 GGADMP C[C@@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(OC2CCCC2)CC1 ZINC000195325504 1433319606 /nfs/dbraw/zinc/31/96/06/1433319606.db2.gz XIXROCWJGYVEPH-FPOVZHCZSA-N 2 1 399.579 3.189 20 0 GGADMP C[C@@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(OC2CCCC2)CC1 ZINC000195325504 1433319608 /nfs/dbraw/zinc/31/96/08/1433319608.db2.gz XIXROCWJGYVEPH-FPOVZHCZSA-N 2 1 399.579 3.189 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000195635956 1433342668 /nfs/dbraw/zinc/34/26/68/1433342668.db2.gz FGQIGYXLQXHLCC-SQNIBIBYSA-N 2 1 378.586 3.305 20 0 GGADMP CC[N@H+](C)[C@H](C(=O)Nc1ccc(C(=O)OC2CC[NH2+]CC2)cc1)c1ccccc1 ZINC000236888508 1433382265 /nfs/dbraw/zinc/38/22/65/1433382265.db2.gz VFPLOSDJSAITMQ-NRFANRHFSA-N 2 1 395.503 3.227 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)Nc1ccc(C(=O)OC2CC[NH2+]CC2)cc1)c1ccccc1 ZINC000236888508 1433382266 /nfs/dbraw/zinc/38/22/66/1433382266.db2.gz VFPLOSDJSAITMQ-NRFANRHFSA-N 2 1 395.503 3.227 20 0 GGADMP CC[N@H+](C)[C@H](C(=O)Nc1cccc(C(=O)OC[C@@H]2CCC[NH2+]2)c1)c1ccccc1 ZINC000236888627 1433382278 /nfs/dbraw/zinc/38/22/78/1433382278.db2.gz CANODWPEBAPXPM-SFTDATJTSA-N 2 1 395.503 3.227 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)Nc1cccc(C(=O)OC[C@@H]2CCC[NH2+]2)c1)c1ccccc1 ZINC000236888627 1433382280 /nfs/dbraw/zinc/38/22/80/1433382280.db2.gz CANODWPEBAPXPM-SFTDATJTSA-N 2 1 395.503 3.227 20 0 GGADMP CC[C@H](NC(=O)CC[C@@H]([NH3+])c1ccccc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000236995985 1433385516 /nfs/dbraw/zinc/38/55/16/1433385516.db2.gz ZFWCFAUUCSRDCJ-VJBWXMMDSA-N 2 1 395.547 3.262 20 0 GGADMP CC[C@H](NC(=O)CC[C@@H]([NH3+])c1ccccc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000236995985 1433385518 /nfs/dbraw/zinc/38/55/18/1433385518.db2.gz ZFWCFAUUCSRDCJ-VJBWXMMDSA-N 2 1 395.547 3.262 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C[C@@H](C)[C@@H]3CCC[NH2+]C3)CC2)cs1 ZINC000237042673 1433387055 /nfs/dbraw/zinc/38/70/55/1433387055.db2.gz JSPCUTLKRIVRLN-SJLPKXTDSA-N 2 1 392.613 3.060 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H](C)CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000237111990 1433389415 /nfs/dbraw/zinc/38/94/15/1433389415.db2.gz RHZWKXQOPHXMAH-CQSZACIVSA-N 2 1 387.446 3.123 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H](C)CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000237111533 1433389520 /nfs/dbraw/zinc/38/95/20/1433389520.db2.gz RHZWKXQOPHXMAH-AWEZNQCLSA-N 2 1 387.446 3.123 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)[C@@]2(C)CC[NH2+]C2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000237124723 1433390043 /nfs/dbraw/zinc/39/00/43/1433390043.db2.gz UGTCSUHFBLGELE-AYBZRNKSSA-N 2 1 383.458 3.204 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccncc2)CC1 ZINC000237129744 1433390313 /nfs/dbraw/zinc/39/03/13/1433390313.db2.gz ZEYAGCCUBDZOTH-UHFFFAOYSA-N 2 1 391.519 3.135 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)[C@H]2Cc3ccccc3C[NH2+]2)CC1 ZINC000237193790 1433391840 /nfs/dbraw/zinc/39/18/40/1433391840.db2.gz LSJYMTNFZFXSOG-HSZRJFAPSA-N 2 1 377.532 3.072 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)[C@H]2[NH2+]CCc3ccccc32)CC1 ZINC000237193728 1433391854 /nfs/dbraw/zinc/39/18/54/1433391854.db2.gz LOEBNIOPIOIQRM-QHCPKHFHSA-N 2 1 377.532 3.244 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000237244513 1433393949 /nfs/dbraw/zinc/39/39/49/1433393949.db2.gz LYQIZKASGNCATR-SJORKVTESA-N 2 1 377.529 3.275 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000237317936 1433397074 /nfs/dbraw/zinc/39/70/74/1433397074.db2.gz KDAFHASKTJBAPK-ZWKOTPCHSA-N 2 1 389.590 3.044 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000237317936 1433397075 /nfs/dbraw/zinc/39/70/75/1433397075.db2.gz KDAFHASKTJBAPK-ZWKOTPCHSA-N 2 1 389.590 3.044 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(N2CC[NH+](C)CC2)c(Cl)c1)[C@@H]1CCC[NH2+]C1 ZINC000237367744 1433399399 /nfs/dbraw/zinc/39/93/99/1433399399.db2.gz SMBDCZCJZCKVGQ-JKSUJKDBSA-N 2 1 378.948 3.056 20 0 GGADMP C[C@H]([NH3+])[C@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000237440438 1433403213 /nfs/dbraw/zinc/40/32/13/1433403213.db2.gz YPFYULLFKARISZ-VDZJLULYSA-N 2 1 383.458 3.027 20 0 GGADMP C[C@H](CC(=O)Nc1ccccc1)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000237508763 1433406932 /nfs/dbraw/zinc/40/69/32/1433406932.db2.gz SGPAIFBYCZYTAW-MOPGFXCFSA-N 2 1 381.520 3.414 20 0 GGADMP C[C@H](CC(=O)Nc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000237508763 1433406938 /nfs/dbraw/zinc/40/69/38/1433406938.db2.gz SGPAIFBYCZYTAW-MOPGFXCFSA-N 2 1 381.520 3.414 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)N1CCN(c2ccccc2)CC1 ZINC000237515512 1433407270 /nfs/dbraw/zinc/40/72/70/1433407270.db2.gz UNFJAIRZUNTKGQ-JOCHJYFZSA-N 2 1 392.591 3.451 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(N2CC[NH+](C)CC2)c(Cl)c1)[C@@H]1CCC[NH2+]C1 ZINC000237556082 1433409668 /nfs/dbraw/zinc/40/96/68/1433409668.db2.gz SMBDCZCJZCKVGQ-HZPDHXFCSA-N 2 1 378.948 3.056 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[C@H]([NH3+])c1ccccc1 ZINC000237563738 1433409979 /nfs/dbraw/zinc/40/99/79/1433409979.db2.gz FZQPVWHNSZEZHZ-BTYIYWSLSA-N 2 1 387.474 3.382 20 0 GGADMP C[C@H](C[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1ccccc1 ZINC000237584871 1433411138 /nfs/dbraw/zinc/41/11/38/1433411138.db2.gz NFJUKDZHFVCMBL-LJQANCHMSA-N 2 1 381.520 3.241 20 0 GGADMP Cc1ccc(NC(=O)CCC2CC[NH2+]CC2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000237600036 1433411597 /nfs/dbraw/zinc/41/15/97/1433411597.db2.gz FFIOWPSVJJIOMX-UHFFFAOYSA-N 2 1 386.540 3.138 20 0 GGADMP C[C@H](CC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[C@H]1CCC[NH2+]C1 ZINC000237599556 1433411927 /nfs/dbraw/zinc/41/19/27/1433411927.db2.gz YOIGNGWBDAAUQX-WBVHZDCISA-N 2 1 379.495 3.071 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CCN(C(=O)[C@@H]3CCCCCC[C@@H]3[NH3+])CC2)C[C@H](C)O1 ZINC000237606236 1433412325 /nfs/dbraw/zinc/41/23/25/1433412325.db2.gz BBIFIRVNZZZXHD-JYRKZWEQSA-N 2 1 379.589 3.022 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)CC[C@@H]([NH3+])c3ccccc3)cc2)C[C@H](C)O1 ZINC000237630399 1433413641 /nfs/dbraw/zinc/41/36/41/1433413641.db2.gz IBELCPYIUSPFGF-SELNLUPBSA-N 2 1 395.547 3.392 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)C2(c3ccccc3)CC[NH2+]CC2)C[N@H+]1Cc1ccccc1 ZINC000237693351 1433417434 /nfs/dbraw/zinc/41/74/34/1433417434.db2.gz WIFKORJLFWQQCJ-SIKLNZKXSA-N 2 1 377.532 3.087 20 0 GGADMP [NH3+]C[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000237831046 1433427551 /nfs/dbraw/zinc/42/75/51/1433427551.db2.gz UZUCLPHVVJSISN-MOPGFXCFSA-N 2 1 391.437 3.138 20 0 GGADMP O=C(CCC1CC[NH2+]CC1)N[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000237880220 1433431192 /nfs/dbraw/zinc/43/11/92/1433431192.db2.gz AKCDZYUZODMMOW-SFHVURJKSA-N 2 1 383.458 3.176 20 0 GGADMP [NH3+]Cc1nc(C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)cs1 ZINC000238033319 1433439880 /nfs/dbraw/zinc/43/98/80/1433439880.db2.gz HEMXJFBGGCDTFA-UHFFFAOYSA-N 2 1 394.544 3.424 20 0 GGADMP [NH3+]Cc1nc(C(=O)NC[C@H](c2ccccc2)N2CCc3sccc3C2)cs1 ZINC000238079067 1433442225 /nfs/dbraw/zinc/44/22/25/1433442225.db2.gz QDLKDCRCCZSNNZ-QGZVFWFLSA-N 2 1 398.557 3.193 20 0 GGADMP C[C@@H](C(=O)N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000245201216 1433454818 /nfs/dbraw/zinc/45/48/18/1433454818.db2.gz GKYMTZVJHCTPDV-DMUMMCEESA-N 2 1 385.552 3.352 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000245392606 1433458941 /nfs/dbraw/zinc/45/89/41/1433458941.db2.gz ULYCVFDFVRIYBO-GUDVDZBRSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000245392606 1433458942 /nfs/dbraw/zinc/45/89/42/1433458942.db2.gz ULYCVFDFVRIYBO-GUDVDZBRSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000245392606 1433458943 /nfs/dbraw/zinc/45/89/43/1433458943.db2.gz ULYCVFDFVRIYBO-GUDVDZBRSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N2CC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000245395608 1433459637 /nfs/dbraw/zinc/45/96/37/1433459637.db2.gz IDYKZMZFZZAPSN-DENIHFKCSA-N 2 1 384.568 3.298 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N3CC[C@@H]([NH+]4CCCC4)C3)cc2)C1 ZINC000245395712 1433459953 /nfs/dbraw/zinc/45/99/53/1433459953.db2.gz IRBSYHWWCCCIET-SIKLNZKXSA-N 2 1 384.568 3.298 20 0 GGADMP CC(C)[C@H](C(=O)NC1CC[NH+](C2CCCCC2)CC1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000245424481 1433465391 /nfs/dbraw/zinc/46/53/91/1433465391.db2.gz CNPOMEDGXNQGQF-LVCYWYKZSA-N 2 1 379.589 3.034 20 0 GGADMP CC(C)[C@H](C(=O)NC1CC[NH+](C2CCCCC2)CC1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000245424481 1433465394 /nfs/dbraw/zinc/46/53/94/1433465394.db2.gz CNPOMEDGXNQGQF-LVCYWYKZSA-N 2 1 379.589 3.034 20 0 GGADMP C[C@H](C(=O)NCCc1cccs1)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000245439878 1433467836 /nfs/dbraw/zinc/46/78/36/1433467836.db2.gz GCUVSCVQJVDQNF-UYAOXDASSA-N 2 1 385.577 3.249 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(C)[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000245440334 1433468357 /nfs/dbraw/zinc/46/83/57/1433468357.db2.gz ULKHVRXDCWFDSQ-VXKWHMMOSA-N 2 1 386.584 3.413 20 0 GGADMP C(CC[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1)C[NH+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245446681 1433469652 /nfs/dbraw/zinc/46/96/52/1433469652.db2.gz LIUXMIMPQUAWFP-ZEQRLZLVSA-N 4 1 390.660 3.382 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(Cc2cccc(CN3CC[C@@H](C[N@H+](C)CC)C3)c2)C1 ZINC000245455104 1433470825 /nfs/dbraw/zinc/47/08/25/1433470825.db2.gz SKSNMMVLKXFKHT-ZEQRLZLVSA-N 4 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[NH+](Cc2cccc(CN3CC[C@@H](C[N@@H+](C)CC)C3)c2)C1 ZINC000245455104 1433470828 /nfs/dbraw/zinc/47/08/28/1433470828.db2.gz SKSNMMVLKXFKHT-ZEQRLZLVSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[NH+](Cc2cccc(CN3CC[C@@H](C[N@H+](C)CC)C3)c2)C1 ZINC000245455104 1433470829 /nfs/dbraw/zinc/47/08/29/1433470829.db2.gz SKSNMMVLKXFKHT-ZEQRLZLVSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(Cc2cccc(C[N@@H+]3CC[C@@H](C[NH+](C)CC)C3)c2)C1 ZINC000245455104 1433470830 /nfs/dbraw/zinc/47/08/30/1433470830.db2.gz SKSNMMVLKXFKHT-ZEQRLZLVSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(Cc2cccc(C[N@H+]3CC[C@@H](C[NH+](C)CC)C3)c2)C1 ZINC000245455104 1433470831 /nfs/dbraw/zinc/47/08/31/1433470831.db2.gz SKSNMMVLKXFKHT-ZEQRLZLVSA-N 3 1 386.628 3.234 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000245454972 1433471041 /nfs/dbraw/zinc/47/10/41/1433471041.db2.gz HTKIWSCKUMGWLX-ZWKOTPCHSA-N 2 1 381.586 3.242 20 0 GGADMP COc1cccc(CNC(=O)[C@@H](C)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000245457850 1433471879 /nfs/dbraw/zinc/47/18/79/1433471879.db2.gz UOINFBCMCXFHHF-DENIHFKCSA-N 2 1 395.547 3.154 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]C2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)C[C@H](C)O1 ZINC000245552669 1433484060 /nfs/dbraw/zinc/48/40/60/1433484060.db2.gz QOWZBZNXQLLMIG-IQWRZIDRSA-N 2 1 395.588 3.396 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000245586395 1433488093 /nfs/dbraw/zinc/48/80/93/1433488093.db2.gz AMFPZLOYGIKSAQ-BWAGFHJFSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000245586395 1433488094 /nfs/dbraw/zinc/48/80/94/1433488094.db2.gz AMFPZLOYGIKSAQ-BWAGFHJFSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000245586395 1433488095 /nfs/dbraw/zinc/48/80/95/1433488095.db2.gz AMFPZLOYGIKSAQ-BWAGFHJFSA-N 2 1 384.568 3.439 20 0 GGADMP COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1 ZINC000245612486 1433491029 /nfs/dbraw/zinc/49/10/29/1433491029.db2.gz LCEWCNQKFWCBDQ-VXKWHMMOSA-N 2 1 381.520 3.251 20 0 GGADMP COc1ccc([C@@H]2CCC[N@H+]2CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1 ZINC000245612486 1433491032 /nfs/dbraw/zinc/49/10/32/1433491032.db2.gz LCEWCNQKFWCBDQ-VXKWHMMOSA-N 2 1 381.520 3.251 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[NH+]1C1CCOCC1 ZINC000245666825 1433497201 /nfs/dbraw/zinc/49/72/01/1433497201.db2.gz ASBJPQRNFCQCEB-JTHBVZDNSA-N 2 1 399.579 3.000 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[N@@H+]1C1CCOCC1 ZINC000245666825 1433497204 /nfs/dbraw/zinc/49/72/04/1433497204.db2.gz ASBJPQRNFCQCEB-JTHBVZDNSA-N 2 1 399.579 3.000 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[N@H+]1C1CCOCC1 ZINC000245666825 1433497209 /nfs/dbraw/zinc/49/72/09/1433497209.db2.gz ASBJPQRNFCQCEB-JTHBVZDNSA-N 2 1 399.579 3.000 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000245669960 1433497318 /nfs/dbraw/zinc/49/73/18/1433497318.db2.gz FGLUUYIMZAFCJX-KCZVDYSFSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000245669960 1433497321 /nfs/dbraw/zinc/49/73/21/1433497321.db2.gz FGLUUYIMZAFCJX-KCZVDYSFSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000245669960 1433497323 /nfs/dbraw/zinc/49/73/23/1433497323.db2.gz FGLUUYIMZAFCJX-KCZVDYSFSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](Oc1ccccc1)C(=O)N(C)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000245702382 1433502648 /nfs/dbraw/zinc/50/26/48/1433502648.db2.gz LOXQYFNIUOOLTE-VLCRHTCISA-N 2 1 387.568 3.250 20 0 GGADMP CN(C(=O)COc1ccc(F)cc1)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000245702412 1433502660 /nfs/dbraw/zinc/50/26/60/1433502660.db2.gz LPQPHHXOKKXAOW-NHCUHLMSSA-N 2 1 391.531 3.000 20 0 GGADMP CC[NH+](CCNC(=O)NC[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000245730099 1433506913 /nfs/dbraw/zinc/50/69/13/1433506913.db2.gz SUIXUSGZTPNIOH-BEFAXECRSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+](CCNC(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000245730099 1433506915 /nfs/dbraw/zinc/50/69/15/1433506915.db2.gz SUIXUSGZTPNIOH-BEFAXECRSA-N 2 1 396.938 3.255 20 0 GGADMP COc1cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000245734035 1433507892 /nfs/dbraw/zinc/50/78/92/1433507892.db2.gz FLOJCGBZOHSDIV-ICSRJNTNSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000245734035 1433507895 /nfs/dbraw/zinc/50/78/95/1433507895.db2.gz FLOJCGBZOHSDIV-ICSRJNTNSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000245734035 1433507900 /nfs/dbraw/zinc/50/79/00/1433507900.db2.gz FLOJCGBZOHSDIV-ICSRJNTNSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000245734035 1433507903 /nfs/dbraw/zinc/50/79/03/1433507903.db2.gz FLOJCGBZOHSDIV-ICSRJNTNSA-N 2 1 384.520 3.459 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)NCC2CC[NH+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245761271 1433513491 /nfs/dbraw/zinc/51/34/91/1433513491.db2.gz ZMRJOUSMLJIHNU-APWZRJJASA-N 2 1 396.938 3.113 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CNC(=O)NC[C@@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245763103 1433513740 /nfs/dbraw/zinc/51/37/40/1433513740.db2.gz ZVVQVQJJUPMXMU-FCEWJHQRSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245763103 1433513746 /nfs/dbraw/zinc/51/37/46/1433513746.db2.gz ZVVQVQJJUPMXMU-FCEWJHQRSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245763103 1433513752 /nfs/dbraw/zinc/51/37/52/1433513752.db2.gz ZVVQVQJJUPMXMU-FCEWJHQRSA-N 2 1 396.938 3.255 20 0 GGADMP CCN(C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)[C@H](C)c1ccc(F)cc1 ZINC000245816905 1433521915 /nfs/dbraw/zinc/52/19/15/1433521915.db2.gz DFBHYJGZDDKFBZ-MSOLQXFVSA-N 2 1 386.515 3.423 20 0 GGADMP CCN(C(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)[C@H](C)c1ccc(F)cc1 ZINC000245816905 1433521922 /nfs/dbraw/zinc/52/19/22/1433521922.db2.gz DFBHYJGZDDKFBZ-MSOLQXFVSA-N 2 1 386.515 3.423 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000245868500 1433530292 /nfs/dbraw/zinc/53/02/92/1433530292.db2.gz FQKIATZTOSOEOU-QIJUGHKUSA-N 2 1 384.568 3.480 20 0 GGADMP C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000245877763 1433532751 /nfs/dbraw/zinc/53/27/51/1433532751.db2.gz ASJKDXKRYWIISZ-VXKWHMMOSA-N 2 1 384.568 3.024 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)NC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000245918076 1433542469 /nfs/dbraw/zinc/54/24/69/1433542469.db2.gz FZUDDQWBKFRRJG-NQIIRXRSSA-N 2 1 387.572 3.171 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC2CC[NH+]([C@H](C)c3ccncc3)CC2)C1 ZINC000245921503 1433543489 /nfs/dbraw/zinc/54/34/89/1433543489.db2.gz GQYBVWUZETWVKM-RTBURBONSA-N 2 1 387.572 3.027 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)N2[C@H](C)CCC[C@@H]2C)CC1 ZINC000245965181 1433551050 /nfs/dbraw/zinc/55/10/50/1433551050.db2.gz VLKATONIOFRQSZ-ZCNNSNEGSA-N 2 1 381.605 3.235 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000245981314 1433553187 /nfs/dbraw/zinc/55/31/87/1433553187.db2.gz YKKIXZIVCFCVGK-QYZOEREBSA-N 2 1 387.572 3.027 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)c1ccsc1 ZINC000245998106 1433556122 /nfs/dbraw/zinc/55/61/22/1433556122.db2.gz RNKXBYHXUOCHRZ-BHIYHBOVSA-N 2 1 378.586 3.257 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@H]2C[NH+](C)CC[C@@H]21 ZINC000246018198 1433558430 /nfs/dbraw/zinc/55/84/30/1433558430.db2.gz URMMKMJIYJNVGC-UCBRCEGISA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@@H]21 ZINC000246018198 1433558436 /nfs/dbraw/zinc/55/84/36/1433558436.db2.gz URMMKMJIYJNVGC-UCBRCEGISA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21 ZINC000246018198 1433558441 /nfs/dbraw/zinc/55/84/41/1433558441.db2.gz URMMKMJIYJNVGC-UCBRCEGISA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@@H]21 ZINC000246018186 1433558521 /nfs/dbraw/zinc/55/85/21/1433558521.db2.gz URMMKMJIYJNVGC-FUOIXIIKSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21 ZINC000246018186 1433558528 /nfs/dbraw/zinc/55/85/28/1433558528.db2.gz URMMKMJIYJNVGC-FUOIXIIKSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21 ZINC000246018186 1433558531 /nfs/dbraw/zinc/55/85/31/1433558531.db2.gz URMMKMJIYJNVGC-FUOIXIIKSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCCC[C@H]3S(C)(=O)=O)cc2)C1 ZINC000246026480 1433559445 /nfs/dbraw/zinc/55/94/45/1433559445.db2.gz LBKBJDCSOYJVDL-DUXKGJEZSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCCC[C@H]2S(C)(=O)=O)C1 ZINC000246041581 1433560713 /nfs/dbraw/zinc/56/07/13/1433560713.db2.gz NZUMESYTYITNCV-JRGCBEDISA-N 2 1 378.582 3.364 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)Cc1ccccc1 ZINC000246071035 1433564727 /nfs/dbraw/zinc/56/47/27/1433564727.db2.gz ZYMUIODBPBGPLV-BHIFYINESA-N 2 1 386.584 3.065 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+]([C@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000246111673 1433570739 /nfs/dbraw/zinc/57/07/39/1433570739.db2.gz XNNRBIPBRIVHQE-WBVHZDCISA-N 2 1 375.479 3.126 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+]([C@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000246111673 1433570741 /nfs/dbraw/zinc/57/07/41/1433570741.db2.gz XNNRBIPBRIVHQE-WBVHZDCISA-N 2 1 375.479 3.126 20 0 GGADMP C[C@H]1CCc2c(sc3nc(CC[N@@H+]4CC[C@@H](C[NH+]5CCCC5)C4)nc(N)c23)C1 ZINC000246152826 1433575325 /nfs/dbraw/zinc/57/53/25/1433575325.db2.gz GCYQOZXXWMJNEP-HOTGVXAUSA-N 2 1 399.608 3.359 20 0 GGADMP C[C@H]1CCc2c(sc3nc(CC[N@H+]4CC[C@@H](C[NH+]5CCCC5)C4)nc(N)c23)C1 ZINC000246152826 1433575329 /nfs/dbraw/zinc/57/53/29/1433575329.db2.gz GCYQOZXXWMJNEP-HOTGVXAUSA-N 2 1 399.608 3.359 20 0 GGADMP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000246163208 1433576797 /nfs/dbraw/zinc/57/67/97/1433576797.db2.gz KWILNNSLGCDTSG-UGKGYDQZSA-N 2 1 397.567 3.381 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000246163208 1433576799 /nfs/dbraw/zinc/57/67/99/1433576799.db2.gz KWILNNSLGCDTSG-UGKGYDQZSA-N 2 1 397.567 3.381 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](CC(=O)N[C@H](c3ccccc3)C3CC3)CC2)C[C@@H](C)O1 ZINC000246187758 1433579548 /nfs/dbraw/zinc/57/95/48/1433579548.db2.gz IDFAIAKNKBGLIN-KHCICDEESA-N 2 1 399.579 3.075 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1CN(C)Cc1ccco1 ZINC000246192311 1433579967 /nfs/dbraw/zinc/57/99/67/1433579967.db2.gz IKSZTBPBSZICJI-XMSQKQJNSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000246192311 1433579970 /nfs/dbraw/zinc/57/99/70/1433579970.db2.gz IKSZTBPBSZICJI-XMSQKQJNSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000246192311 1433579972 /nfs/dbraw/zinc/57/99/72/1433579972.db2.gz IKSZTBPBSZICJI-XMSQKQJNSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000246192311 1433579975 /nfs/dbraw/zinc/57/99/75/1433579975.db2.gz IKSZTBPBSZICJI-XMSQKQJNSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000246192311 1433579976 /nfs/dbraw/zinc/57/99/76/1433579976.db2.gz IKSZTBPBSZICJI-XMSQKQJNSA-N 2 1 398.551 3.393 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000246289126 1433590059 /nfs/dbraw/zinc/59/00/59/1433590059.db2.gz CGGQWZUJKJJIFU-PMACEKPBSA-N 2 1 375.532 3.132 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)[C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)C1 ZINC000246289126 1433590064 /nfs/dbraw/zinc/59/00/64/1433590064.db2.gz CGGQWZUJKJJIFU-PMACEKPBSA-N 2 1 375.532 3.132 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000246294293 1433591098 /nfs/dbraw/zinc/59/10/98/1433591098.db2.gz DMTASGVFISCNFX-RZUBCFFCSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000246294293 1433591102 /nfs/dbraw/zinc/59/11/02/1433591102.db2.gz DMTASGVFISCNFX-RZUBCFFCSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000246294293 1433591104 /nfs/dbraw/zinc/59/11/04/1433591104.db2.gz DMTASGVFISCNFX-RZUBCFFCSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000246294293 1433591108 /nfs/dbraw/zinc/59/11/08/1433591108.db2.gz DMTASGVFISCNFX-RZUBCFFCSA-N 2 1 390.568 3.159 20 0 GGADMP C[C@H](NC1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000246311474 1433593096 /nfs/dbraw/zinc/59/30/96/1433593096.db2.gz DTPOUCLTEWPRBV-OFAXGOBFSA-N 2 1 389.584 3.046 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000246316906 1433593806 /nfs/dbraw/zinc/59/38/06/1433593806.db2.gz NVENRJGOMLTFCS-QFBILLFUSA-N 2 1 380.964 3.316 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000246316906 1433593810 /nfs/dbraw/zinc/59/38/10/1433593810.db2.gz NVENRJGOMLTFCS-QFBILLFUSA-N 2 1 380.964 3.316 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000246316917 1433594000 /nfs/dbraw/zinc/59/40/00/1433594000.db2.gz NVENRJGOMLTFCS-VQIMIIECSA-N 2 1 380.964 3.316 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000246316917 1433594002 /nfs/dbraw/zinc/59/40/02/1433594002.db2.gz NVENRJGOMLTFCS-VQIMIIECSA-N 2 1 380.964 3.316 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246321676 1433594586 /nfs/dbraw/zinc/59/45/86/1433594586.db2.gz KOQJREKFBVJLTJ-IIZPIQPGSA-N 2 1 390.616 3.403 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246321676 1433594590 /nfs/dbraw/zinc/59/45/90/1433594590.db2.gz KOQJREKFBVJLTJ-IIZPIQPGSA-N 2 1 390.616 3.403 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246321676 1433594592 /nfs/dbraw/zinc/59/45/92/1433594592.db2.gz KOQJREKFBVJLTJ-IIZPIQPGSA-N 2 1 390.616 3.403 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1[C@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000246321026 1433594627 /nfs/dbraw/zinc/59/46/27/1433594627.db2.gz FKSJXDWPRNUAJX-FUOIXIIKSA-N 2 1 398.595 3.411 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000246321026 1433594631 /nfs/dbraw/zinc/59/46/31/1433594631.db2.gz FKSJXDWPRNUAJX-FUOIXIIKSA-N 2 1 398.595 3.411 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000246321026 1433594635 /nfs/dbraw/zinc/59/46/35/1433594635.db2.gz FKSJXDWPRNUAJX-FUOIXIIKSA-N 2 1 398.595 3.411 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)C1 ZINC000246323778 1433594936 /nfs/dbraw/zinc/59/49/36/1433594936.db2.gz HFCYWTSWALHWAU-HBMCJLEFSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)C1 ZINC000246323778 1433594938 /nfs/dbraw/zinc/59/49/38/1433594938.db2.gz HFCYWTSWALHWAU-HBMCJLEFSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)C1 ZINC000246323778 1433594940 /nfs/dbraw/zinc/59/49/40/1433594940.db2.gz HFCYWTSWALHWAU-HBMCJLEFSA-N 2 1 378.605 3.403 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000246340347 1433597353 /nfs/dbraw/zinc/59/73/53/1433597353.db2.gz HXFDJXJRQFATKN-SKWRMQMOSA-N 2 1 398.595 3.413 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)N(C)[C@H]3CC[N@@H+](C)C[C@H]3C)c2)CC1 ZINC000246372413 1433602548 /nfs/dbraw/zinc/60/25/48/1433602548.db2.gz QYBGMWGKQHTLRN-KNQAVFIVSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1C[N@@H+](CCC2CCN(C(=O)[C@H](c3ccccc3)[NH+](C)C)CC2)C[C@H](C)O1 ZINC000246383624 1433604230 /nfs/dbraw/zinc/60/42/30/1433604230.db2.gz OZPMAYSVOZGFFD-JQVVWYNYSA-N 2 1 387.568 3.027 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CCN(C(=O)[C@H](c3ccccc3)[NH+](C)C)CC2)C[C@H](C)O1 ZINC000246383624 1433604232 /nfs/dbraw/zinc/60/42/32/1433604232.db2.gz OZPMAYSVOZGFFD-JQVVWYNYSA-N 2 1 387.568 3.027 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)C1 ZINC000246403775 1433608030 /nfs/dbraw/zinc/60/80/30/1433608030.db2.gz LMZNQBXFSGYLTO-HBMCJLEFSA-N 2 1 378.605 3.260 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)C1 ZINC000246403775 1433608033 /nfs/dbraw/zinc/60/80/33/1433608033.db2.gz LMZNQBXFSGYLTO-HBMCJLEFSA-N 2 1 378.605 3.260 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)C1 ZINC000246403775 1433608036 /nfs/dbraw/zinc/60/80/36/1433608036.db2.gz LMZNQBXFSGYLTO-HBMCJLEFSA-N 2 1 378.605 3.260 20 0 GGADMP C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246408695 1433608281 /nfs/dbraw/zinc/60/82/81/1433608281.db2.gz BKNKEWBIGMYYQJ-CEQIKUNHSA-N 2 1 391.506 3.433 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000246415238 1433609448 /nfs/dbraw/zinc/60/94/48/1433609448.db2.gz SFVCHDVQAAXZBM-MOPGFXCFSA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000246415238 1433609451 /nfs/dbraw/zinc/60/94/51/1433609451.db2.gz SFVCHDVQAAXZBM-MOPGFXCFSA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000246415238 1433609454 /nfs/dbraw/zinc/60/94/54/1433609454.db2.gz SFVCHDVQAAXZBM-MOPGFXCFSA-N 2 1 392.613 3.476 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246415152 1433609476 /nfs/dbraw/zinc/60/94/76/1433609476.db2.gz LEYICUMXOBBWQZ-NNWRFLSQSA-N 2 1 399.604 3.252 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246415152 1433609477 /nfs/dbraw/zinc/60/94/77/1433609477.db2.gz LEYICUMXOBBWQZ-NNWRFLSQSA-N 2 1 399.604 3.252 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000246426089 1433610617 /nfs/dbraw/zinc/61/06/17/1433610617.db2.gz CICJOTMVSZKLLM-UIFIKXQLSA-N 2 1 381.524 3.029 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)N[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000246426089 1433610621 /nfs/dbraw/zinc/61/06/21/1433610621.db2.gz CICJOTMVSZKLLM-UIFIKXQLSA-N 2 1 381.524 3.029 20 0 GGADMP c1ccc(-c2nnn(CCCCC[N@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)n2)cc1 ZINC000246441743 1433613683 /nfs/dbraw/zinc/61/36/83/1433613683.db2.gz DGAGIQABMHPXAM-RBBKRZOGSA-N 2 1 394.567 3.459 20 0 GGADMP c1ccc(-c2nnn(CCCCC[NH+]3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)n2)cc1 ZINC000246441743 1433613686 /nfs/dbraw/zinc/61/36/86/1433613686.db2.gz DGAGIQABMHPXAM-RBBKRZOGSA-N 2 1 394.567 3.459 20 0 GGADMP c1ccc(-c2nnn(CCCCC[NH+]3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)n2)cc1 ZINC000246441743 1433613688 /nfs/dbraw/zinc/61/36/88/1433613688.db2.gz DGAGIQABMHPXAM-RBBKRZOGSA-N 2 1 394.567 3.459 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000246463585 1433616123 /nfs/dbraw/zinc/61/61/23/1433616123.db2.gz QBPCILDHEGQLQQ-QZTJIDSGSA-N 2 1 391.556 3.379 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000246509172 1433623088 /nfs/dbraw/zinc/62/30/88/1433623088.db2.gz SRPWMYCJLJZRGB-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000246509172 1433623093 /nfs/dbraw/zinc/62/30/93/1433623093.db2.gz SRPWMYCJLJZRGB-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000246509172 1433623094 /nfs/dbraw/zinc/62/30/94/1433623094.db2.gz SRPWMYCJLJZRGB-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000246509172 1433623096 /nfs/dbraw/zinc/62/30/96/1433623096.db2.gz SRPWMYCJLJZRGB-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C[N@H+]1Cc1ccccc1 ZINC000246510343 1433623473 /nfs/dbraw/zinc/62/34/73/1433623473.db2.gz UAGPMPAUDJHMIR-WQJYWUQFSA-N 2 1 396.579 3.308 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C[NH+]1Cc1ccccc1 ZINC000246510343 1433623474 /nfs/dbraw/zinc/62/34/74/1433623474.db2.gz UAGPMPAUDJHMIR-WQJYWUQFSA-N 2 1 396.579 3.308 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C[NH+]1Cc1ccccc1 ZINC000246510343 1433623475 /nfs/dbraw/zinc/62/34/75/1433623475.db2.gz UAGPMPAUDJHMIR-WQJYWUQFSA-N 2 1 396.579 3.308 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246513374 1433623791 /nfs/dbraw/zinc/62/37/91/1433623791.db2.gz UFJIKSGWEUCPGP-SBHAEUEKSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246513374 1433623792 /nfs/dbraw/zinc/62/37/92/1433623792.db2.gz UFJIKSGWEUCPGP-SBHAEUEKSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246513374 1433623793 /nfs/dbraw/zinc/62/37/93/1433623793.db2.gz UFJIKSGWEUCPGP-SBHAEUEKSA-N 2 1 376.589 3.013 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000246513803 1433623810 /nfs/dbraw/zinc/62/38/10/1433623810.db2.gz NYMWLGUDMUHPIF-LQWHRVPQSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000246513803 1433623811 /nfs/dbraw/zinc/62/38/11/1433623811.db2.gz NYMWLGUDMUHPIF-LQWHRVPQSA-N 2 1 383.540 3.180 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000246544318 1433628412 /nfs/dbraw/zinc/62/84/12/1433628412.db2.gz YJAOJSKQWJGQPZ-FGZHOGPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000246544318 1433628416 /nfs/dbraw/zinc/62/84/16/1433628416.db2.gz YJAOJSKQWJGQPZ-FGZHOGPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000246544318 1433628418 /nfs/dbraw/zinc/62/84/18/1433628418.db2.gz YJAOJSKQWJGQPZ-FGZHOGPDSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](CCc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000246574131 1433633529 /nfs/dbraw/zinc/63/35/29/1433633529.db2.gz MOFNDJJVNAJHTB-WMZHIEFXSA-N 2 1 379.548 3.495 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NC2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246636617 1433643113 /nfs/dbraw/zinc/64/31/13/1433643113.db2.gz CHBNLKBFRFWMNK-IRFCIJBXSA-N 2 1 386.584 3.174 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246636629 1433643483 /nfs/dbraw/zinc/64/34/83/1433643483.db2.gz CHBNLKBFRFWMNK-KIZRIRGWSA-N 2 1 386.584 3.174 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246636629 1433643486 /nfs/dbraw/zinc/64/34/86/1433643486.db2.gz CHBNLKBFRFWMNK-KIZRIRGWSA-N 2 1 386.584 3.174 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246636629 1433643489 /nfs/dbraw/zinc/64/34/89/1433643489.db2.gz CHBNLKBFRFWMNK-KIZRIRGWSA-N 2 1 386.584 3.174 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C[N@H+]1C1CC1 ZINC000246639260 1433643948 /nfs/dbraw/zinc/64/39/48/1433643948.db2.gz YBRQWPFDPFOMPD-FIEIAYSHSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)C[NH+]1C1CC1 ZINC000246639260 1433643949 /nfs/dbraw/zinc/64/39/49/1433643949.db2.gz YBRQWPFDPFOMPD-FIEIAYSHSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)C[NH+]1C1CC1 ZINC000246639260 1433643950 /nfs/dbraw/zinc/64/39/50/1433643950.db2.gz YBRQWPFDPFOMPD-FIEIAYSHSA-N 2 1 384.568 3.067 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@H](CNC(=O)NC[C@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000246724323 1433655901 /nfs/dbraw/zinc/65/59/01/1433655901.db2.gz VKXYBZVCBPSPGQ-ZWKOTPCHSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000246724323 1433655902 /nfs/dbraw/zinc/65/59/02/1433655902.db2.gz VKXYBZVCBPSPGQ-ZWKOTPCHSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)C1 ZINC000246724323 1433655903 /nfs/dbraw/zinc/65/59/03/1433655903.db2.gz VKXYBZVCBPSPGQ-ZWKOTPCHSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)C1 ZINC000246724323 1433655904 /nfs/dbraw/zinc/65/59/04/1433655904.db2.gz VKXYBZVCBPSPGQ-ZWKOTPCHSA-N 2 1 392.613 3.162 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C1CCCCC1 ZINC000246732201 1433656670 /nfs/dbraw/zinc/65/66/70/1433656670.db2.gz WASXMARGVJVSSX-CEWLAPEOSA-N 2 1 376.589 3.155 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C1CCCCC1 ZINC000246732215 1433657212 /nfs/dbraw/zinc/65/72/12/1433657212.db2.gz WASXMARGVJVSSX-SESVDKBCSA-N 2 1 376.589 3.155 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N(CC)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000246791432 1433667661 /nfs/dbraw/zinc/66/76/61/1433667661.db2.gz JCBVULBAAAQMKP-YADHBBJMSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(CC)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000246791432 1433667662 /nfs/dbraw/zinc/66/76/62/1433667662.db2.gz JCBVULBAAAQMKP-YADHBBJMSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(CC)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000246791432 1433667666 /nfs/dbraw/zinc/66/76/66/1433667666.db2.gz JCBVULBAAAQMKP-YADHBBJMSA-N 2 1 386.584 3.272 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NCC3CC[NH+](Cc4ccccc4)CC3)CC[C@H]21 ZINC000246812324 1433672466 /nfs/dbraw/zinc/67/24/66/1433672466.db2.gz JLWVEVOSNADQIM-FGZHOGPDSA-N 2 1 384.568 3.024 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(Cl)cc2)[C@H](C)C1 ZINC000246816048 1433672779 /nfs/dbraw/zinc/67/27/79/1433672779.db2.gz AWIKAMVOLANSEE-MDZRGWNJSA-N 2 1 381.948 3.394 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(Cl)cc2)[C@H](C)C1 ZINC000246816048 1433672780 /nfs/dbraw/zinc/67/27/80/1433672780.db2.gz AWIKAMVOLANSEE-MDZRGWNJSA-N 2 1 381.948 3.394 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](N[C@H]2CCCN(c3ccc(C)cc3)C2=O)[C@H](C)C1 ZINC000246823707 1433674617 /nfs/dbraw/zinc/67/46/17/1433674617.db2.gz ATERRRXOIBYULA-HJNYFJLDSA-N 2 1 387.568 3.217 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccc(C)cc3)C2=O)[C@H](C)C1 ZINC000246823707 1433674621 /nfs/dbraw/zinc/67/46/21/1433674621.db2.gz ATERRRXOIBYULA-HJNYFJLDSA-N 2 1 387.568 3.217 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccc(C)cc3)C2=O)[C@H](C)C1 ZINC000246823707 1433674628 /nfs/dbraw/zinc/67/46/28/1433674628.db2.gz ATERRRXOIBYULA-HJNYFJLDSA-N 2 1 387.568 3.217 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000246828152 1433675525 /nfs/dbraw/zinc/67/55/25/1433675525.db2.gz DRRFJKRMGYTROF-QZTJIDSGSA-N 2 1 378.586 3.162 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)CC1 ZINC000246839449 1433676817 /nfs/dbraw/zinc/67/68/17/1433676817.db2.gz KJUMTHKMNDOHMU-CBQOVEMMSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000246899989 1433684339 /nfs/dbraw/zinc/68/43/39/1433684339.db2.gz CJKMGIZVIYLABE-AZUAARDMSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000246899989 1433684346 /nfs/dbraw/zinc/68/43/46/1433684346.db2.gz CJKMGIZVIYLABE-AZUAARDMSA-N 2 1 384.524 3.188 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)C1 ZINC000246914157 1433686435 /nfs/dbraw/zinc/68/64/35/1433686435.db2.gz LCYKQLKZFOCKAW-SBHAEUEKSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)C1 ZINC000246914157 1433686439 /nfs/dbraw/zinc/68/64/39/1433686439.db2.gz LCYKQLKZFOCKAW-SBHAEUEKSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)C1 ZINC000246914157 1433686442 /nfs/dbraw/zinc/68/64/42/1433686442.db2.gz LCYKQLKZFOCKAW-SBHAEUEKSA-N 2 1 387.568 3.100 20 0 GGADMP CC[NH+](CC)CCOc1ccc(CN[C@@H]2C[C@H](C)[N@@H+](C)C[C@H]2C)cc1OC ZINC000246920570 1433687297 /nfs/dbraw/zinc/68/72/97/1433687297.db2.gz GSHAJDQTUHCZGL-WSTZPKSXSA-N 2 1 377.573 3.234 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@H]2C)cc1OC ZINC000246920570 1433687298 /nfs/dbraw/zinc/68/72/98/1433687298.db2.gz GSHAJDQTUHCZGL-WSTZPKSXSA-N 3 1 377.573 3.234 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2C[C@H](C)[N@@H+](C)C[C@H]2C)cc1OC ZINC000246920570 1433687299 /nfs/dbraw/zinc/68/72/99/1433687299.db2.gz GSHAJDQTUHCZGL-WSTZPKSXSA-N 3 1 377.573 3.234 20 0 GGADMP COc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246928247 1433688332 /nfs/dbraw/zinc/68/83/32/1433688332.db2.gz SWCXDYAQNMSNHJ-NTLWEQJWSA-N 2 1 385.552 3.210 20 0 GGADMP COc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246928287 1433688370 /nfs/dbraw/zinc/68/83/70/1433688370.db2.gz SWCXDYAQNMSNHJ-UGNRZPKXSA-N 2 1 385.552 3.210 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1)Cc1ccccc1 ZINC000247266571 1433698341 /nfs/dbraw/zinc/69/83/41/1433698341.db2.gz RYCYZCUXZORAHA-FKBYEOEOSA-N 2 1 386.584 3.065 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000247280568 1433699772 /nfs/dbraw/zinc/69/97/72/1433699772.db2.gz KHQKDOJTWLBODI-IFMALSPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000247280568 1433699778 /nfs/dbraw/zinc/69/97/78/1433699778.db2.gz KHQKDOJTWLBODI-IFMALSPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000247280568 1433699783 /nfs/dbraw/zinc/69/97/83/1433699783.db2.gz KHQKDOJTWLBODI-IFMALSPDSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N(C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247308502 1433703322 /nfs/dbraw/zinc/70/33/22/1433703322.db2.gz GYKNJMHFKFGSTL-FCEUIQTBSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247308502 1433703331 /nfs/dbraw/zinc/70/33/31/1433703331.db2.gz GYKNJMHFKFGSTL-FCEUIQTBSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247308502 1433703341 /nfs/dbraw/zinc/70/33/41/1433703341.db2.gz GYKNJMHFKFGSTL-FCEUIQTBSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N(C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247308511 1433703370 /nfs/dbraw/zinc/70/33/70/1433703370.db2.gz GYKNJMHFKFGSTL-KSEOMHKRSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247308511 1433703376 /nfs/dbraw/zinc/70/33/76/1433703376.db2.gz GYKNJMHFKFGSTL-KSEOMHKRSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247308511 1433703383 /nfs/dbraw/zinc/70/33/83/1433703383.db2.gz GYKNJMHFKFGSTL-KSEOMHKRSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C)C2)CC[N@H+]1Cc1ccccc1 ZINC000247329993 1433707897 /nfs/dbraw/zinc/70/78/97/1433707897.db2.gz WVKZTJXJFGKJTL-ZDFPQIBNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)CC[NH+]1Cc1ccccc1 ZINC000247329993 1433707901 /nfs/dbraw/zinc/70/79/01/1433707901.db2.gz WVKZTJXJFGKJTL-ZDFPQIBNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)CC[NH+]1Cc1ccccc1 ZINC000247329993 1433707907 /nfs/dbraw/zinc/70/79/07/1433707907.db2.gz WVKZTJXJFGKJTL-ZDFPQIBNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247346076 1433710765 /nfs/dbraw/zinc/71/07/65/1433710765.db2.gz XVFGTFDPJJYXAD-UCBRCEGISA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000247346076 1433710767 /nfs/dbraw/zinc/71/07/67/1433710767.db2.gz XVFGTFDPJJYXAD-UCBRCEGISA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000247346076 1433710770 /nfs/dbraw/zinc/71/07/70/1433710770.db2.gz XVFGTFDPJJYXAD-UCBRCEGISA-N 2 1 398.595 3.269 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCC[C@@H](C)C2)C1 ZINC000247403987 1433717549 /nfs/dbraw/zinc/71/75/49/1433717549.db2.gz XRZDMVAXRDFOIE-WOJBJXKFSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000247403987 1433717553 /nfs/dbraw/zinc/71/75/53/1433717553.db2.gz XRZDMVAXRDFOIE-WOJBJXKFSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000247403987 1433717557 /nfs/dbraw/zinc/71/75/57/1433717557.db2.gz XRZDMVAXRDFOIE-WOJBJXKFSA-N 2 1 386.584 3.402 20 0 GGADMP CC1CC[NH+](CCNC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000247415928 1433719323 /nfs/dbraw/zinc/71/93/23/1433719323.db2.gz UAKUWUTXKKRGJZ-UNMCSNQZSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)N(C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247412052 1433719385 /nfs/dbraw/zinc/71/93/85/1433719385.db2.gz STPXEFOSJUHGPP-RZUBCFFCSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247412052 1433719390 /nfs/dbraw/zinc/71/93/90/1433719390.db2.gz STPXEFOSJUHGPP-RZUBCFFCSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247412052 1433719397 /nfs/dbraw/zinc/71/93/97/1433719397.db2.gz STPXEFOSJUHGPP-RZUBCFFCSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)NC[C@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000247419240 1433720094 /nfs/dbraw/zinc/72/00/94/1433720094.db2.gz UPQVACTVCLWYEX-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000247419240 1433720099 /nfs/dbraw/zinc/72/00/99/1433720099.db2.gz UPQVACTVCLWYEX-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000247419240 1433720104 /nfs/dbraw/zinc/72/01/04/1433720104.db2.gz UPQVACTVCLWYEX-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247460219 1433725359 /nfs/dbraw/zinc/72/53/59/1433725359.db2.gz UIKHWUZJHWTASA-KSEOMHKRSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247460219 1433725364 /nfs/dbraw/zinc/72/53/64/1433725364.db2.gz UIKHWUZJHWTASA-KSEOMHKRSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247460219 1433725365 /nfs/dbraw/zinc/72/53/65/1433725365.db2.gz UIKHWUZJHWTASA-KSEOMHKRSA-N 2 1 386.584 3.317 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@H]1CN(c2ccccc2)C(=O)O1 ZINC000247485215 1433728241 /nfs/dbraw/zinc/72/82/41/1433728241.db2.gz KMHRTVHXSNUHER-UNMCSNQZSA-N 2 1 379.504 3.466 20 0 GGADMP C[N@@H+](C[C@H]1CN(c2ccccc2)C(=O)O1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000247485215 1433728245 /nfs/dbraw/zinc/72/82/45/1433728245.db2.gz KMHRTVHXSNUHER-UNMCSNQZSA-N 2 1 379.504 3.466 20 0 GGADMP C[N@H+](C[C@H]1CN(c2ccccc2)C(=O)O1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000247485215 1433728249 /nfs/dbraw/zinc/72/82/49/1433728249.db2.gz KMHRTVHXSNUHER-UNMCSNQZSA-N 2 1 379.504 3.466 20 0 GGADMP C[NH+](C[C@H]1CN(c2ccccc2)C(=O)O1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000247485215 1433728253 /nfs/dbraw/zinc/72/82/53/1433728253.db2.gz KMHRTVHXSNUHER-UNMCSNQZSA-N 2 1 379.504 3.466 20 0 GGADMP C[NH+](C[C@H]1CN(c2ccccc2)C(=O)O1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000247485215 1433728257 /nfs/dbraw/zinc/72/82/57/1433728257.db2.gz KMHRTVHXSNUHER-UNMCSNQZSA-N 2 1 379.504 3.466 20 0 GGADMP Cc1ccc([C@H](OC[C@@H](O)C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c2ccccc2)cc1 ZINC000247516354 1433732783 /nfs/dbraw/zinc/73/27/83/1433732783.db2.gz WIFRYPABMYXVDI-NKKJXINNSA-N 2 1 382.548 3.345 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1CNC(=O)N[C@H]1c2ccccc2CC[C@@H]1n1ccnc1 ZINC000247529217 1433733948 /nfs/dbraw/zinc/73/39/48/1433733948.db2.gz OUJFPJOFRIKCIB-GIVPXCGWSA-N 2 1 381.524 3.285 20 0 GGADMP C[N@@H+](C[C@@H](O)COCc1ccccc1F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000247563277 1433737706 /nfs/dbraw/zinc/73/77/06/1433737706.db2.gz QZJURPLUMUGOTI-RBBKRZOGSA-N 2 1 386.511 3.157 20 0 GGADMP C[NH+](C[C@@H](O)COCc1ccccc1F)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000247563277 1433737711 /nfs/dbraw/zinc/73/77/11/1433737711.db2.gz QZJURPLUMUGOTI-RBBKRZOGSA-N 2 1 386.511 3.157 20 0 GGADMP C[NH+](C[C@@H](O)COCc1ccccc1F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000247563277 1433737714 /nfs/dbraw/zinc/73/77/14/1433737714.db2.gz QZJURPLUMUGOTI-RBBKRZOGSA-N 2 1 386.511 3.157 20 0 GGADMP O[C@H](COc1cccc(C(F)(F)F)c1)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000247640954 1433742052 /nfs/dbraw/zinc/74/20/52/1433742052.db2.gz SXLCWGUWOSLIPC-WMZOPIPTSA-N 2 1 386.458 3.253 20 0 GGADMP O[C@H](COc1cccc(C(F)(F)F)c1)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000247640954 1433742062 /nfs/dbraw/zinc/74/20/62/1433742062.db2.gz SXLCWGUWOSLIPC-WMZOPIPTSA-N 2 1 386.458 3.253 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@H+](C[C@@H](O)COc3cccc4[nH]ccc43)C2)CC1 ZINC000247651944 1433742996 /nfs/dbraw/zinc/74/29/96/1433742996.db2.gz WOIKOUMDDYMDGP-WOJBJXKFSA-N 2 1 385.552 3.352 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](C[C@@H](O)COc3cccc4[nH]ccc43)C2)CC1 ZINC000247651944 1433743001 /nfs/dbraw/zinc/74/30/01/1433743001.db2.gz WOIKOUMDDYMDGP-WOJBJXKFSA-N 2 1 385.552 3.352 20 0 GGADMP C[N@@H+](CC1CC[NH+](C[C@H](O)c2ccccc2)CC1)[C@@H]1Cc2ccccc2[C@H]1O ZINC000247710098 1433747481 /nfs/dbraw/zinc/74/74/81/1433747481.db2.gz RSJIYFMBSJJNSJ-TZRRMPRUSA-N 2 1 380.532 3.022 20 0 GGADMP C[NH+](C)C1(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCN2C(=O)OC(C)(C)C)CCOCC1 ZINC000247878288 1433754736 /nfs/dbraw/zinc/75/47/36/1433754736.db2.gz ZGGWOGTVWTWSDM-QRVBRYPASA-N 2 1 395.588 3.255 20 0 GGADMP C[C@@H](NCCC[N@H+]1CCCC[C@@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000247890539 1433755491 /nfs/dbraw/zinc/75/54/91/1433755491.db2.gz FDYFWNYQFWHDKC-ZWKOTPCHSA-N 2 1 379.570 3.142 20 0 GGADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000247890539 1433755494 /nfs/dbraw/zinc/75/54/94/1433755494.db2.gz FDYFWNYQFWHDKC-ZWKOTPCHSA-N 2 1 379.570 3.142 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000247890539 1433755496 /nfs/dbraw/zinc/75/54/96/1433755496.db2.gz FDYFWNYQFWHDKC-ZWKOTPCHSA-N 2 1 379.570 3.142 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000247929054 1433756541 /nfs/dbraw/zinc/75/65/41/1433756541.db2.gz BWBZWDGXLVGXRQ-BHIFYINESA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000247929054 1433756545 /nfs/dbraw/zinc/75/65/45/1433756545.db2.gz BWBZWDGXLVGXRQ-BHIFYINESA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000247929054 1433756549 /nfs/dbraw/zinc/75/65/49/1433756549.db2.gz BWBZWDGXLVGXRQ-BHIFYINESA-N 2 1 384.568 3.024 20 0 GGADMP COc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c1)CC2 ZINC000248010066 1433762867 /nfs/dbraw/zinc/76/28/67/1433762867.db2.gz LEXPZHGVMGDJJZ-OFNKIYASSA-N 2 1 393.531 3.170 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000248134547 1433773388 /nfs/dbraw/zinc/77/33/88/1433773388.db2.gz OWUPRJLWGSVILJ-QZNHQXDQSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248134547 1433773395 /nfs/dbraw/zinc/77/33/95/1433773395.db2.gz OWUPRJLWGSVILJ-QZNHQXDQSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000248134547 1433773405 /nfs/dbraw/zinc/77/34/05/1433773405.db2.gz OWUPRJLWGSVILJ-QZNHQXDQSA-N 2 1 396.579 3.167 20 0 GGADMP O[C@H](COCc1ccco1)C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000248168640 1433776690 /nfs/dbraw/zinc/77/66/90/1433776690.db2.gz UHMDJGDCJXDRFC-QNWVGRARSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000248168640 1433776697 /nfs/dbraw/zinc/77/66/97/1433776697.db2.gz UHMDJGDCJXDRFC-QNWVGRARSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248168640 1433776706 /nfs/dbraw/zinc/77/67/06/1433776706.db2.gz UHMDJGDCJXDRFC-QNWVGRARSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000248168640 1433776712 /nfs/dbraw/zinc/77/67/12/1433776712.db2.gz UHMDJGDCJXDRFC-QNWVGRARSA-N 2 1 384.520 3.144 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)CC(=O)Nc2cccnc2Cl)[C@@H](C)C1 ZINC000248215785 1433780175 /nfs/dbraw/zinc/78/01/75/1433780175.db2.gz ZPRDSNPHBZYELH-BBWFWOEESA-N 2 1 396.963 3.179 20 0 GGADMP CC(C)[C@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000248255274 1433783462 /nfs/dbraw/zinc/78/34/62/1433783462.db2.gz ULEIKGJILBUAPR-XQBPLPMBSA-N 2 1 387.568 3.032 20 0 GGADMP CC(C)[C@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000248255274 1433783468 /nfs/dbraw/zinc/78/34/68/1433783468.db2.gz ULEIKGJILBUAPR-XQBPLPMBSA-N 2 1 387.568 3.032 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)[C@H]3CC[NH+](C4CCCCC4)C3)c2)CCO1 ZINC000248371889 1433789166 /nfs/dbraw/zinc/78/91/66/1433789166.db2.gz ZGBPBBRWSFMMNY-KNQAVFIVSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)[C@H]3CC[NH+](C4CCCCC4)C3)c2)CCO1 ZINC000248371889 1433789173 /nfs/dbraw/zinc/78/91/73/1433789173.db2.gz ZGBPBBRWSFMMNY-KNQAVFIVSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@@H]1C[NH+](Cc2cccc(CNC(=O)[C@H]3CC[N@@H+](C4CCCCC4)C3)c2)CCO1 ZINC000248371889 1433789182 /nfs/dbraw/zinc/78/91/82/1433789182.db2.gz ZGBPBBRWSFMMNY-KNQAVFIVSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@@H]1C[NH+](Cc2cccc(CNC(=O)[C@H]3CC[N@H+](C4CCCCC4)C3)c2)CCO1 ZINC000248371889 1433789190 /nfs/dbraw/zinc/78/91/90/1433789190.db2.gz ZGBPBBRWSFMMNY-KNQAVFIVSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)NC(=O)Nc1ccccc1 ZINC000248390815 1433793459 /nfs/dbraw/zinc/79/34/59/1433793459.db2.gz CKANSMQURBJSSK-OEWRPIJISA-N 2 1 394.519 3.081 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)NC(=O)Nc1ccccc1 ZINC000248390815 1433793463 /nfs/dbraw/zinc/79/34/63/1433793463.db2.gz CKANSMQURBJSSK-OEWRPIJISA-N 2 1 394.519 3.081 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@@H](O)COCc1cccs1 ZINC000248391613 1433794123 /nfs/dbraw/zinc/79/41/23/1433794123.db2.gz DJAMZFOXQKOLKY-MXKPZRPRSA-N 2 1 388.577 3.372 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)[NH+]1CCc2ccccc2C1 ZINC000248402322 1433797493 /nfs/dbraw/zinc/79/74/93/1433797493.db2.gz NCYSACUVMIKOTD-DYXWJJEUSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000248402322 1433797497 /nfs/dbraw/zinc/79/74/97/1433797497.db2.gz NCYSACUVMIKOTD-DYXWJJEUSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000248402322 1433797502 /nfs/dbraw/zinc/79/75/02/1433797502.db2.gz NCYSACUVMIKOTD-DYXWJJEUSA-N 2 1 398.595 3.385 20 0 GGADMP CNC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000248401554 1433797609 /nfs/dbraw/zinc/79/76/09/1433797609.db2.gz LWBQWVVOSHSCHH-YTFSRNRJSA-N 2 1 377.532 3.437 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)N1CC[NH+](C)CC1 ZINC000248402336 1433797660 /nfs/dbraw/zinc/79/76/60/1433797660.db2.gz NEWKLNRIMJIGQE-LIONHTAISA-N 3 1 398.639 3.149 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)N1CCN(C)CC1 ZINC000248402336 1433797661 /nfs/dbraw/zinc/79/76/61/1433797661.db2.gz NEWKLNRIMJIGQE-LIONHTAISA-N 2 1 398.639 3.149 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)N1CCN(C)CC1 ZINC000248402336 1433797662 /nfs/dbraw/zinc/79/76/62/1433797662.db2.gz NEWKLNRIMJIGQE-LIONHTAISA-N 2 1 398.639 3.149 20 0 GGADMP Cc1cccn2c(=O)cc(C[NH2+][C@H]3[C@H](C)C[N@@H+](Cc4ccccc4)C[C@@H]3C)nc12 ZINC000248401703 1433798072 /nfs/dbraw/zinc/79/80/72/1433798072.db2.gz SIOHSLDVISNJFE-MOJGAOKDSA-N 2 1 390.531 3.249 20 0 GGADMP Cc1cccn2c(=O)cc(C[NH2+][C@H]3[C@H](C)C[N@H+](Cc4ccccc4)C[C@@H]3C)nc12 ZINC000248401703 1433798076 /nfs/dbraw/zinc/79/80/76/1433798076.db2.gz SIOHSLDVISNJFE-MOJGAOKDSA-N 2 1 390.531 3.249 20 0 GGADMP COc1ccccc1CNC(=O)C[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000248401815 1433798122 /nfs/dbraw/zinc/79/81/22/1433798122.db2.gz SXJYUNPGOQCBMI-HROJSSOGSA-N 2 1 395.547 3.058 20 0 GGADMP COc1ccccc1CNC(=O)C[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000248401815 1433798126 /nfs/dbraw/zinc/79/81/26/1433798126.db2.gz SXJYUNPGOQCBMI-HROJSSOGSA-N 2 1 395.547 3.058 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1cccs1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248403772 1433798505 /nfs/dbraw/zinc/79/85/05/1433798505.db2.gz PBOFXCAOTYIFIU-XYJFISCASA-N 2 1 378.586 3.303 20 0 GGADMP COc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000248403691 1433798527 /nfs/dbraw/zinc/79/85/27/1433798527.db2.gz OYNNFVDVHWSWKE-JZXOWHBKSA-N 2 1 394.581 3.402 20 0 GGADMP COc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000248403691 1433798533 /nfs/dbraw/zinc/79/85/33/1433798533.db2.gz OYNNFVDVHWSWKE-JZXOWHBKSA-N 2 1 394.581 3.402 20 0 GGADMP COc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000248403689 1433798682 /nfs/dbraw/zinc/79/86/82/1433798682.db2.gz OYNNFVDVHWSWKE-BQFCYCMXSA-N 2 1 394.581 3.402 20 0 GGADMP COc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000248403689 1433798688 /nfs/dbraw/zinc/79/86/88/1433798688.db2.gz OYNNFVDVHWSWKE-BQFCYCMXSA-N 2 1 394.581 3.402 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(NS(C)(=O)=O)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248402794 1433798842 /nfs/dbraw/zinc/79/88/42/1433798842.db2.gz NTQOREFCAJXEKV-JZXOWHBKSA-N 2 1 379.570 3.362 20 0 GGADMP CS(=O)(=O)C1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248408888 1433800149 /nfs/dbraw/zinc/80/01/49/1433800149.db2.gz VYSNOKXFUBBUGS-OAADDMNDSA-N 2 1 390.593 3.233 20 0 GGADMP CS(=O)(=O)C1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248408888 1433800150 /nfs/dbraw/zinc/80/01/50/1433800150.db2.gz VYSNOKXFUBBUGS-OAADDMNDSA-N 2 1 390.593 3.233 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]23)C[C@H](C)O1 ZINC000248410732 1433800418 /nfs/dbraw/zinc/80/04/18/1433800418.db2.gz HKUTYWOWULCPFN-MRQKEVAZSA-N 3 1 385.596 3.376 20 0 GGADMP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)C[C@H](C)O1 ZINC000248410732 1433800419 /nfs/dbraw/zinc/80/04/19/1433800419.db2.gz HKUTYWOWULCPFN-MRQKEVAZSA-N 3 1 385.596 3.376 20 0 GGADMP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)C[C@H](C)O1 ZINC000248410732 1433800421 /nfs/dbraw/zinc/80/04/21/1433800421.db2.gz HKUTYWOWULCPFN-MRQKEVAZSA-N 3 1 385.596 3.376 20 0 GGADMP CN(C)C(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000248413047 1433800545 /nfs/dbraw/zinc/80/05/45/1433800545.db2.gz KUNALMCVSJDXSO-YCAMKHIRSA-N 2 1 391.559 3.186 20 0 GGADMP CN(C)C(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000248413047 1433800546 /nfs/dbraw/zinc/80/05/46/1433800546.db2.gz KUNALMCVSJDXSO-YCAMKHIRSA-N 2 1 391.559 3.186 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)C(=O)NCc1ccccc1 ZINC000248416905 1433801039 /nfs/dbraw/zinc/80/10/39/1433801039.db2.gz QIGBSCNXMUICID-OUFMZXHOSA-N 2 1 377.532 3.192 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)C(=O)NCc1ccccc1 ZINC000248416904 1433801102 /nfs/dbraw/zinc/80/11/02/1433801102.db2.gz QIGBSCNXMUICID-JBJBFBLISA-N 2 1 377.532 3.192 20 0 GGADMP O=C1[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CCCN1CC(F)(F)F ZINC000248418844 1433801236 /nfs/dbraw/zinc/80/12/36/1433801236.db2.gz UDNCHHBTVGUCIL-WJFTUGDTSA-N 2 1 395.469 3.040 20 0 GGADMP O=C1[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CCCN1CC(F)(F)F ZINC000248418842 1433801294 /nfs/dbraw/zinc/80/12/94/1433801294.db2.gz UDNCHHBTVGUCIL-INDMIFKZSA-N 2 1 395.469 3.040 20 0 GGADMP O[C@@H](COc1ccccc1C(F)(F)F)C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000248435742 1433802391 /nfs/dbraw/zinc/80/23/91/1433802391.db2.gz AHLOPNYKQQTXBF-IAGOWNOFSA-N 2 1 386.458 3.395 20 0 GGADMP O[C@@H](COc1ccccc1C(F)(F)F)C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000248435742 1433802393 /nfs/dbraw/zinc/80/23/93/1433802393.db2.gz AHLOPNYKQQTXBF-IAGOWNOFSA-N 2 1 386.458 3.395 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)c(F)c1 ZINC000248447760 1433803448 /nfs/dbraw/zinc/80/34/48/1433803448.db2.gz NPKICKCZRZXCPO-UGKGYDQZSA-N 2 1 390.474 3.399 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)c1ccc(F)c(F)c1 ZINC000248447760 1433803450 /nfs/dbraw/zinc/80/34/50/1433803450.db2.gz NPKICKCZRZXCPO-UGKGYDQZSA-N 2 1 390.474 3.399 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(-n2ccnc2)cc1 ZINC000248453047 1433803904 /nfs/dbraw/zinc/80/39/04/1433803904.db2.gz QGLUALXMFYLDRM-FDDCHVKYSA-N 2 1 376.504 3.290 20 0 GGADMP CCOc1ccc(OC[C@H](O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248568693 1433808914 /nfs/dbraw/zinc/80/89/14/1433808914.db2.gz LNUBQHIOKIPYPD-WSTZPKSXSA-N 2 1 376.541 3.068 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NC[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000248591441 1433810060 /nfs/dbraw/zinc/81/00/60/1433810060.db2.gz YZTVOGMCENJSLZ-DNVCBOLYSA-N 2 1 396.938 3.208 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000248591441 1433810061 /nfs/dbraw/zinc/81/00/61/1433810061.db2.gz YZTVOGMCENJSLZ-DNVCBOLYSA-N 2 1 396.938 3.208 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1)[C@H](c1ccccc1)[NH+](C)C ZINC000248622488 1433812086 /nfs/dbraw/zinc/81/20/86/1433812086.db2.gz BEKPNZMCXGPNMS-NGYIFUPDSA-N 2 1 395.547 3.085 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@H](c1ccccc1)[NH+](C)C ZINC000248622488 1433812087 /nfs/dbraw/zinc/81/20/87/1433812087.db2.gz BEKPNZMCXGPNMS-NGYIFUPDSA-N 2 1 395.547 3.085 20 0 GGADMP CC[C@H]([NH2+][C@@H](C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)c1c(C)noc1C ZINC000248642603 1433813285 /nfs/dbraw/zinc/81/32/85/1433813285.db2.gz ZSWHYGIRIKDRLX-VDGAXYAQSA-N 2 1 384.524 3.111 20 0 GGADMP CC[C@H]([NH2+][C@@H](C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(C)noc1C ZINC000248642603 1433813286 /nfs/dbraw/zinc/81/32/86/1433813286.db2.gz ZSWHYGIRIKDRLX-VDGAXYAQSA-N 2 1 384.524 3.111 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)C[C@@H]2COCCN2C(=O)OC(C)(C)C)C1 ZINC000248690636 1433815498 /nfs/dbraw/zinc/81/54/98/1433815498.db2.gz AULGVFAICONKBE-VAMGGRTRSA-N 2 1 397.604 3.359 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 ZINC000248707748 1433816425 /nfs/dbraw/zinc/81/64/25/1433816425.db2.gz IBTPXJLTSRPOOM-AHEZYBDSSA-N 2 1 383.458 3.125 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000248724522 1433817927 /nfs/dbraw/zinc/81/79/27/1433817927.db2.gz HQCKYHKWGKADQV-FUDKSRODSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000248724522 1433817928 /nfs/dbraw/zinc/81/79/28/1433817928.db2.gz HQCKYHKWGKADQV-FUDKSRODSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000248724522 1433817929 /nfs/dbraw/zinc/81/79/29/1433817929.db2.gz HQCKYHKWGKADQV-FUDKSRODSA-N 2 1 396.579 3.167 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)[C@@H](C)C1 ZINC000248734417 1433818601 /nfs/dbraw/zinc/81/86/01/1433818601.db2.gz PLONXNJIZJWFJR-LESCRADOSA-N 2 1 383.458 3.126 20 0 GGADMP C[C@@H](CCc1ccc(O)cc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248749696 1433819869 /nfs/dbraw/zinc/81/98/69/1433819869.db2.gz SWWMBUASJXQHAW-PGRDOPGGSA-N 2 1 395.547 3.200 20 0 GGADMP O=C1C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)CN1Cc1ccccc1C(F)(F)F ZINC000248773560 1433821721 /nfs/dbraw/zinc/82/17/21/1433821721.db2.gz YKSNBGJCLBUYRV-IKGGRYGDSA-N 2 1 381.442 3.023 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000248799131 1433823081 /nfs/dbraw/zinc/82/30/81/1433823081.db2.gz JNNIVLQSKPBMBO-XMSQKQJNSA-N 2 1 384.568 3.213 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NC[C@H]1C[NH+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000248830712 1433824589 /nfs/dbraw/zinc/82/45/89/1433824589.db2.gz LMMXCNJJAMRMSU-GOTSBHOMSA-N 2 1 395.547 3.087 20 0 GGADMP CC[NH+](C)[C@H](C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000248830712 1433824590 /nfs/dbraw/zinc/82/45/90/1433824590.db2.gz LMMXCNJJAMRMSU-GOTSBHOMSA-N 2 1 395.547 3.087 20 0 GGADMP CC[NH+](C)[C@H](C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000248830712 1433824591 /nfs/dbraw/zinc/82/45/91/1433824591.db2.gz LMMXCNJJAMRMSU-GOTSBHOMSA-N 2 1 395.547 3.087 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000248852093 1433825765 /nfs/dbraw/zinc/82/57/65/1433825765.db2.gz OWKCSKXGFSJOMI-VLSUOOLDSA-N 2 1 396.579 3.165 20 0 GGADMP O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)[C@H]1CC[NH+](C2CCCCC2)C1 ZINC000248855250 1433826067 /nfs/dbraw/zinc/82/60/67/1433826067.db2.gz VWCHSXOCSAJOQX-JTHBVZDNSA-N 2 1 399.579 3.048 20 0 GGADMP O=C(NC[C@@H]1C[NH+](Cc2ccccc2)CCCO1)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000248855250 1433826070 /nfs/dbraw/zinc/82/60/70/1433826070.db2.gz VWCHSXOCSAJOQX-JTHBVZDNSA-N 2 1 399.579 3.048 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[C@@H](C)C1 ZINC000248944970 1433830169 /nfs/dbraw/zinc/83/01/69/1433830169.db2.gz DHDHMFYNKQJYMP-PXCRPINLSA-N 2 1 387.568 3.079 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[C@@H](C)C1 ZINC000248944970 1433830170 /nfs/dbraw/zinc/83/01/70/1433830170.db2.gz DHDHMFYNKQJYMP-PXCRPINLSA-N 2 1 387.568 3.079 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2c(F)cccc2Cl)CCO1 ZINC000248996352 1433831713 /nfs/dbraw/zinc/83/17/13/1433831713.db2.gz PAVRGLBAFBVEED-JDQBCZDHSA-N 2 1 395.950 3.456 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2c(F)cccc2Cl)CCO1 ZINC000248996352 1433831714 /nfs/dbraw/zinc/83/17/14/1433831714.db2.gz PAVRGLBAFBVEED-JDQBCZDHSA-N 2 1 395.950 3.456 20 0 GGADMP COc1cccc2c1CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)C2 ZINC000249033999 1433832794 /nfs/dbraw/zinc/83/27/94/1433832794.db2.gz MHBHGYQTWPYNLM-YADHBBJMSA-N 2 1 380.532 3.299 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCCNc4ccccc43)c2)C1 ZINC000249058511 1433833325 /nfs/dbraw/zinc/83/33/25/1433833325.db2.gz ZKGFAVMMVSJWDA-OFNKIYASSA-N 2 1 392.547 3.421 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)[C@@H](C)C1 ZINC000249127197 1433836571 /nfs/dbraw/zinc/83/65/71/1433836571.db2.gz RHYIRWGVSJGZGW-PGRDOPGGSA-N 2 1 388.531 3.297 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)[C@@H](C)C1 ZINC000249127197 1433836572 /nfs/dbraw/zinc/83/65/72/1433836572.db2.gz RHYIRWGVSJGZGW-PGRDOPGGSA-N 2 1 388.531 3.297 20 0 GGADMP C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000249181886 1433838417 /nfs/dbraw/zinc/83/84/17/1433838417.db2.gz INFBWLKACDACCB-SMVLHYPJSA-N 2 1 383.536 3.304 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000249181886 1433838418 /nfs/dbraw/zinc/83/84/18/1433838418.db2.gz INFBWLKACDACCB-SMVLHYPJSA-N 2 1 383.536 3.304 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN([C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1 ZINC000249273498 1433839953 /nfs/dbraw/zinc/83/99/53/1433839953.db2.gz JLWKIEGXVYNMBR-UZLBHIALSA-N 2 1 379.495 3.120 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@H](C)[C@@H]2CNC(=O)OC(C)(C)C)CC1 ZINC000249274896 1433840054 /nfs/dbraw/zinc/84/00/54/1433840054.db2.gz KMQOOOVKJGHXHB-PMACEKPBSA-N 2 1 396.620 3.028 20 0 GGADMP COc1ccccc1[C@@H]1CCC[N@H+]1CC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000249284031 1433840386 /nfs/dbraw/zinc/84/03/86/1433840386.db2.gz HPDUNJFCNPXWHT-LEWJYISDSA-N 2 1 381.520 3.251 20 0 GGADMP CCN(C(=O)NC[C@H](C)Cn1cc[nH+]c1C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000249357588 1433841630 /nfs/dbraw/zinc/84/16/30/1433841630.db2.gz RUHAHXHGKGZDRR-GHTZIAJQSA-N 2 1 383.540 3.134 20 0 GGADMP CCN(C(=O)NC[C@H](C)Cn1cc[nH+]c1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249357588 1433841632 /nfs/dbraw/zinc/84/16/32/1433841632.db2.gz RUHAHXHGKGZDRR-GHTZIAJQSA-N 2 1 383.540 3.134 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cc(C)cc(C)c2)[C@@H](C)C1 ZINC000249389971 1433842296 /nfs/dbraw/zinc/84/22/96/1433842296.db2.gz RTJRFGDUHSVLRE-ZVDOUQERSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cc(C)cc(C)c2)[C@@H](C)C1 ZINC000249389971 1433842297 /nfs/dbraw/zinc/84/22/97/1433842297.db2.gz RTJRFGDUHSVLRE-ZVDOUQERSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000249412808 1433843083 /nfs/dbraw/zinc/84/30/83/1433843083.db2.gz FOCWKZKJJRUUIF-IIMDRIAPSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000249412808 1433843085 /nfs/dbraw/zinc/84/30/85/1433843085.db2.gz FOCWKZKJJRUUIF-IIMDRIAPSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)[C@@H](C)C1 ZINC000249461969 1433844378 /nfs/dbraw/zinc/84/43/78/1433844378.db2.gz QZQMFDUXDLLVRI-MKUJHJDCSA-N 2 1 381.605 3.042 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)[C@@H](C)C1 ZINC000249461969 1433844379 /nfs/dbraw/zinc/84/43/79/1433844379.db2.gz QZQMFDUXDLLVRI-MKUJHJDCSA-N 2 1 381.605 3.042 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cc(C)ccc2C)[C@@H](C)C1 ZINC000249478641 1433844672 /nfs/dbraw/zinc/84/46/72/1433844672.db2.gz WIULXYNPLCKKQI-ZCNNSNEGSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cc(C)ccc2C)[C@@H](C)C1 ZINC000249478641 1433844675 /nfs/dbraw/zinc/84/46/75/1433844675.db2.gz WIULXYNPLCKKQI-ZCNNSNEGSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)ccc2C)[C@@H](C)C1 ZINC000249478639 1433844713 /nfs/dbraw/zinc/84/47/13/1433844713.db2.gz WIULXYNPLCKKQI-UFYCRDLUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)ccc2C)[C@@H](C)C1 ZINC000249478639 1433844714 /nfs/dbraw/zinc/84/47/14/1433844714.db2.gz WIULXYNPLCKKQI-UFYCRDLUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCC(=O)N[C@@H](C)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249486542 1433844781 /nfs/dbraw/zinc/84/47/81/1433844781.db2.gz UNJXKVAVGONJTE-ZWOKBUDYSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249486542 1433844782 /nfs/dbraw/zinc/84/47/82/1433844782.db2.gz UNJXKVAVGONJTE-ZWOKBUDYSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249486542 1433844783 /nfs/dbraw/zinc/84/47/83/1433844783.db2.gz UNJXKVAVGONJTE-ZWOKBUDYSA-N 2 1 395.975 3.244 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NC[C@H]3CC[NH+](C4CC4)C3)cc2)C1 ZINC000249507634 1433845398 /nfs/dbraw/zinc/84/53/98/1433845398.db2.gz JUJFOFMUBAZLIA-GHTZIAJQSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@H]1CCC[NH+](Cc2ccc(CNC(=O)NC[C@H]3CC[N@@H+](C4CC4)C3)cc2)C1 ZINC000249507634 1433845399 /nfs/dbraw/zinc/84/53/99/1433845399.db2.gz JUJFOFMUBAZLIA-GHTZIAJQSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@H]1CCC[NH+](Cc2ccc(CNC(=O)NC[C@H]3CC[N@H+](C4CC4)C3)cc2)C1 ZINC000249507634 1433845400 /nfs/dbraw/zinc/84/54/00/1433845400.db2.gz JUJFOFMUBAZLIA-GHTZIAJQSA-N 2 1 384.568 3.202 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000249688408 1433848951 /nfs/dbraw/zinc/84/89/51/1433848951.db2.gz MLDXRJDKJJERFI-OALUTQOASA-N 2 1 396.620 3.028 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000249688408 1433848952 /nfs/dbraw/zinc/84/89/52/1433848952.db2.gz MLDXRJDKJJERFI-OALUTQOASA-N 2 1 396.620 3.028 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000249779715 1433852016 /nfs/dbraw/zinc/85/20/16/1433852016.db2.gz PCMNNCSOIAXGII-PMACEKPBSA-N 2 1 386.584 3.113 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)C1CCS(=O)(=O)CC1 ZINC000249956803 1433853790 /nfs/dbraw/zinc/85/37/90/1433853790.db2.gz JHVRCFUJTOIEHK-CEXWTWQISA-N 2 1 392.609 3.467 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)C1CCS(=O)(=O)CC1 ZINC000250067440 1433854096 /nfs/dbraw/zinc/85/40/96/1433854096.db2.gz NQJMXZRYXZIVTN-QZTJIDSGSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000250418423 1433855991 /nfs/dbraw/zinc/85/59/91/1433855991.db2.gz BPMZUODZAQYZTO-QRVBRYPASA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000250418423 1433855992 /nfs/dbraw/zinc/85/59/92/1433855992.db2.gz BPMZUODZAQYZTO-QRVBRYPASA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000250418423 1433855993 /nfs/dbraw/zinc/85/59/93/1433855993.db2.gz BPMZUODZAQYZTO-QRVBRYPASA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000250418417 1433856072 /nfs/dbraw/zinc/85/60/72/1433856072.db2.gz BPMZUODZAQYZTO-GUDVDZBRSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000250418417 1433856073 /nfs/dbraw/zinc/85/60/73/1433856073.db2.gz BPMZUODZAQYZTO-GUDVDZBRSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000250418417 1433856074 /nfs/dbraw/zinc/85/60/74/1433856074.db2.gz BPMZUODZAQYZTO-GUDVDZBRSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)N3CC[C@@H](C[NH+](C)C)C3)cc2)C1 ZINC000251432048 1433858043 /nfs/dbraw/zinc/85/80/43/1433858043.db2.gz BGUJXJCRUNCNLS-JQVVWYNYSA-N 2 1 386.584 3.258 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)[NH+](C)C)cc1 ZINC000251506497 1433858548 /nfs/dbraw/zinc/85/85/48/1433858548.db2.gz YCVHFEZESHIABU-VXKWHMMOSA-N 2 1 380.536 3.296 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)[NH+](C)C)cc1 ZINC000251506497 1433858549 /nfs/dbraw/zinc/85/85/49/1433858549.db2.gz YCVHFEZESHIABU-VXKWHMMOSA-N 2 1 380.536 3.296 20 0 GGADMP C[NH+](C)C[C@@H]1CCN(C(=O)NC[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)C1 ZINC000251545715 1433858780 /nfs/dbraw/zinc/85/87/80/1433858780.db2.gz GURZXWGTIDHHJU-GMBSWORKSA-N 2 1 396.938 3.065 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1)C1CC1 ZINC000251685661 1433859812 /nfs/dbraw/zinc/85/98/12/1433859812.db2.gz OBSVCSBBOGINEA-YPAWHYETSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1)C1CC1 ZINC000251685661 1433859813 /nfs/dbraw/zinc/85/98/13/1433859813.db2.gz OBSVCSBBOGINEA-YPAWHYETSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)C1CC1 ZINC000251685661 1433859816 /nfs/dbraw/zinc/85/98/16/1433859816.db2.gz OBSVCSBBOGINEA-YPAWHYETSA-N 2 1 384.568 3.023 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1)C1CC1 ZINC000251685655 1433859891 /nfs/dbraw/zinc/85/98/91/1433859891.db2.gz OBSVCSBBOGINEA-VSKRKVRLSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1)C1CC1 ZINC000251685655 1433859892 /nfs/dbraw/zinc/85/98/92/1433859892.db2.gz OBSVCSBBOGINEA-VSKRKVRLSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)C1CC1 ZINC000251685655 1433859893 /nfs/dbraw/zinc/85/98/93/1433859893.db2.gz OBSVCSBBOGINEA-VSKRKVRLSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CC[NH+](C)C[C@H]2c2ccccc2)C1 ZINC000252209551 1433862797 /nfs/dbraw/zinc/86/27/97/1433862797.db2.gz XUPFXQPNAVFHTK-VWPQPMDRSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[NH+](C)C[C@H]2c2ccccc2)C1 ZINC000252209551 1433862798 /nfs/dbraw/zinc/86/27/98/1433862798.db2.gz XUPFXQPNAVFHTK-VWPQPMDRSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)C1 ZINC000252209551 1433862799 /nfs/dbraw/zinc/86/27/99/1433862799.db2.gz XUPFXQPNAVFHTK-VWPQPMDRSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC000252209551 1433862800 /nfs/dbraw/zinc/86/28/00/1433862800.db2.gz XUPFXQPNAVFHTK-VWPQPMDRSA-N 2 1 386.584 3.443 20 0 GGADMP COc1ccc([C@H](NC(=O)CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C(C)C)cc1 ZINC000252692405 1433864270 /nfs/dbraw/zinc/86/42/70/1433864270.db2.gz BHHANLJUAWWODG-NGYIFUPDSA-N 2 1 399.579 3.457 20 0 GGADMP COc1ccc([C@H](NC(=O)CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C2CC2)cc1 ZINC000252692328 1433864290 /nfs/dbraw/zinc/86/42/90/1433864290.db2.gz BERGFCZHMSMTTQ-BPUDTRNYSA-N 2 1 397.563 3.211 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@H+](C)C2CC[NH+](CCC)CC2)c(OC)c1 ZINC000255324692 1433880369 /nfs/dbraw/zinc/88/03/69/1433880369.db2.gz VDBUEFXHNZNCJK-MWGFUINXSA-N 2 1 376.541 3.274 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+](Cc2csc(C3CCCCC3)n2)C1)[C@H]1CCC[NH2+]1 ZINC000261651453 1433898264 /nfs/dbraw/zinc/89/82/64/1433898264.db2.gz ALIANANPSCHRST-QFBILLFUSA-N 2 1 390.597 3.271 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2csc(C3CCCCC3)n2)C1)[C@H]1CCC[NH2+]1 ZINC000261651453 1433898266 /nfs/dbraw/zinc/89/82/66/1433898266.db2.gz ALIANANPSCHRST-QFBILLFUSA-N 2 1 390.597 3.271 20 0 GGADMP NC(=O)c1ccc(-c2nc(C[N@@H+]3C[C@@H](C[NH3+])[C@H](c4ccccc4)C3)cs2)cc1 ZINC000261807480 1433905063 /nfs/dbraw/zinc/90/50/63/1433905063.db2.gz RGSCCUAAWJGEBI-QUCCMNQESA-N 2 1 392.528 3.083 20 0 GGADMP NC(=O)c1ccc(-c2nc(C[N@H+]3C[C@@H](C[NH3+])[C@H](c4ccccc4)C3)cs2)cc1 ZINC000261807480 1433905064 /nfs/dbraw/zinc/90/50/64/1433905064.db2.gz RGSCCUAAWJGEBI-QUCCMNQESA-N 2 1 392.528 3.083 20 0 GGADMP CCOc1cc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)ccc1OCC(=O)Nc1ccccc1 ZINC000261817162 1433905413 /nfs/dbraw/zinc/90/54/13/1433905413.db2.gz XJZFMPYPEAIIGW-HSZRJFAPSA-N 2 1 397.519 3.274 20 0 GGADMP CCOc1cc(C[N@H+]2CC[C@](C)(C[NH3+])C2)ccc1OCC(=O)Nc1ccccc1 ZINC000261817162 1433905420 /nfs/dbraw/zinc/90/54/20/1433905420.db2.gz XJZFMPYPEAIIGW-HSZRJFAPSA-N 2 1 397.519 3.274 20 0 GGADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000261880031 1433909294 /nfs/dbraw/zinc/90/92/94/1433909294.db2.gz PAYJAYBBDAIQEG-IIDMSEBBSA-N 2 1 383.458 3.347 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+](Cc2ccc(SC(F)F)cc2)C1)[C@H]1CCC[NH2+]1 ZINC000261921102 1433913106 /nfs/dbraw/zinc/91/31/06/1433913106.db2.gz UYOKGPSLVMEQAR-NVXWUHKLSA-N 2 1 383.508 3.082 20 0 GGADMP O=C(NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1)[C@H]1CC12CC[NH2+]CC2 ZINC000261939329 1433914321 /nfs/dbraw/zinc/91/43/21/1433914321.db2.gz MUZUGUIBEYFYOK-UXHICEINSA-N 2 1 395.572 3.353 20 0 GGADMP O=C(NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1)[C@H]1CC12CC[NH2+]CC2 ZINC000261939329 1433914322 /nfs/dbraw/zinc/91/43/22/1433914322.db2.gz MUZUGUIBEYFYOK-UXHICEINSA-N 2 1 395.572 3.353 20 0 GGADMP C[NH2+]CCC1CC[NH+](Cc2csc(CC(=O)Nc3ccccc3C)n2)CC1 ZINC000261964139 1433916906 /nfs/dbraw/zinc/91/69/06/1433916906.db2.gz AKEWTLJHUWHZRD-UHFFFAOYSA-N 2 1 386.565 3.454 20 0 GGADMP C[NH2+]CCC1CC[NH+](CC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2)CC1 ZINC000261979906 1433919205 /nfs/dbraw/zinc/91/92/05/1433919205.db2.gz HOCSXVVHZPJKEP-UHFFFAOYSA-N 2 1 397.567 3.430 20 0 GGADMP C[NH2+]CCC1CC[NH+](Cc2csc(CC(=O)Nc3ccc(C)cc3)n2)CC1 ZINC000261998779 1433920524 /nfs/dbraw/zinc/92/05/24/1433920524.db2.gz OSWIEPRTMVPHCF-UHFFFAOYSA-N 2 1 386.565 3.454 20 0 GGADMP [NH3+]CCC(=O)NC[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000261998064 1433920682 /nfs/dbraw/zinc/92/06/82/1433920682.db2.gz KZEKJJPQIOCSSJ-HNNXBMFYSA-N 2 1 398.532 3.376 20 0 GGADMP [NH3+]CCC(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000261998064 1433920683 /nfs/dbraw/zinc/92/06/83/1433920683.db2.gz KZEKJJPQIOCSSJ-HNNXBMFYSA-N 2 1 398.532 3.376 20 0 GGADMP C[NH2+]CCC1CC[NH+]([C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)CC1 ZINC000262014367 1433922175 /nfs/dbraw/zinc/92/21/75/1433922175.db2.gz VKVGLOOEFGBENM-GOSISDBHSA-N 2 1 383.540 3.138 20 0 GGADMP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000262101383 1433926980 /nfs/dbraw/zinc/92/69/80/1433926980.db2.gz ZHSMJLPVAWTFNQ-JOCHJYFZSA-N 2 1 381.495 3.211 20 0 GGADMP C[C@@H]1CC[N@@H+](CCOc2ccc(NC(=O)C3C[C@H]4CCC[C@@H](C3)C4[NH3+])cc2)C1 ZINC000262303744 1433934342 /nfs/dbraw/zinc/93/43/42/1433934342.db2.gz OFDURMNKZBWTKN-BORGENLISA-N 2 1 385.552 3.499 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)c2csc(CC[NH3+])n2)C1 ZINC000262309756 1433934416 /nfs/dbraw/zinc/93/44/16/1433934416.db2.gz AGMJPLQYKBITIK-IYBDPMFKSA-N 2 1 386.565 3.052 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N(CCC[NH3+])Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000262492341 1433941340 /nfs/dbraw/zinc/94/13/40/1433941340.db2.gz VIDVBQJYVALHPC-BGYRXZFFSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N(CCC[NH3+])Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000262492341 1433941344 /nfs/dbraw/zinc/94/13/44/1433941344.db2.gz VIDVBQJYVALHPC-BGYRXZFFSA-N 2 1 395.547 3.287 20 0 GGADMP COc1ccc([C@@H](CNC(=O)[C@@H]([NH3+])c2ccc(C)cc2)[NH+]2CCCCC2)cc1 ZINC000262672199 1433949138 /nfs/dbraw/zinc/94/91/38/1433949138.db2.gz SBUVOZMUQZOXQB-YADHBBJMSA-N 2 1 381.520 3.347 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1(C)C ZINC000262752385 1433953685 /nfs/dbraw/zinc/95/36/85/1433953685.db2.gz ACTVHYKREJXHJN-HCLVMJGWSA-N 2 1 387.568 3.067 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1(C)C ZINC000262762678 1433954245 /nfs/dbraw/zinc/95/42/45/1433954245.db2.gz DSGHPKFOJDVBST-HCLVMJGWSA-N 2 1 387.568 3.067 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1(C)C ZINC000262761797 1433954303 /nfs/dbraw/zinc/95/43/03/1433954303.db2.gz DNEIPCUEABEYTG-CFKGEZKQSA-N 2 1 387.568 3.030 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccn([C@H]4CCC[NH2+]C4)n3)cc2)C1 ZINC000262834187 1433960205 /nfs/dbraw/zinc/96/02/05/1433960205.db2.gz SJRIORMPYKNQTL-PXNSSMCTSA-N 2 1 381.524 3.292 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000263271551 1434000131 /nfs/dbraw/zinc/00/01/31/1434000131.db2.gz XAOJRNHQNXUBIO-HUUCEWRRSA-N 2 1 382.346 3.488 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cs1 ZINC000263741040 1434027658 /nfs/dbraw/zinc/02/76/58/1434027658.db2.gz AERLUBKEECCDOQ-FQEVSTJZSA-N 2 1 398.576 3.054 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)cs1 ZINC000263741040 1434027662 /nfs/dbraw/zinc/02/76/62/1434027662.db2.gz AERLUBKEECCDOQ-FQEVSTJZSA-N 2 1 398.576 3.054 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cc(F)cc4c3OCOC4)CC2)C[C@H](C)O1 ZINC000263770853 1434031697 /nfs/dbraw/zinc/03/16/97/1434031697.db2.gz STWXGWXJNJFXCP-IYBDPMFKSA-N 2 1 378.488 3.013 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cc(F)cc4c3OCOC4)CC2)C[C@H](C)O1 ZINC000263770853 1434031700 /nfs/dbraw/zinc/03/17/00/1434031700.db2.gz STWXGWXJNJFXCP-IYBDPMFKSA-N 2 1 378.488 3.013 20 0 GGADMP C[C@@H]1C[N@H+](CC2CCN(C(=O)c3cccc(C[NH+]4CCCC4)c3)CC2)C[C@H](C)O1 ZINC000263832318 1434039398 /nfs/dbraw/zinc/03/93/98/1434039398.db2.gz SMUCCRSUHLHTKW-BGYRXZFFSA-N 2 1 399.579 3.244 20 0 GGADMP Cc1sc2nc([C@@H](C)[N@@H+](C)CC3CC[NH+](C[C@@H](C)O)CC3)[nH]c(=O)c2c1C ZINC000264359320 1434101812 /nfs/dbraw/zinc/10/18/12/1434101812.db2.gz JELBFOYJUPDTEG-TZMCWYRMSA-N 2 1 392.569 3.099 20 0 GGADMP Cc1sc2nc([C@@H](C)[N@H+](C)CC3CC[NH+](C[C@@H](C)O)CC3)[nH]c(=O)c2c1C ZINC000264359320 1434101816 /nfs/dbraw/zinc/10/18/16/1434101816.db2.gz JELBFOYJUPDTEG-TZMCWYRMSA-N 2 1 392.569 3.099 20 0 GGADMP Cc1sc2nc([C@@H](C)[N@@H+](C)CC3CC[NH+](C[C@H](C)O)CC3)[nH]c(=O)c2c1C ZINC000264359317 1434101849 /nfs/dbraw/zinc/10/18/49/1434101849.db2.gz JELBFOYJUPDTEG-GXTWGEPZSA-N 2 1 392.569 3.099 20 0 GGADMP Cc1sc2nc([C@@H](C)[N@H+](C)CC3CC[NH+](C[C@H](C)O)CC3)[nH]c(=O)c2c1C ZINC000264359317 1434101851 /nfs/dbraw/zinc/10/18/51/1434101851.db2.gz JELBFOYJUPDTEG-GXTWGEPZSA-N 2 1 392.569 3.099 20 0 GGADMP C[N@@H+](CCCOCC(F)(F)F)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000264402935 1434108110 /nfs/dbraw/zinc/10/81/10/1434108110.db2.gz UHKLZFCRSBZDLP-LJQANCHMSA-N 2 1 388.474 3.333 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]CCCC[N@H+]3CCC[C@H]3CO)cs2)cc1 ZINC000264944890 1434166583 /nfs/dbraw/zinc/16/65/83/1434166583.db2.gz ICYSGFMSWUCFAA-IBGZPJMESA-N 2 1 389.565 3.357 20 0 GGADMP CCN1CC[NH+](CCCCNC(=O)c2ccc(C[N@@H+](CC)C(C)C)cc2)CC1 ZINC000265136708 1434189370 /nfs/dbraw/zinc/18/93/70/1434189370.db2.gz UDYUEUHBYHEDQL-UHFFFAOYSA-N 2 1 388.600 3.064 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)NCCCCN2CC[NH+](CC)CC2)cc1)C(C)C ZINC000265136708 1434189372 /nfs/dbraw/zinc/18/93/72/1434189372.db2.gz UDYUEUHBYHEDQL-UHFFFAOYSA-N 2 1 388.600 3.064 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NCCCCN2CC[NH+](CC)CC2)cc1)C(C)C ZINC000265136708 1434189375 /nfs/dbraw/zinc/18/93/75/1434189375.db2.gz UDYUEUHBYHEDQL-UHFFFAOYSA-N 2 1 388.600 3.064 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc(C[NH+]3CCCC3)cc2)[C@@H](C)C1 ZINC000265253585 1434208022 /nfs/dbraw/zinc/20/80/22/1434208022.db2.gz KSZXVJTYPLRYEY-SIKLNZKXSA-N 2 1 387.568 3.149 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)NC2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000265487815 1434238899 /nfs/dbraw/zinc/23/88/99/1434238899.db2.gz FOOZWAZXUKJLOU-FQEVSTJZSA-N 2 1 387.568 3.149 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)N2CC[NH+](CC3CCOCC3)CC2)cc1 ZINC000265534435 1434243621 /nfs/dbraw/zinc/24/36/21/1434243621.db2.gz OAJHWPCMJVEUMH-UHFFFAOYSA-N 2 1 387.568 3.103 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCCC2(CCOCC2)C1 ZINC000266009496 1434296002 /nfs/dbraw/zinc/29/60/02/1434296002.db2.gz LORKQGQBSYTFKI-HXUWFJFHSA-N 2 1 399.579 3.048 20 0 GGADMP CC[NH+](CC)CCSCC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000266138202 1434306393 /nfs/dbraw/zinc/30/63/93/1434306393.db2.gz LFXLQBGELLYDMJ-UHFFFAOYSA-N 2 1 399.551 3.120 20 0 GGADMP C[NH+](C)C/C=C/C(=O)N(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000266460289 1434339542 /nfs/dbraw/zinc/33/95/42/1434339542.db2.gz HJVGOXKTNGRUKP-YOCVDRLZSA-N 2 1 383.458 3.017 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NC(=O)c2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000266651423 1434359090 /nfs/dbraw/zinc/35/90/90/1434359090.db2.gz NUSKVZXATDQPEN-UHFFFAOYSA-N 2 1 380.492 3.035 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000266789403 1434375783 /nfs/dbraw/zinc/37/57/83/1434375783.db2.gz SHTAWYDGMRJCOE-SFHVURJKSA-N 2 1 389.569 3.245 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000266789403 1434375787 /nfs/dbraw/zinc/37/57/87/1434375787.db2.gz SHTAWYDGMRJCOE-SFHVURJKSA-N 2 1 389.569 3.245 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000266849459 1434381576 /nfs/dbraw/zinc/38/15/76/1434381576.db2.gz PAOGVONIIZQJCR-UHFFFAOYSA-N 2 1 389.609 3.111 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000266981613 1434395741 /nfs/dbraw/zinc/39/57/41/1434395741.db2.gz NCBXVAPPZUIQHE-UHFFFAOYSA-N 2 1 396.539 3.172 20 0 GGADMP C[NH+](C)Cc1ccc(-c2noc([C@@H]3C[N@H+](Cc4ccccc4)CCO3)n2)cc1 ZINC000267088673 1434406601 /nfs/dbraw/zinc/40/66/01/1434406601.db2.gz RUANGUYWXNUEMM-FQEVSTJZSA-N 2 1 378.476 3.372 20 0 GGADMP C[NH+](C)Cc1ccc(-c2noc([C@@H]3C[N@@H+](Cc4ccccc4)CCO3)n2)cc1 ZINC000267088673 1434406604 /nfs/dbraw/zinc/40/66/04/1434406604.db2.gz RUANGUYWXNUEMM-FQEVSTJZSA-N 2 1 378.476 3.372 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)[C@@H](c2ccccc2)N2CCOCC2)cn1 ZINC000267285590 1434419320 /nfs/dbraw/zinc/41/93/20/1434419320.db2.gz WJXBILSLBIWAKL-MBSDFSHPSA-N 2 1 391.519 3.127 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000267308593 1434421470 /nfs/dbraw/zinc/42/14/70/1434421470.db2.gz BSPHVOOSTRSVKO-RXVVDRJESA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000267308593 1434421472 /nfs/dbraw/zinc/42/14/72/1434421472.db2.gz BSPHVOOSTRSVKO-RXVVDRJESA-N 2 1 383.540 3.182 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000267325201 1434423105 /nfs/dbraw/zinc/42/31/05/1434423105.db2.gz DYQVKHSDNHDAIO-KNQAVFIVSA-N 2 1 386.584 3.413 20 0 GGADMP Cn1c2ccccc2nc1CC[N@@H+](C)C1CCN(CCc2ccccn2)CC1 ZINC000267339265 1434423993 /nfs/dbraw/zinc/42/39/93/1434423993.db2.gz BUPTYIUGMNHLSK-UHFFFAOYSA-N 2 1 377.536 3.150 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000267359277 1434425569 /nfs/dbraw/zinc/42/55/69/1434425569.db2.gz IYMWDTFGONLGOZ-KNQAVFIVSA-N 2 1 386.584 3.270 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)NC1CC[NH+](C2CCCC2)CC1 ZINC000267378714 1434427585 /nfs/dbraw/zinc/42/75/85/1434427585.db2.gz VBVZCYLGGROWLU-NRFANRHFSA-N 2 1 398.595 3.257 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000267426056 1434431482 /nfs/dbraw/zinc/43/14/82/1434431482.db2.gz QLPOHZMHMXLVGP-ILWGZMRPSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000267426056 1434431484 /nfs/dbraw/zinc/43/14/84/1434431484.db2.gz QLPOHZMHMXLVGP-ILWGZMRPSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000267426056 1434431486 /nfs/dbraw/zinc/43/14/86/1434431486.db2.gz QLPOHZMHMXLVGP-ILWGZMRPSA-N 2 1 386.584 3.270 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCC1CC[NH+](CCC(C)C)CC1 ZINC000267496918 1434440962 /nfs/dbraw/zinc/44/09/62/1434440962.db2.gz HPOUXCSKDWDGGG-UHFFFAOYSA-N 2 1 398.555 3.133 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000268556815 1434533336 /nfs/dbraw/zinc/53/33/36/1434533336.db2.gz JLJURRHVFCDJDE-ROUUACIJSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1ccc(CNC(=O)C2CC[NH+](CC[C@@H]3CCCC[N@@H+]3C)CC2)cc1F ZINC000268569008 1434535103 /nfs/dbraw/zinc/53/51/03/1434535103.db2.gz QUFWTOYATGOZFV-FQEVSTJZSA-N 2 1 375.532 3.337 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1cccc(N2CCOCC2)c1 ZINC000268701390 1434548565 /nfs/dbraw/zinc/54/85/65/1434548565.db2.gz AHYYHPVDSQBGGR-HXUWFJFHSA-N 2 1 395.547 3.206 20 0 GGADMP C[C@@H]1C[C@@H](NCc2ccc(N3CCOCC3)nc2)CC[N@H+]1Cc1ccccc1 ZINC000268741802 1434551890 /nfs/dbraw/zinc/55/18/90/1434551890.db2.gz GDNKEDOUDWWDJW-KNQAVFIVSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CCN1Cc1ccccc1 ZINC000268741802 1434551893 /nfs/dbraw/zinc/55/18/93/1434551893.db2.gz GDNKEDOUDWWDJW-KNQAVFIVSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CC[N@@H+]1Cc1ccccc1 ZINC000268741802 1434551897 /nfs/dbraw/zinc/55/18/97/1434551897.db2.gz GDNKEDOUDWWDJW-KNQAVFIVSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CC[N@H+]1Cc1ccccc1 ZINC000268741802 1434551900 /nfs/dbraw/zinc/55/19/00/1434551900.db2.gz GDNKEDOUDWWDJW-KNQAVFIVSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)[C@@H](C)C3)cn2)CCO1 ZINC000268761542 1434553999 /nfs/dbraw/zinc/55/39/99/1434553999.db2.gz HMEDEIIUMSAQMP-MIZPHKNDSA-N 2 1 394.563 3.449 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H](C)C3)cn2)CCO1 ZINC000268761542 1434554001 /nfs/dbraw/zinc/55/40/01/1434554001.db2.gz HMEDEIIUMSAQMP-MIZPHKNDSA-N 2 1 394.563 3.449 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2cccnc2N2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000268761818 1434554053 /nfs/dbraw/zinc/55/40/53/1434554053.db2.gz LUOXWWZUSFWLBH-DENIHFKCSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2cccnc2N2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000268761818 1434554055 /nfs/dbraw/zinc/55/40/55/1434554055.db2.gz LUOXWWZUSFWLBH-DENIHFKCSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2cccnc2N2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000268761826 1434554213 /nfs/dbraw/zinc/55/42/13/1434554213.db2.gz LUOXWWZUSFWLBH-UGKGYDQZSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2cccnc2N2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000268761826 1434554216 /nfs/dbraw/zinc/55/42/16/1434554216.db2.gz LUOXWWZUSFWLBH-UGKGYDQZSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2cccc(OCC(=O)N(C)C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000268766862 1434554611 /nfs/dbraw/zinc/55/46/11/1434554611.db2.gz JPKLLPMSRNUPSG-SIKLNZKXSA-N 2 1 395.547 3.296 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2cccc(OCC(=O)N(C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000268766862 1434554615 /nfs/dbraw/zinc/55/46/15/1434554615.db2.gz JPKLLPMSRNUPSG-SIKLNZKXSA-N 2 1 395.547 3.296 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc(COC)o2)cc1OC ZINC000268795791 1434558044 /nfs/dbraw/zinc/55/80/44/1434558044.db2.gz NVNPTYBNHMPTMI-UHFFFAOYSA-N 2 1 376.497 3.445 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2ccc(OC(F)F)c(OC)c2)CC1 ZINC000268801451 1434558651 /nfs/dbraw/zinc/55/86/51/1434558651.db2.gz HOVYWRTWYUHJDP-INIZCTEOSA-N 2 1 385.499 3.365 20 0 GGADMP CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)cc1 ZINC000268811257 1434560132 /nfs/dbraw/zinc/56/01/32/1434560132.db2.gz KYSIZVHJKLFCLM-SFHVURJKSA-N 2 1 381.520 3.324 20 0 GGADMP C[C@H]([NH2+]C[C@@H](O)C[NH+]1CCCC1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000268825517 1434561378 /nfs/dbraw/zinc/56/13/78/1434561378.db2.gz JBGBLYVXHCFWRR-GHTZIAJQSA-N 2 1 394.519 3.021 20 0 GGADMP COc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ccc1OCCO ZINC000268826161 1434561417 /nfs/dbraw/zinc/56/14/17/1434561417.db2.gz YXUDQDSCMVWWDE-NQIIRXRSSA-N 2 1 384.520 3.209 20 0 GGADMP COc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1OCCO ZINC000268826161 1434561420 /nfs/dbraw/zinc/56/14/20/1434561420.db2.gz YXUDQDSCMVWWDE-NQIIRXRSSA-N 2 1 384.520 3.209 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2ccc(OCc3nccn3C)cc2)CC1 ZINC000268838619 1434562929 /nfs/dbraw/zinc/56/29/29/1434562929.db2.gz SYMTXWFUHHDZBO-HXUWFJFHSA-N 2 1 399.583 3.067 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(C(=O)c3ccncc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000268867324 1434566157 /nfs/dbraw/zinc/56/61/57/1434566157.db2.gz WYUAUMTUMUDFIW-CVDCTZTESA-N 2 1 392.547 3.329 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(C(=O)c3ccncc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000268867324 1434566160 /nfs/dbraw/zinc/56/61/60/1434566160.db2.gz WYUAUMTUMUDFIW-CVDCTZTESA-N 2 1 392.547 3.329 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(C(=O)c3ccncc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000268867328 1434566224 /nfs/dbraw/zinc/56/62/24/1434566224.db2.gz WYUAUMTUMUDFIW-XXBNENTESA-N 2 1 392.547 3.329 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(C(=O)c3ccncc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000268867328 1434566226 /nfs/dbraw/zinc/56/62/26/1434566226.db2.gz WYUAUMTUMUDFIW-XXBNENTESA-N 2 1 392.547 3.329 20 0 GGADMP COCCOc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1OC ZINC000268877741 1434567262 /nfs/dbraw/zinc/56/72/62/1434567262.db2.gz ZELPYGYSMIVVBB-OTWHNJEPSA-N 2 1 394.556 3.260 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000268899338 1434568994 /nfs/dbraw/zinc/56/89/94/1434568994.db2.gz OJCLOFZCWXHHRO-QGZVFWFLSA-N 2 1 392.569 3.353 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(OCCOC)cc2)[C@@H](C)C1 ZINC000268901630 1434569067 /nfs/dbraw/zinc/56/90/67/1434569067.db2.gz LHYDZEQPRUQNBC-IPJJNNNSSA-N 2 1 378.557 3.499 20 0 GGADMP CNC(=O)[C@H](Cc1c[nH]c2ccccc12)[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC000268928416 1434571922 /nfs/dbraw/zinc/57/19/22/1434571922.db2.gz WVLXRGXXFCOJJV-WGGBDISSSA-N 2 1 396.579 3.458 20 0 GGADMP CN(C)C(=O)[C@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000268959314 1434575912 /nfs/dbraw/zinc/57/59/12/1434575912.db2.gz XFSRRBINUZQYRA-RXVVDRJESA-N 2 1 375.532 3.069 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H]2CO)cc1 ZINC000268972103 1434577022 /nfs/dbraw/zinc/57/70/22/1434577022.db2.gz ZPZOLTBBNIZDQF-PXNSSMCTSA-N 2 1 376.545 3.104 20 0 GGADMP OC[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000268997064 1434579566 /nfs/dbraw/zinc/57/95/66/1434579566.db2.gz NWOYNMRBKNQJNZ-URXFXBBRSA-N 2 1 379.548 3.128 20 0 GGADMP OC[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000268997064 1434579569 /nfs/dbraw/zinc/57/95/69/1434579569.db2.gz NWOYNMRBKNQJNZ-URXFXBBRSA-N 2 1 379.548 3.128 20 0 GGADMP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+]Cc2ccccc2OCc2cccnc2)CC1 ZINC000268995135 1434579616 /nfs/dbraw/zinc/57/96/16/1434579616.db2.gz XHRAPYUADWKTJW-FGZHOGPDSA-N 2 1 381.520 3.128 20 0 GGADMP O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1Cc2ccccc2C[NH2+]1 ZINC000269277907 1434616931 /nfs/dbraw/zinc/61/69/31/1434616931.db2.gz YNLQMTCFEATEBF-WVUPVLJSSA-N 2 1 375.516 3.013 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccsc1 ZINC000269482146 1434652187 /nfs/dbraw/zinc/65/21/87/1434652187.db2.gz GESFITAMOROOIS-KFKAGJAMSA-N 2 1 376.570 3.009 20 0 GGADMP CSc1ccc(OCC[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000269608470 1434663299 /nfs/dbraw/zinc/66/32/99/1434663299.db2.gz APCSJEXBJVKSJG-UHFFFAOYSA-N 2 1 377.598 3.278 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1 ZINC000269713539 1434671414 /nfs/dbraw/zinc/67/14/14/1434671414.db2.gz QXLJFEKEILEKTH-ROUUACIJSA-N 2 1 380.492 3.169 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H]3CCc4c3c(F)ccc4F)c2)C1 ZINC000269884652 1434684215 /nfs/dbraw/zinc/68/42/15/1434684215.db2.gz ZVTGHAMHOLDKRD-UWJYYQICSA-N 2 1 399.485 3.439 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCc4c3c(F)ccc4F)c2)C1 ZINC000269884652 1434684217 /nfs/dbraw/zinc/68/42/17/1434684217.db2.gz ZVTGHAMHOLDKRD-UWJYYQICSA-N 2 1 399.485 3.439 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)cc1F ZINC000270288769 1434719821 /nfs/dbraw/zinc/71/98/21/1434719821.db2.gz WMDOJEPKNKDBPR-IBGZPJMESA-N 2 1 399.514 3.193 20 0 GGADMP CCOc1ccc(C(C)=O)cc1C[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000271009500 1434795283 /nfs/dbraw/zinc/79/52/83/1434795283.db2.gz ZPJIHWMWBCAOAV-UHFFFAOYSA-N 2 1 387.568 3.278 20 0 GGADMP C[C@@H](CC[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1)[NH+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000271217735 1434808789 /nfs/dbraw/zinc/80/87/89/1434808789.db2.gz JEFXBRUQUOUFRN-FXTUREPZSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[NH+]1CC[C@@H](C)[C@@H](n2ccnc2)C1)[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000271217735 1434808791 /nfs/dbraw/zinc/80/87/91/1434808791.db2.gz JEFXBRUQUOUFRN-FXTUREPZSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[NH+]1CC[C@@H](C)[C@@H](n2ccnc2)C1)[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000271217735 1434808792 /nfs/dbraw/zinc/80/87/92/1434808792.db2.gz JEFXBRUQUOUFRN-FXTUREPZSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1)[NH+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271217738 1434808802 /nfs/dbraw/zinc/80/88/02/1434808802.db2.gz JEFXBRUQUOUFRN-LLVBAIKDSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[NH+]1CC[C@@H](C)[C@@H](n2ccnc2)C1)[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271217738 1434808804 /nfs/dbraw/zinc/80/88/04/1434808804.db2.gz JEFXBRUQUOUFRN-LLVBAIKDSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[NH+]1CC[C@@H](C)[C@@H](n2ccnc2)C1)[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271217738 1434808805 /nfs/dbraw/zinc/80/88/05/1434808805.db2.gz JEFXBRUQUOUFRN-LLVBAIKDSA-N 2 1 384.572 3.324 20 0 GGADMP COc1cc(OC)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc1Cl ZINC000271515240 1434831075 /nfs/dbraw/zinc/83/10/75/1434831075.db2.gz OLYQTYLWKFSFPR-KKXDTOCCSA-N 2 1 382.932 3.386 20 0 GGADMP CN(CC[N@@H+](C)Cc1ccc(OCc2ccncc2)cc1)C1CC[NH+](C)CC1 ZINC000271603029 1434838539 /nfs/dbraw/zinc/83/85/39/1434838539.db2.gz AZDGIPNVQPRKMR-UHFFFAOYSA-N 2 1 382.552 3.118 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(S(N)(=O)=O)c1 ZINC000271611896 1434839069 /nfs/dbraw/zinc/83/90/69/1434839069.db2.gz AVHPJPSWBNESCT-ABSDTBQOSA-N 2 1 387.549 3.038 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(S(N)(=O)=O)c1 ZINC000271611896 1434839070 /nfs/dbraw/zinc/83/90/70/1434839070.db2.gz AVHPJPSWBNESCT-ABSDTBQOSA-N 2 1 387.549 3.038 20 0 GGADMP C[NH+]1CCN(C(=O)c2ccc(C[NH2+][C@H]3CCCc4cc(F)ccc43)cc2)CC1 ZINC000271758400 1434848462 /nfs/dbraw/zinc/84/84/62/1434848462.db2.gz ZBVKHUMXNQYQPF-QFIPXVFZSA-N 2 1 381.495 3.381 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](c2nccn2C)C2CC2)cc1OC ZINC000271781403 1434850103 /nfs/dbraw/zinc/85/01/03/1434850103.db2.gz GYUCQEBERLOBND-OAQYLSRUSA-N 2 1 386.540 3.390 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)NCC2=CC[NH+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000271869177 1434856036 /nfs/dbraw/zinc/85/60/36/1434856036.db2.gz JRGJDCALBQMGMB-APWZRJJASA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)NCC2=CC[N@H+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000271869177 1434856037 /nfs/dbraw/zinc/85/60/37/1434856037.db2.gz JRGJDCALBQMGMB-APWZRJJASA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)NCC2=CC[N@@H+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000271869177 1434856039 /nfs/dbraw/zinc/85/60/39/1434856039.db2.gz JRGJDCALBQMGMB-APWZRJJASA-N 2 1 394.922 3.033 20 0 GGADMP C[C@H](NC(=O)NC1CC[NH+](CC2CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272207991 1434878127 /nfs/dbraw/zinc/87/81/27/1434878127.db2.gz PRRMXHIEDQYANJ-GHTZIAJQSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(-n2cnnn2)cc1 ZINC000272307449 1434885912 /nfs/dbraw/zinc/88/59/12/1434885912.db2.gz IBIIUPNVMYUCCE-BBTUJRGHSA-N 2 1 376.508 3.224 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]([NH+]2CCCCC2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272305633 1434885956 /nfs/dbraw/zinc/88/59/56/1434885956.db2.gz JTFAGWACWDNWID-ILWGZMRPSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H]([NH2+]C1CCN(C(=O)c2ccco2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272345897 1434889094 /nfs/dbraw/zinc/88/90/94/1434889094.db2.gz PTABIZQODKBOOA-UYAOXDASSA-N 2 1 381.520 3.384 20 0 GGADMP C[C@H]([NH2+]C1CCN(C(=O)c2ccco2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272345892 1434889196 /nfs/dbraw/zinc/88/91/96/1434889196.db2.gz PTABIZQODKBOOA-ICSRJNTNSA-N 2 1 381.520 3.384 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272375468 1434891466 /nfs/dbraw/zinc/89/14/66/1434891466.db2.gz HCXTZZJXJXDCRL-RXVVDRJESA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272375468 1434891468 /nfs/dbraw/zinc/89/14/68/1434891468.db2.gz HCXTZZJXJXDCRL-RXVVDRJESA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272375464 1434891524 /nfs/dbraw/zinc/89/15/24/1434891524.db2.gz HCXTZZJXJXDCRL-NQIIRXRSSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272375464 1434891526 /nfs/dbraw/zinc/89/15/26/1434891526.db2.gz HCXTZZJXJXDCRL-NQIIRXRSSA-N 2 1 383.540 3.182 20 0 GGADMP C[N@H+]1CC[C@@H]2CCN(C(=O)Nc3ccc(OCC[NH+]4CCCCC4)cc3)[C@H]2C1 ZINC000272449717 1434897150 /nfs/dbraw/zinc/89/71/50/1434897150.db2.gz PLOGFYPPXJBGNS-NQIIRXRSSA-N 2 1 386.540 3.109 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000272468120 1434898256 /nfs/dbraw/zinc/89/82/56/1434898256.db2.gz HYGUMRCJLBXPML-WSWWRLHASA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272468120 1434898257 /nfs/dbraw/zinc/89/82/57/1434898257.db2.gz HYGUMRCJLBXPML-WSWWRLHASA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272468120 1434898258 /nfs/dbraw/zinc/89/82/58/1434898258.db2.gz HYGUMRCJLBXPML-WSWWRLHASA-N 2 1 384.568 3.023 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H]2C[C@H](NC(=O)OC(C)(C)C)c3ccccc32)CC1 ZINC000272508452 1434901709 /nfs/dbraw/zinc/90/17/09/1434901709.db2.gz FWEYALOVFFIKFP-PMACEKPBSA-N 2 1 389.540 3.398 20 0 GGADMP COCC[C@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000272508005 1434901767 /nfs/dbraw/zinc/90/17/67/1434901767.db2.gz VOKJADPDHVNYIL-RXVVDRJESA-N 2 1 399.535 3.116 20 0 GGADMP FC(F)(F)CCN1CCC([NH2+]Cc2ccccc2C[NH+]2CCOCC2)CC1 ZINC000272638726 1434918584 /nfs/dbraw/zinc/91/85/84/1434918584.db2.gz CZCOLMNSVPAYFJ-UHFFFAOYSA-N 2 1 385.474 3.025 20 0 GGADMP C[C@H](NC(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)C1=CC[NH+](C)CC1 ZINC000272694794 1434923549 /nfs/dbraw/zinc/92/35/49/1434923549.db2.gz DDBRVKLDSIFPQD-LMVRJCEZSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](NC(=O)N[C@H]1[C@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)C1=CC[N@H+](C)CC1 ZINC000272694794 1434923552 /nfs/dbraw/zinc/92/35/52/1434923552.db2.gz DDBRVKLDSIFPQD-LMVRJCEZSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](NC(=O)N[C@H]1[C@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)C1=CC[N@@H+](C)CC1 ZINC000272694794 1434923554 /nfs/dbraw/zinc/92/35/54/1434923554.db2.gz DDBRVKLDSIFPQD-LMVRJCEZSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](NC(=O)NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)C1=CC[N@@H+](C)CC1 ZINC000272694792 1434923625 /nfs/dbraw/zinc/92/36/25/1434923625.db2.gz DDBRVKLDSIFPQD-FHWLQOOXSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](C[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)NC(=O)OC(C)(C)C ZINC000272711617 1434925138 /nfs/dbraw/zinc/92/51/38/1434925138.db2.gz BKACLGMSDYPASL-MBOZVWFJSA-N 2 1 391.556 3.035 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272846145 1434935634 /nfs/dbraw/zinc/93/56/34/1434935634.db2.gz SWOBNNIWAXVZIA-VQIMIIECSA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000272846145 1434935635 /nfs/dbraw/zinc/93/56/35/1434935635.db2.gz SWOBNNIWAXVZIA-VQIMIIECSA-N 2 1 396.539 3.028 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccsc1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000272889607 1434939040 /nfs/dbraw/zinc/93/90/40/1434939040.db2.gz YZWBOGPJGQKCOS-TXPKVOOTSA-N 2 1 378.586 3.303 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1)C1=CC[N@@H+](C)CC1 ZINC000272945894 1434943127 /nfs/dbraw/zinc/94/31/27/1434943127.db2.gz MJJRHMZHVPXUNE-MRXNPFEDSA-N 2 1 378.948 3.064 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1)C1=CC[N@@H+](C)CC1 ZINC000272945893 1434943152 /nfs/dbraw/zinc/94/31/52/1434943152.db2.gz MJJRHMZHVPXUNE-INIZCTEOSA-N 2 1 378.948 3.064 20 0 GGADMP CC[NH+](CC)CCN(Cc1cccs1)C(=O)N[C@H](C)C1=CC[N@@H+](C)CC1 ZINC000272956639 1434944041 /nfs/dbraw/zinc/94/40/41/1434944041.db2.gz NAYNMSLWAPELIG-QGZVFWFLSA-N 2 1 378.586 3.252 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1)C1=CC[NH+](C)CC1 ZINC000272963366 1434944763 /nfs/dbraw/zinc/94/47/63/1434944763.db2.gz NRGXXKXVEKXJSB-AJSBUHFISA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)C1=CC[N@H+](C)CC1 ZINC000272963366 1434944765 /nfs/dbraw/zinc/94/47/65/1434944765.db2.gz NRGXXKXVEKXJSB-AJSBUHFISA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)C1=CC[N@@H+](C)CC1 ZINC000272963366 1434944767 /nfs/dbraw/zinc/94/47/67/1434944767.db2.gz NRGXXKXVEKXJSB-AJSBUHFISA-N 2 1 396.579 3.333 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)N[C@@H](C)C1=CC[NH+](C)CC1 ZINC000272994102 1434947790 /nfs/dbraw/zinc/94/77/90/1434947790.db2.gz QKBKVZATCHXSDA-PZJWPPBQSA-N 2 1 384.568 3.190 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@@H](C)C1=CC[N@H+](C)CC1 ZINC000272994102 1434947793 /nfs/dbraw/zinc/94/77/93/1434947793.db2.gz QKBKVZATCHXSDA-PZJWPPBQSA-N 2 1 384.568 3.190 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000272994102 1434947795 /nfs/dbraw/zinc/94/77/95/1434947795.db2.gz QKBKVZATCHXSDA-PZJWPPBQSA-N 2 1 384.568 3.190 20 0 GGADMP C[C@@H](NC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)C1=CC[NH+](C)CC1 ZINC000273000289 1434948512 /nfs/dbraw/zinc/94/85/12/1434948512.db2.gz RDGMFJMIANUKDP-OXQOHEQNSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@@H](NC(=O)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)C1=CC[N@H+](C)CC1 ZINC000273000289 1434948515 /nfs/dbraw/zinc/94/85/15/1434948515.db2.gz RDGMFJMIANUKDP-OXQOHEQNSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@@H](NC(=O)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)C1=CC[N@@H+](C)CC1 ZINC000273000289 1434948517 /nfs/dbraw/zinc/94/85/17/1434948517.db2.gz RDGMFJMIANUKDP-OXQOHEQNSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@H](NC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)C1=CC[NH+](C)CC1 ZINC000273000286 1434948597 /nfs/dbraw/zinc/94/85/97/1434948597.db2.gz RDGMFJMIANUKDP-OXJNMPFZSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@H](NC(=O)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)C1=CC[N@H+](C)CC1 ZINC000273000286 1434948599 /nfs/dbraw/zinc/94/85/99/1434948599.db2.gz RDGMFJMIANUKDP-OXJNMPFZSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@H](NC(=O)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)C1=CC[N@@H+](C)CC1 ZINC000273000286 1434948602 /nfs/dbraw/zinc/94/86/02/1434948602.db2.gz RDGMFJMIANUKDP-OXJNMPFZSA-N 2 1 395.469 3.208 20 0 GGADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@H](Cc3ccc(F)cc3)C(N)=O)cc2)CC1 ZINC000273058299 1434955849 /nfs/dbraw/zinc/95/58/49/1434955849.db2.gz YDJFCWRJDJSIJU-JOCHJYFZSA-N 2 1 398.526 3.112 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)cc1F ZINC000273341159 1434982059 /nfs/dbraw/zinc/98/20/59/1434982059.db2.gz AKUCWHHWHQSVDB-OAHLLOKOSA-N 2 1 387.503 3.192 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCC[C@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000273368902 1434983864 /nfs/dbraw/zinc/98/38/64/1434983864.db2.gz FROOIUXNJQMSLJ-WOJBJXKFSA-N 2 1 375.538 3.265 20 0 GGADMP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000273423109 1434988085 /nfs/dbraw/zinc/98/80/85/1434988085.db2.gz SNZBZBPABSXKJI-QGZVFWFLSA-N 2 1 390.597 3.429 20 0 GGADMP COC(=O)CCCN1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000274215657 1435052117 /nfs/dbraw/zinc/05/21/17/1435052117.db2.gz OOWGXTIBQVSACN-UGKGYDQZSA-N 2 1 387.568 3.047 20 0 GGADMP COC(=O)CCCN1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000274215657 1435052122 /nfs/dbraw/zinc/05/21/22/1435052122.db2.gz OOWGXTIBQVSACN-UGKGYDQZSA-N 2 1 387.568 3.047 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749791 1435089593 /nfs/dbraw/zinc/08/95/93/1435089593.db2.gz HFIDUINYCHRGCW-QUURXOELSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CC[C@@H](O)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274749791 1435089595 /nfs/dbraw/zinc/08/95/95/1435089595.db2.gz HFIDUINYCHRGCW-QUURXOELSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CC[C@@H](O)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274749791 1435089597 /nfs/dbraw/zinc/08/95/97/1435089597.db2.gz HFIDUINYCHRGCW-QUURXOELSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749791 1435089600 /nfs/dbraw/zinc/08/96/00/1435089600.db2.gz HFIDUINYCHRGCW-QUURXOELSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[N@H+]1CC[C@@H](O)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749791 1435089601 /nfs/dbraw/zinc/08/96/01/1435089601.db2.gz HFIDUINYCHRGCW-QUURXOELSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[NH+]1CC[C@@H](O)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274749791 1435089604 /nfs/dbraw/zinc/08/96/04/1435089604.db2.gz HFIDUINYCHRGCW-QUURXOELSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[NH+]1CC[C@@H](O)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274749791 1435089606 /nfs/dbraw/zinc/08/96/06/1435089606.db2.gz HFIDUINYCHRGCW-QUURXOELSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749790 1435089668 /nfs/dbraw/zinc/08/96/68/1435089668.db2.gz HFIDUINYCHRGCW-OPHFCASCSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CC[C@H](O)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274749790 1435089671 /nfs/dbraw/zinc/08/96/71/1435089671.db2.gz HFIDUINYCHRGCW-OPHFCASCSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CC[C@H](O)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274749790 1435089673 /nfs/dbraw/zinc/08/96/73/1435089673.db2.gz HFIDUINYCHRGCW-OPHFCASCSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[N@@H+]1CC[C@H](O)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749790 1435089674 /nfs/dbraw/zinc/08/96/74/1435089674.db2.gz HFIDUINYCHRGCW-OPHFCASCSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[N@H+]1CC[C@H](O)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749790 1435089675 /nfs/dbraw/zinc/08/96/75/1435089675.db2.gz HFIDUINYCHRGCW-OPHFCASCSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[NH+]1CC[C@H](O)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274749790 1435089678 /nfs/dbraw/zinc/08/96/78/1435089678.db2.gz HFIDUINYCHRGCW-OPHFCASCSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[NH+]1CC[C@H](O)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274749790 1435089680 /nfs/dbraw/zinc/08/96/80/1435089680.db2.gz HFIDUINYCHRGCW-OPHFCASCSA-N 2 1 393.575 3.253 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NC[C@@H](C)c2ccccc2)[C@@H](C)C1 ZINC000274821174 1435095490 /nfs/dbraw/zinc/09/54/90/1435095490.db2.gz GXTBTBKFUKNMCY-DYQZNNLLSA-N 2 1 389.584 3.021 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NC[C@@H](C)c2ccccc2)[C@@H](C)C1 ZINC000274821174 1435095491 /nfs/dbraw/zinc/09/54/91/1435095491.db2.gz GXTBTBKFUKNMCY-DYQZNNLLSA-N 2 1 389.584 3.021 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCCc2nc(-c3ccccc3)no2)[C@H](C)C1 ZINC000274830421 1435096294 /nfs/dbraw/zinc/09/62/94/1435096294.db2.gz JKXQRXYUWTUIIH-QUCCMNQESA-N 2 1 386.540 3.396 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(Cl)cn1 ZINC000274878026 1435100516 /nfs/dbraw/zinc/10/05/16/1435100516.db2.gz GXTZNSLYAATXHX-YJBOKZPZSA-N 2 1 386.927 3.283 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(Cl)cn1 ZINC000274878026 1435100517 /nfs/dbraw/zinc/10/05/17/1435100517.db2.gz GXTZNSLYAATXHX-YJBOKZPZSA-N 2 1 386.927 3.283 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2c(Cl)cnn2C)cc1OC ZINC000275471616 1435141611 /nfs/dbraw/zinc/14/16/11/1435141611.db2.gz IWDVSIQWNCMEQN-UHFFFAOYSA-N 2 1 380.920 3.093 20 0 GGADMP Cn1ccnc1[C@H]1OCCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000275544326 1435147039 /nfs/dbraw/zinc/14/70/39/1435147039.db2.gz MXUHNAHKWHMOPB-SFTDATJTSA-N 2 1 386.515 3.076 20 0 GGADMP Cc1ccc([C@@H](CCn2cncn2)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000275665495 1435157883 /nfs/dbraw/zinc/15/78/83/1435157883.db2.gz BUUCGQFGDDSTSX-RZUBCFFCSA-N 2 1 385.556 3.197 20 0 GGADMP Cc1ccc([C@H](CCn2cncn2)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000275665504 1435158020 /nfs/dbraw/zinc/15/80/20/1435158020.db2.gz BUUCGQFGDDSTSX-VWPQPMDRSA-N 2 1 385.556 3.197 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1CC[NH+](C)C)[N@@H+]1CCc2sccc2C1 ZINC000275666504 1435158167 /nfs/dbraw/zinc/15/81/67/1435158167.db2.gz OMZCFWMVEWTHQP-INIZCTEOSA-N 2 1 386.565 3.421 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1CC[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000275666504 1435158168 /nfs/dbraw/zinc/15/81/68/1435158168.db2.gz OMZCFWMVEWTHQP-INIZCTEOSA-N 2 1 386.565 3.421 20 0 GGADMP C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]C[C@H]1CCc2[nH+]ccn2C1 ZINC000275723312 1435163003 /nfs/dbraw/zinc/16/30/03/1435163003.db2.gz ZEFWVEKHNROJFD-UONOGXRCSA-N 2 1 380.414 3.471 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)CC2)n[nH]1 ZINC000275928011 1435180302 /nfs/dbraw/zinc/18/03/02/1435180302.db2.gz QZZGRNXGGRNHJN-ILWGZMRPSA-N 2 1 379.552 3.187 20 0 GGADMP C[C@H](NC(=O)NCc1ccc(CC[NH+](C)C)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000276110571 1435191473 /nfs/dbraw/zinc/19/14/73/1435191473.db2.gz CZGXDEOEVPAUAL-GHTZIAJQSA-N 2 1 386.584 3.243 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N(CC)c2ccccc2)[C@H](C)C1 ZINC000276288441 1435202358 /nfs/dbraw/zinc/20/23/58/1435202358.db2.gz VEWMDPBOWWCEPK-SBHAEUEKSA-N 2 1 375.557 3.155 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N(CC)c2ccccc2)[C@H](C)C1 ZINC000276288441 1435202361 /nfs/dbraw/zinc/20/23/61/1435202361.db2.gz VEWMDPBOWWCEPK-SBHAEUEKSA-N 2 1 375.557 3.155 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N(CC)c2ccccc2)[C@H](C)C1 ZINC000276288436 1435202368 /nfs/dbraw/zinc/20/23/68/1435202368.db2.gz VEWMDPBOWWCEPK-DYXWJJEUSA-N 2 1 375.557 3.155 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N(CC)c2ccccc2)[C@H](C)C1 ZINC000276288436 1435202370 /nfs/dbraw/zinc/20/23/70/1435202370.db2.gz VEWMDPBOWWCEPK-DYXWJJEUSA-N 2 1 375.557 3.155 20 0 GGADMP O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc2c(c1)CC[NH2+]CC2 ZINC000276653288 1435222878 /nfs/dbraw/zinc/22/28/78/1435222878.db2.gz QCWNYSCPXJITQE-CWAQXLGLSA-N 2 1 389.543 3.300 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000276658643 1435223098 /nfs/dbraw/zinc/22/30/98/1435223098.db2.gz VPQGOWGAYKPNEF-KNQAVFIVSA-N 2 1 382.552 3.164 20 0 GGADMP C[C@H](c1nc(-c2ccc(N3CCC[N@@H+](C)CC3)nc2)no1)[NH+]1CCCCCC1 ZINC000276925868 1435243461 /nfs/dbraw/zinc/24/34/61/1435243461.db2.gz NGZDWMBVODQFOU-QGZVFWFLSA-N 2 1 384.528 3.211 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[NH+]2CCC[C@H]2C(N)=O)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000276932069 1435244459 /nfs/dbraw/zinc/24/44/59/1435244459.db2.gz OIKMEQCYCREVPC-RCJHGTSTSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[NH+]2CCC[C@H]2C(N)=O)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276932069 1435244462 /nfs/dbraw/zinc/24/44/62/1435244462.db2.gz OIKMEQCYCREVPC-RCJHGTSTSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[N@@H+]2CCC[C@H]2C(N)=O)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276932069 1435244464 /nfs/dbraw/zinc/24/44/64/1435244464.db2.gz OIKMEQCYCREVPC-RCJHGTSTSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[N@H+]2CCC[C@H]2C(N)=O)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276932069 1435244466 /nfs/dbraw/zinc/24/44/66/1435244466.db2.gz OIKMEQCYCREVPC-RCJHGTSTSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@@H](c1nc(-c2ccc(N3CCC[NH+](C)CC3)nc2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276981623 1435249388 /nfs/dbraw/zinc/24/93/88/1435249388.db2.gz WBQXWBMHBQYGFU-BBWFWOEESA-N 2 1 384.528 3.207 20 0 GGADMP C[C@@H](c1nc(-c2ccc(N3CCC[N@H+](C)CC3)nc2)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276981623 1435249390 /nfs/dbraw/zinc/24/93/90/1435249390.db2.gz WBQXWBMHBQYGFU-BBWFWOEESA-N 2 1 384.528 3.207 20 0 GGADMP C[C@@H](c1nc(-c2ccc(N3CCC[N@@H+](C)CC3)nc2)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276981623 1435249393 /nfs/dbraw/zinc/24/93/93/1435249393.db2.gz WBQXWBMHBQYGFU-BBWFWOEESA-N 2 1 384.528 3.207 20 0 GGADMP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C4CCN(c5cccnn5)CC4)[C@@H]3C2)cc1 ZINC000277032555 1435254291 /nfs/dbraw/zinc/25/42/91/1435254291.db2.gz FKSKHDDEQRLMQU-WWNPGLIZSA-N 2 1 391.563 3.336 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)NCCc1nc2ccccc2s1 ZINC000277052890 1435256774 /nfs/dbraw/zinc/25/67/74/1435256774.db2.gz COGUYCWQFGJXPK-UHFFFAOYSA-N 2 1 399.564 3.126 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)NCCc1nc2ccccc2s1 ZINC000277052890 1435256778 /nfs/dbraw/zinc/25/67/78/1435256778.db2.gz COGUYCWQFGJXPK-UHFFFAOYSA-N 2 1 399.564 3.126 20 0 GGADMP CCCn1ccnc1CCC[N@@H+](C)CCCS(=O)(=O)c1ccccc1OC ZINC000277056026 1435257179 /nfs/dbraw/zinc/25/71/79/1435257179.db2.gz IZLDEBWTKPMFNF-UHFFFAOYSA-N 2 1 393.553 3.030 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000277331764 1435294863 /nfs/dbraw/zinc/29/48/63/1435294863.db2.gz VPMIIZYRXUUATJ-LJQANCHMSA-N 2 1 383.540 3.234 20 0 GGADMP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nncn1-c1ccccc1 ZINC000277603800 1435315808 /nfs/dbraw/zinc/31/58/08/1435315808.db2.gz FGPRYFPZDBDJLO-UHFFFAOYSA-N 2 1 376.508 3.401 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nncn1-c1ccccc1 ZINC000277603800 1435315810 /nfs/dbraw/zinc/31/58/10/1435315810.db2.gz FGPRYFPZDBDJLO-UHFFFAOYSA-N 2 1 376.508 3.401 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NCc2cccc(C[NH+](C)C)c2)CC1 ZINC000277860922 1435337035 /nfs/dbraw/zinc/33/70/35/1435337035.db2.gz AYSSNNIMIURXSJ-UHFFFAOYSA-N 2 1 382.508 3.205 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NCCCC[NH+]2CCC(C)CC2)CC1 ZINC000278015947 1435350498 /nfs/dbraw/zinc/35/04/98/1435350498.db2.gz PPYWHFDWRGHUAU-UHFFFAOYSA-N 2 1 388.556 3.455 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000278082080 1435357346 /nfs/dbraw/zinc/35/73/46/1435357346.db2.gz PEKPYXOYFZURCZ-RXVVDRJESA-N 2 1 384.568 3.213 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC1CC[NH+](C2CC2)CC1 ZINC000278251438 1435373484 /nfs/dbraw/zinc/37/34/84/1435373484.db2.gz VYXGONCBAHTBFL-NRFANRHFSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(OCc2nccn2C)cc1 ZINC000278363135 1435384051 /nfs/dbraw/zinc/38/40/51/1435384051.db2.gz BMDUAHMERJCHLX-RTBURBONSA-N 2 1 386.540 3.151 20 0 GGADMP Cn1nccc1N1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000278506203 1435395760 /nfs/dbraw/zinc/39/57/60/1435395760.db2.gz QXSGYZRRQOKWSR-KJJMTIBFSA-N 2 1 379.552 3.174 20 0 GGADMP O=C1O[C@@H](C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)CN1c1ccccc1 ZINC000278792919 1435424173 /nfs/dbraw/zinc/42/41/73/1435424173.db2.gz FCKBEPVIZVZNON-FQEVSTJZSA-N 2 1 380.492 3.424 20 0 GGADMP C[C@@H](C(=O)N(C)Cc1ccccc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278822736 1435427289 /nfs/dbraw/zinc/42/72/89/1435427289.db2.gz HPOWNISSMCSORZ-SFHVURJKSA-N 2 1 380.536 3.446 20 0 GGADMP CCC[NH+](CC)Cc1ccc(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)cc1 ZINC000278909717 1435438429 /nfs/dbraw/zinc/43/84/29/1435438429.db2.gz SRUXBLSLKGRYNK-IBGZPJMESA-N 2 1 387.568 3.244 20 0 GGADMP CCC[NH+](CC)Cc1ccc(C(=O)N2CC[N@H+](C3CCOCC3)C[C@@H]2C)cc1 ZINC000278909717 1435438432 /nfs/dbraw/zinc/43/84/32/1435438432.db2.gz SRUXBLSLKGRYNK-IBGZPJMESA-N 2 1 387.568 3.244 20 0 GGADMP O[C@@H](COc1cccc2[nH]ccc21)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278933206 1435441809 /nfs/dbraw/zinc/44/18/09/1435441809.db2.gz SWOGXTAERGHMPE-LJQANCHMSA-N 2 1 394.519 3.320 20 0 GGADMP COc1ccc(NC(=O)CC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000278956908 1435445254 /nfs/dbraw/zinc/44/52/54/1435445254.db2.gz WLHRLZWKDWQTNX-UHFFFAOYSA-N 2 1 382.508 3.436 20 0 GGADMP Nc1ccc(F)c(NC(=O)CC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000278966893 1435446603 /nfs/dbraw/zinc/44/66/03/1435446603.db2.gz XJNNIEZEUCKXAV-UHFFFAOYSA-N 2 1 385.487 3.149 20 0 GGADMP O=C(CCc1ncc[nH]1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000279106130 1435460965 /nfs/dbraw/zinc/46/09/65/1435460965.db2.gz BGLNWWSLECKFLK-UHFFFAOYSA-N 2 1 380.414 3.096 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](C[C@@H](O)Cc2ccc3ccccc3c2)CC1 ZINC000279705289 1435532300 /nfs/dbraw/zinc/53/23/00/1435532300.db2.gz KEVRMIDLPAPNQS-BKSPAHHJSA-N 2 1 395.591 3.234 20 0 GGADMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccnn1-c1ccc(F)cc1 ZINC000279776140 1435541587 /nfs/dbraw/zinc/54/15/87/1435541587.db2.gz AORSROGKKNRGBZ-QHCPKHFHSA-N 2 1 394.494 3.258 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)[C@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000279907305 1435561449 /nfs/dbraw/zinc/56/14/49/1435561449.db2.gz LPLKNVOKYAYWTA-RBUKOAKNSA-N 2 1 377.573 3.203 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3ccnn3-c3ccc(F)cc3)CC2)nc(C)[nH+]1 ZINC000280440626 1435661357 /nfs/dbraw/zinc/66/13/57/1435661357.db2.gz YDGVNKCFUAUXFR-UHFFFAOYSA-N 2 1 380.471 3.177 20 0 GGADMP CO[C@@]1(C)CCC[N@H+]([C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000280510824 1435671693 /nfs/dbraw/zinc/67/16/93/1435671693.db2.gz NNWGUUQBMZMQCT-CVDCTZTESA-N 2 1 387.568 3.047 20 0 GGADMP CC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280810911 1435724347 /nfs/dbraw/zinc/72/43/47/1435724347.db2.gz JFAZNHIUNCWOFG-SFHVURJKSA-N 2 1 399.988 3.163 20 0 GGADMP CN(CCC[NH+]1CCCC1)C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000280898221 1435738319 /nfs/dbraw/zinc/73/83/19/1435738319.db2.gz BHJNIICYDJVCCN-UHFFFAOYSA-N 2 1 394.510 3.057 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H](c3cccnc3)C3CCC3)c2)C1 ZINC000280923685 1435742387 /nfs/dbraw/zinc/74/23/87/1435742387.db2.gz RFTQNJXVYLGTLR-GOTSBHOMSA-N 2 1 392.547 3.410 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H](c3cncc(F)c3)C3CC3)c2)C1 ZINC000281172535 1435789051 /nfs/dbraw/zinc/78/90/51/1435789051.db2.gz HYZKTSQETQFGID-SIKLNZKXSA-N 2 1 396.510 3.159 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H]2CCC[N@@H+]2C2CCCCC2)cn1 ZINC000281390383 1435806810 /nfs/dbraw/zinc/80/68/10/1435806810.db2.gz GRQWIJORAAHZSQ-HXUWFJFHSA-N 2 1 396.539 3.172 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)cn1 ZINC000281390383 1435806811 /nfs/dbraw/zinc/80/68/11/1435806811.db2.gz GRQWIJORAAHZSQ-HXUWFJFHSA-N 2 1 396.539 3.172 20 0 GGADMP [NH3+]CC[C@@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000281611038 1435815559 /nfs/dbraw/zinc/81/55/59/1435815559.db2.gz BFFJHSUGVAMFHP-PKOBYXMFSA-N 2 1 383.458 3.028 20 0 GGADMP COc1ccccc1-n1nccc1C[NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000281748121 1435820509 /nfs/dbraw/zinc/82/05/09/1435820509.db2.gz RWKYHIWKAFFSBK-UHFFFAOYSA-N 2 1 392.507 3.046 20 0 GGADMP Cn1cc(-c2ccc(C[NH2+]Cc3ccccc3C[N@H+]3CCC[C@H]3CO)s2)cn1 ZINC000282156131 1435836665 /nfs/dbraw/zinc/83/66/65/1435836665.db2.gz CJVAJDMQVBCFQK-FQEVSTJZSA-N 2 1 396.560 3.395 20 0 GGADMP Cn1cc(-c2ccc(C[NH2+]Cc3ccccc3C[N@H+]3CC[C@@H](O)C3)s2)cn1 ZINC000282270964 1435841137 /nfs/dbraw/zinc/84/11/37/1435841137.db2.gz OQNNVAHKLPDZGA-LJQANCHMSA-N 2 1 382.533 3.005 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000282402234 1435845947 /nfs/dbraw/zinc/84/59/47/1435845947.db2.gz FIIFSWZVHVOZMK-HSZRJFAPSA-N 3 1 386.628 3.293 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000282402234 1435845948 /nfs/dbraw/zinc/84/59/48/1435845948.db2.gz FIIFSWZVHVOZMK-HSZRJFAPSA-N 3 1 386.628 3.293 20 0 GGADMP Cc1cc([C@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)nn1C ZINC000282437000 1435847155 /nfs/dbraw/zinc/84/71/55/1435847155.db2.gz ZFRFUDHAODYHDU-SFHVURJKSA-N 2 1 386.540 3.069 20 0 GGADMP Cc1cc([C@H](C)[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)nn1C ZINC000282437000 1435847156 /nfs/dbraw/zinc/84/71/56/1435847156.db2.gz ZFRFUDHAODYHDU-SFHVURJKSA-N 2 1 386.540 3.069 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000282479436 1435848664 /nfs/dbraw/zinc/84/86/64/1435848664.db2.gz QCADLXFGFBSUTL-FQEVSTJZSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282479436 1435848665 /nfs/dbraw/zinc/84/86/65/1435848665.db2.gz QCADLXFGFBSUTL-FQEVSTJZSA-N 2 1 383.540 3.182 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH2+]C2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1 ZINC000283248542 1435881194 /nfs/dbraw/zinc/88/11/94/1435881194.db2.gz JSPWOJNINZTCSZ-VXKWHMMOSA-N 2 1 386.628 3.149 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 ZINC000283320074 1435884265 /nfs/dbraw/zinc/88/42/65/1435884265.db2.gz OQRBHNNLEYGGCX-FGZHOGPDSA-N 2 1 377.548 3.394 20 0 GGADMP O=C1CCCCN1CC1CCN(C[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)CC1 ZINC000283915987 1435951848 /nfs/dbraw/zinc/95/18/48/1435951848.db2.gz CBQPKGMPXPIEEE-HSZRJFAPSA-N 2 1 399.579 3.002 20 0 GGADMP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H](C(=O)NC3CC3)c3ccccc3)cc2)CC1 ZINC000283924348 1435954506 /nfs/dbraw/zinc/95/45/06/1435954506.db2.gz DWHDSZBBVHUGNF-HSZRJFAPSA-N 2 1 393.531 3.269 20 0 GGADMP c1ccc(C[N@H+]2CCCO[C@H](CN3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)C2)cc1 ZINC000284104631 1435991031 /nfs/dbraw/zinc/99/10/31/1435991031.db2.gz MSIQCXNVTXSKLY-OEMFJLHTSA-N 2 1 383.580 3.226 20 0 GGADMP c1csc(CC[NH+]2CCN(C[C@@H]3C[N@@H+](Cc4ccccc4)CCCO3)CC2)c1 ZINC000284139324 1435997563 /nfs/dbraw/zinc/99/75/63/1435997563.db2.gz OSUWOSBBWMRSAG-JOCHJYFZSA-N 2 1 399.604 3.199 20 0 GGADMP c1ccc(C[N@@H+]2CCc3c(ncnc3N3CCC4(CCCC[NH2+]4)CC3)C2)cc1 ZINC001164388129 718802938 /nfs/dbraw/zinc/80/29/38/718802938.db2.gz UIKYGZXRNNQYQO-UHFFFAOYSA-N 2 1 377.536 3.147 20 0 GGADMP c1ccc(C[N@H+]2CCc3c(ncnc3N3CCC4(CCCC[NH2+]4)CC3)C2)cc1 ZINC001164388129 718802939 /nfs/dbraw/zinc/80/29/39/718802939.db2.gz UIKYGZXRNNQYQO-UHFFFAOYSA-N 2 1 377.536 3.147 20 0 GGADMP CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2CCC(F)(C[NH3+])CC2)n1 ZINC001164386830 718813437 /nfs/dbraw/zinc/81/34/37/718813437.db2.gz ATLWLPWCPAJHFD-UHFFFAOYSA-N 2 1 379.549 3.417 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@H]4[NH2+]CC[C@H]42)n1)CCC3)[NH+]1CCCCC1 ZINC001164411097 718875881 /nfs/dbraw/zinc/87/58/81/718875881.db2.gz MKBWJHNODLPHBN-HZPDHXFCSA-N 2 1 383.565 3.107 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@H]4[NH2+]CC[C@@H]42)n1)CCCC3)[NH+]1CCCC1 ZINC001164412817 718876082 /nfs/dbraw/zinc/87/60/82/718876082.db2.gz ZSFUZWRSXZDVOD-CVEARBPZSA-N 2 1 383.565 3.107 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CC[C@@H]5[NH2+]CC[C@@H]54)c23)C1 ZINC001164412794 718876244 /nfs/dbraw/zinc/87/62/44/718876244.db2.gz ZFGJHHATWNICON-PVAVHDDUSA-N 2 1 397.592 3.353 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CC[C@H]3[NH2+]CC[C@H]32)n1 ZINC001164411749 718876583 /nfs/dbraw/zinc/87/65/83/718876583.db2.gz RZISNGYJPGJGDZ-IAGOWNOFSA-N 2 1 379.533 3.361 20 0 GGADMP Cc1nc2c(n1-c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)CC[NH2+]CC2 ZINC001164430786 718949822 /nfs/dbraw/zinc/94/98/22/718949822.db2.gz YIZRHEZRZVZPSE-UHFFFAOYSA-N 2 1 396.564 3.086 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@@H]4[NH2+]C[C@@H]42)n1)CCC3)[NH+]1CCCCC1 ZINC001164448427 718999656 /nfs/dbraw/zinc/99/96/56/718999656.db2.gz IBYJTXTZQQFBRE-HOTGVXAUSA-N 2 1 383.565 3.107 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CCC[C@H]5[NH2+]C[C@H]53)n2)CCC4)CC1 ZINC001164448730 719000470 /nfs/dbraw/zinc/00/04/70/719000470.db2.gz IXZJRVUGWREGDU-IAGOWNOFSA-N 2 1 397.592 3.353 20 0 GGADMP CCOC(=O)C1CC[NH+](C2CCN(c3cc4cc(OC)ccc4c[nH+]3)CC2)CC1 ZINC001164618391 719030265 /nfs/dbraw/zinc/03/02/65/719030265.db2.gz VVECOCLBJWASOK-UHFFFAOYSA-N 2 1 397.519 3.487 20 0 GGADMP c1ccc(C[N@@H+]2C[C@H]3[C@H](C2)CCCN3c2nccc(C3CC[NH2+]CC3)n2)cc1 ZINC001164628800 719088840 /nfs/dbraw/zinc/08/88/40/719088840.db2.gz OIPOAXXVQQFWJO-UNMCSNQZSA-N 2 1 377.536 3.044 20 0 GGADMP [NH3+]C1CCN(c2cccc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)n2)CC1 ZINC001164626715 719091848 /nfs/dbraw/zinc/09/18/48/719091848.db2.gz IOKXGACRBQYETL-RBBKRZOGSA-N 2 1 391.563 3.110 20 0 GGADMP [NH3+]C1([C@@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]2CF)CC1 ZINC001164627454 719117206 /nfs/dbraw/zinc/11/72/06/719117206.db2.gz KMDOKBICULVFII-VQTJNVASSA-N 2 1 380.511 3.153 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nc(Cl)nc3ccc(F)cc32)c2c1CC[NH2+]C2 ZINC001164683969 719606754 /nfs/dbraw/zinc/60/67/54/719606754.db2.gz LTLOYTCEIKUJMN-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nc(Cl)nc3ccc(F)cc32)c2c1CC[NH2+]C2 ZINC001164683969 719606763 /nfs/dbraw/zinc/60/67/63/719606763.db2.gz LTLOYTCEIKUJMN-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)Oc2cccc(Cl)n2)c2c1CC[NH2+]C2 ZINC001164682285 719615928 /nfs/dbraw/zinc/61/59/28/719615928.db2.gz CDHNVQQVMJUSMU-UHFFFAOYSA-N 2 1 385.846 3.003 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)Oc2cccc(Cl)n2)c2c1CC[NH2+]C2 ZINC001164682285 719615935 /nfs/dbraw/zinc/61/59/35/719615935.db2.gz CDHNVQQVMJUSMU-UHFFFAOYSA-N 2 1 385.846 3.003 20 0 GGADMP Cc1ccc2nc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)c(Cl)nc2c1 ZINC001164684832 719618492 /nfs/dbraw/zinc/61/84/92/719618492.db2.gz XZMGJFVBHDGRHF-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1ccc2nc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)c(Cl)nc2c1 ZINC001164684832 719618496 /nfs/dbraw/zinc/61/84/96/719618496.db2.gz XZMGJFVBHDGRHF-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1ccc2c(c1)nc(Cl)nc2-n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164682876 719622629 /nfs/dbraw/zinc/62/26/29/719622629.db2.gz PLNBBVBPKDQNMR-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1ccc2c(c1)nc(Cl)nc2-n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164682876 719622636 /nfs/dbraw/zinc/62/26/36/719622636.db2.gz PLNBBVBPKDQNMR-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP CSc1nc2ccccc2c(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164682050 719624805 /nfs/dbraw/zinc/62/48/05/719624805.db2.gz LLFIERVKBCNFGR-UHFFFAOYSA-N 2 1 382.537 3.023 20 0 GGADMP CSc1nc2ccccc2c(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164682050 719624817 /nfs/dbraw/zinc/62/48/17/719624817.db2.gz LLFIERVKBCNFGR-UHFFFAOYSA-N 2 1 382.537 3.023 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2cccc(OCc3ccccc3)n2)c2c1CC[NH2+]C2 ZINC001164683148 719632544 /nfs/dbraw/zinc/63/25/44/719632544.db2.gz QZBJJLQVGDNQNY-UHFFFAOYSA-N 2 1 391.519 3.332 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2cccc(OCc3ccccc3)n2)c2c1CC[NH2+]C2 ZINC001164683148 719632552 /nfs/dbraw/zinc/63/25/52/719632552.db2.gz QZBJJLQVGDNQNY-UHFFFAOYSA-N 2 1 391.519 3.332 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nc(Cl)cc(C(C)(C)C)n2)c2c1CC[NH2+]C2 ZINC001164680592 719634929 /nfs/dbraw/zinc/63/49/29/719634929.db2.gz XMBYQDLIZHSUJH-UHFFFAOYSA-N 2 1 376.936 3.099 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nc(Cl)cc(C(C)(C)C)n2)c2c1CC[NH2+]C2 ZINC001164680592 719634934 /nfs/dbraw/zinc/63/49/34/719634934.db2.gz XMBYQDLIZHSUJH-UHFFFAOYSA-N 2 1 376.936 3.099 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2ncc(Cl)nc2-c2ccccc2)c2c1CC[NH2+]C2 ZINC001164679739 719642653 /nfs/dbraw/zinc/64/26/53/719642653.db2.gz LETHACFUUDNIGP-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2ncc(Cl)nc2-c2ccccc2)c2c1CC[NH2+]C2 ZINC001164679739 719642654 /nfs/dbraw/zinc/64/26/54/719642654.db2.gz LETHACFUUDNIGP-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2cc(-c3cccc(Cl)c3)ncn2)c2c1CC[NH2+]C2 ZINC001164679546 719643395 /nfs/dbraw/zinc/64/33/95/719643395.db2.gz GDCXGQMFYQUZLL-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2cc(-c3cccc(Cl)c3)ncn2)c2c1CC[NH2+]C2 ZINC001164679546 719643397 /nfs/dbraw/zinc/64/33/97/719643397.db2.gz GDCXGQMFYQUZLL-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP Cc1c(Cl)nc(CC(C)C)nc1-n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164679447 719649733 /nfs/dbraw/zinc/64/97/33/719649733.db2.gz AQQLBYCPQMYBKW-UHFFFAOYSA-N 2 1 390.963 3.309 20 0 GGADMP Cc1c(Cl)nc(CC(C)C)nc1-n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164679447 719649737 /nfs/dbraw/zinc/64/97/37/719649737.db2.gz AQQLBYCPQMYBKW-UHFFFAOYSA-N 2 1 390.963 3.309 20 0 GGADMP CC[C@@H](C)c1nc2[nH]ccc2c(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164681000 719653988 /nfs/dbraw/zinc/65/39/88/719653988.db2.gz LAMSGUPAKHXDAL-CQSZACIVSA-N 2 1 381.528 3.143 20 0 GGADMP CC[C@@H](C)c1nc2[nH]ccc2c(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164681000 719653993 /nfs/dbraw/zinc/65/39/93/719653993.db2.gz LAMSGUPAKHXDAL-CQSZACIVSA-N 2 1 381.528 3.143 20 0 GGADMP Cc1nc(C[N@H+]2CCCC23CCN(c2ccc4c(n2)CC[NH2+]C4)CC3)cs1 ZINC001164690828 719804768 /nfs/dbraw/zinc/80/47/68/719804768.db2.gz AMSNLKWDCIQGDG-UHFFFAOYSA-N 2 1 383.565 3.127 20 0 GGADMP COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1[nH+]ccc3[nH]ccc31)CC2 ZINC001164712713 720098347 /nfs/dbraw/zinc/09/83/47/720098347.db2.gz YLJQYUAMYBGTQR-LJQANCHMSA-N 2 1 391.519 3.465 20 0 GGADMP COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cccc(N(C)C)[nH+]1)CC2 ZINC001164711055 720099788 /nfs/dbraw/zinc/09/97/88/720099788.db2.gz NPRWTUXWNQDJLU-HXUWFJFHSA-N 2 1 395.551 3.050 20 0 GGADMP COC[C@@H]1CC2(C[N@@H+]1Cc1ccccn1)CCN(c1ccc3c([nH+]1)CCC3)CC2 ZINC001164714821 720112487 /nfs/dbraw/zinc/11/24/87/720112487.db2.gz CFCGNFQAQQEYRP-NRFANRHFSA-N 2 1 392.547 3.473 20 0 GGADMP COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc3c([nH+]1)CCC3)CC2 ZINC001164714821 720112496 /nfs/dbraw/zinc/11/24/96/720112496.db2.gz CFCGNFQAQQEYRP-NRFANRHFSA-N 2 1 392.547 3.473 20 0 GGADMP CCc1cc(N2CCC3(C[C@H](COC)[N@H+](Cc4ccccn4)C3)CC2)nc(C)[nH+]1 ZINC001164710857 720128655 /nfs/dbraw/zinc/12/86/55/720128655.db2.gz DXJDLEOLSVENAH-OAQYLSRUSA-N 2 1 395.551 3.250 20 0 GGADMP CCc1cc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nc(C)[nH+]1 ZINC001164710857 720128661 /nfs/dbraw/zinc/12/86/61/720128661.db2.gz DXJDLEOLSVENAH-OAQYLSRUSA-N 2 1 395.551 3.250 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3nccn3C[C@H](C[NH+](C)C)C2)nc1 ZINC001164735013 720532235 /nfs/dbraw/zinc/53/22/35/720532235.db2.gz MPBGMTOURNUCEH-PZJWPPBQSA-N 2 1 396.583 3.413 20 0 GGADMP CC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3nccn3C[C@@H](C[NH+](C)C)C2)nc1 ZINC001164736053 720532540 /nfs/dbraw/zinc/53/25/40/720532540.db2.gz UVYYNHPNKORRDZ-QUCCMNQESA-N 2 1 382.556 3.023 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3nccn3C[C@@H](C[NH+](C)C)C2)nc1 ZINC001164736054 720532724 /nfs/dbraw/zinc/53/27/24/720532724.db2.gz UVYYNHPNKORRDZ-UYAOXDASSA-N 2 1 382.556 3.023 20 0 GGADMP Cc1cc2[nH]ccc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)[nH+]1 ZINC001164835516 720556105 /nfs/dbraw/zinc/55/61/05/720556105.db2.gz HQRIIIUGGKJJHI-BBTUJRGHSA-N 2 1 378.524 3.446 20 0 GGADMP Cc1[nH+]c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)cc2[nH]ccc21 ZINC001164841285 720587129 /nfs/dbraw/zinc/58/71/29/720587129.db2.gz RUKQFHGEMVMUAD-WAOWUJCRSA-N 2 1 378.524 3.446 20 0 GGADMP CCN(C)c1cc[nH+]c(N2CCC3(C[C@H]([N@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164839858 720654769 /nfs/dbraw/zinc/65/47/69/720654769.db2.gz KLQHJYKSEUZZAI-FQEVSTJZSA-N 2 1 395.551 3.193 20 0 GGADMP CCN(C)c1cc[nH+]c(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164839858 720654777 /nfs/dbraw/zinc/65/47/77/720654777.db2.gz KLQHJYKSEUZZAI-FQEVSTJZSA-N 2 1 395.551 3.193 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC2(C[C@@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164843227 720670800 /nfs/dbraw/zinc/67/08/00/720670800.db2.gz VPNMVMJAMDVYIA-LJQANCHMSA-N 2 1 391.519 3.228 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164843227 720670816 /nfs/dbraw/zinc/67/08/16/720670816.db2.gz VPNMVMJAMDVYIA-LJQANCHMSA-N 2 1 391.519 3.228 20 0 GGADMP COCC[N@@H+]1CCO[C@@H]2CN(c3cc(C)c4ccc(C)c(C)c4[nH+]3)CC[C@@H]2C1 ZINC001164853834 720878448 /nfs/dbraw/zinc/87/84/48/720878448.db2.gz CXGYQSLMEZJRQZ-TZIWHRDSSA-N 2 1 383.536 3.334 20 0 GGADMP COCC[N@H+]1CCO[C@@H]2CN(c3cc(C)c4ccc(C)c(C)c4[nH+]3)CC[C@@H]2C1 ZINC001164853834 720878449 /nfs/dbraw/zinc/87/84/49/720878449.db2.gz CXGYQSLMEZJRQZ-TZIWHRDSSA-N 2 1 383.536 3.334 20 0 GGADMP COCC[N@@H+]1CCO[C@H]2CN(c3cc(C)c4ccc(C)c(C)c4[nH+]3)CC[C@@H]2C1 ZINC001164853819 720878647 /nfs/dbraw/zinc/87/86/47/720878647.db2.gz CXGYQSLMEZJRQZ-CTNGQTDRSA-N 2 1 383.536 3.334 20 0 GGADMP COCC[N@H+]1CCO[C@H]2CN(c3cc(C)c4ccc(C)c(C)c4[nH+]3)CC[C@@H]2C1 ZINC001164853819 720878649 /nfs/dbraw/zinc/87/86/49/720878649.db2.gz CXGYQSLMEZJRQZ-CTNGQTDRSA-N 2 1 383.536 3.334 20 0 GGADMP Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(C)c(C)c[nH+]3)C2)C1 ZINC001164783078 721369172 /nfs/dbraw/zinc/36/91/72/721369172.db2.gz PECYRJKEFNAFCO-JOCHJYFZSA-N 2 1 384.524 3.422 20 0 GGADMP C[N@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(NC3CC3)cc[nH+]1)CC2 ZINC001164792804 721489437 /nfs/dbraw/zinc/48/94/37/721489437.db2.gz MFNHGKGRFJPRIB-UHFFFAOYSA-N 2 1 378.524 3.327 20 0 GGADMP C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(NC3CC3)cc[nH+]1)CC2 ZINC001164792804 721489445 /nfs/dbraw/zinc/48/94/45/721489445.db2.gz MFNHGKGRFJPRIB-UHFFFAOYSA-N 2 1 378.524 3.327 20 0 GGADMP Cc1nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)cc(N(C)C)[nH+]1 ZINC001164792742 721490624 /nfs/dbraw/zinc/49/06/24/721490624.db2.gz LFKLOVXNRNMIBC-UHFFFAOYSA-N 2 1 380.540 3.127 20 0 GGADMP Cc1nc(N(C)C)cc(N2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)[nH+]1 ZINC001164792742 721490628 /nfs/dbraw/zinc/49/06/28/721490628.db2.gz LFKLOVXNRNMIBC-UHFFFAOYSA-N 2 1 380.540 3.127 20 0 GGADMP Cc1nc(N(C)C)cc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)[nH+]1 ZINC001164792742 721490630 /nfs/dbraw/zinc/49/06/30/721490630.db2.gz LFKLOVXNRNMIBC-UHFFFAOYSA-N 2 1 380.540 3.127 20 0 GGADMP Cc1cc2[nH]ccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)[nH+]1 ZINC001164806719 721560262 /nfs/dbraw/zinc/56/02/62/721560262.db2.gz RFZJRMJEWNNNSS-HKBOAZHASA-N 2 1 377.492 3.135 20 0 GGADMP Fc1cccc(O[C@H]2C[C@@H]3CN(c4ncccc4C[NH+]4CCCC4)CC[N@H+]3C2)c1 ZINC001164906425 721565664 /nfs/dbraw/zinc/56/56/64/721565664.db2.gz IZZBNKQOBLGPQE-IRLDBZIGSA-N 2 1 396.510 3.158 20 0 GGADMP Cc1[nH+]c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)cc2[nH]ccc21 ZINC001164805377 721572301 /nfs/dbraw/zinc/57/23/01/721572301.db2.gz NDKGDDVXSYNOCU-JAXLGGSGSA-N 2 1 377.492 3.135 20 0 GGADMP CN(C)c1cc[nH+]c(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164906707 721703021 /nfs/dbraw/zinc/70/30/21/721703021.db2.gz PDZIVNWDMFJYQS-FQEVSTJZSA-N 2 1 387.478 3.280 20 0 GGADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(NC4CC4)cc[nH+]3)C[C@H]21 ZINC001165028007 721797793 /nfs/dbraw/zinc/79/77/93/721797793.db2.gz XVNOMXKFNOLLTE-NSISKUIASA-N 2 1 378.524 3.183 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(NC4CC4)cc[nH+]3)C[C@H]21 ZINC001165028007 721797796 /nfs/dbraw/zinc/79/77/96/721797796.db2.gz XVNOMXKFNOLLTE-NSISKUIASA-N 2 1 378.524 3.183 20 0 GGADMP CCN(C)c1cc(C)[nH+]c(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165020420 721798119 /nfs/dbraw/zinc/79/81/19/721798119.db2.gz FRPKDGPQBVYFMU-JBACZVJFSA-N 2 1 394.567 3.373 20 0 GGADMP C[NH+](C)Cc1ccnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1 ZINC001165027568 721827409 /nfs/dbraw/zinc/82/74/09/721827409.db2.gz SQTJEPJGKZLPJF-NNWRFLSQSA-N 2 1 379.552 3.275 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cc(-n4ccnc4)cc[nH+]3)C[C@H]21 ZINC001165030229 721828028 /nfs/dbraw/zinc/82/80/28/721828028.db2.gz ZCABJOJTVPAOFL-STZQEDGTSA-N 2 1 388.519 3.399 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cc(-n4ccnc4)cc[nH+]3)C[C@@H]21 ZINC001165030457 721828152 /nfs/dbraw/zinc/82/81/52/721828152.db2.gz ZCABJOJTVPAOFL-YUXAGFNASA-N 2 1 388.519 3.399 20 0 GGADMP CC[NH+](CC)C1CCN(c2nc(N(C)Cc3ccc(OC)cc3)cc[nH+]2)CC1 ZINC001165054478 722007128 /nfs/dbraw/zinc/00/71/28/722007128.db2.gz NOROYAJIRAVYER-UHFFFAOYSA-N 2 1 383.540 3.432 20 0 GGADMP CCN(C)c1cc(C)[nH+]c(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164954055 722012320 /nfs/dbraw/zinc/01/23/20/722012320.db2.gz HUMMQQWNQBZBOD-UHFFFAOYSA-N 2 1 380.540 3.129 20 0 GGADMP c1cc(C[N@@H+]2CCOCC3(CCN(c4ccc5c([nH+]4)CCCC5)CC3)C2)ccn1 ZINC001164962490 722055064 /nfs/dbraw/zinc/05/50/64/722055064.db2.gz DWIWVPDHFTTXSZ-UHFFFAOYSA-N 2 1 392.547 3.474 20 0 GGADMP c1cc(C[N@H+]2CCOCC3(CCN(c4ccc5c([nH+]4)CCCC5)CC3)C2)ccn1 ZINC001164962490 722055065 /nfs/dbraw/zinc/05/50/65/722055065.db2.gz DWIWVPDHFTTXSZ-UHFFFAOYSA-N 2 1 392.547 3.474 20 0 GGADMP c1cn(Cc2ccccc2)c2cc[nH+]c(N3C[C@@H]4C[N@@H+](CC5CC5)C[C@H](C3)O4)c12 ZINC001164967601 722073259 /nfs/dbraw/zinc/07/32/59/722073259.db2.gz RMMNXDPBNXLRSW-OYRHEFFESA-N 2 1 388.515 3.384 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(-c2nn[nH]n2)c1 ZINC000824579460 946828301 /nfs/dbraw/zinc/82/83/01/946828301.db2.gz ZMDJQVQURABFNI-MJGOQNOKSA-N 2 1 376.508 3.430 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(-c2nn[nH]n2)c1 ZINC000824579458 946829038 /nfs/dbraw/zinc/82/90/38/946829038.db2.gz ZMDJQVQURABFNI-IEBWSBKVSA-N 2 1 376.508 3.430 20 0 GGADMP CC(C)[C@@H]1[N@@H+](C)C[C@@]12C[C@@H]([NH2+]Cc1cnc(-c3cccs3)s1)[C@@H](O)C2 ZINC001550421873 1126206404 /nfs/dbraw/zinc/20/64/04/1126206404.db2.gz HHTQXMAYAIPDQR-YEWFCNIMSA-N 2 1 377.579 3.441 20 0 GGADMP CC[N@H+]1C[C@@]2(C[C@@H]([NH2+]Cc3cnc(-c4ccco4)s3)[C@@H](O)C2)[C@@H]1C(C)C ZINC001550423933 1126206762 /nfs/dbraw/zinc/20/67/62/1126206762.db2.gz URDQNMREEXZIEJ-JMVFIXPQSA-N 2 1 375.538 3.363 20 0 GGADMP C[NH+]1CCN([C@H](C[NH2+]Cc2ccc(-n3ccnc3)cc2)c2cccs2)CC1 ZINC000022790083 207261876 /nfs/dbraw/zinc/26/18/76/207261876.db2.gz YZCSYDNHYJCWEF-HXUWFJFHSA-N 2 1 381.549 3.012 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000025410259 207303169 /nfs/dbraw/zinc/30/31/69/207303169.db2.gz LTZUXXMZHZULJO-IBGZPJMESA-N 2 1 377.532 3.214 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000025410259 207303173 /nfs/dbraw/zinc/30/31/73/207303173.db2.gz LTZUXXMZHZULJO-IBGZPJMESA-N 2 1 377.532 3.214 20 0 GGADMP C[NH2+]C[C@H]1CCC[N@H+](Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000097162628 208340187 /nfs/dbraw/zinc/34/01/87/208340187.db2.gz JIKJGURCMYGTDN-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000097162628 208340193 /nfs/dbraw/zinc/34/01/93/208340193.db2.gz JIKJGURCMYGTDN-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP COc1c(Br)cc(Br)cc1C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414829275 565962647 /nfs/dbraw/zinc/96/26/47/565962647.db2.gz NPZLXIUKRKDWJS-SNVBAGLBSA-N 2 1 392.135 3.309 20 0 GGADMP COc1c(Br)cc(C[NH2+]C2CC[NH+](C)CC2)cc1Br ZINC000037256085 564420951 /nfs/dbraw/zinc/42/09/51/564420951.db2.gz ZJTVPDDEGMUJHH-UHFFFAOYSA-N 2 1 392.135 3.404 20 0 GGADMP C[C@@H](Cn1cc(Br)cn1)[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000122786228 564427605 /nfs/dbraw/zinc/42/76/05/564427605.db2.gz LVLBZDAOBRCHSS-HNNXBMFYSA-N 2 1 377.330 3.072 20 0 GGADMP C[C@@H](Cn1cc(Br)cn1)[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000122786228 564427608 /nfs/dbraw/zinc/42/76/08/564427608.db2.gz LVLBZDAOBRCHSS-HNNXBMFYSA-N 2 1 377.330 3.072 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)cc1Br ZINC000124319844 564478838 /nfs/dbraw/zinc/47/88/38/564478838.db2.gz SQUKJKPALNUECH-OAHLLOKOSA-N 2 1 398.389 3.382 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCc3c2cc(Br)cc3F)CC1 ZINC000124355197 564479460 /nfs/dbraw/zinc/47/94/60/564479460.db2.gz MNIGOPICNGAJPU-LJQANCHMSA-N 2 1 398.364 3.439 20 0 GGADMP C[C@@H](Cc1ccc(Br)c(F)c1)[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000128708955 564627530 /nfs/dbraw/zinc/62/75/30/564627530.db2.gz DPNRDJCRANQZMM-HNNXBMFYSA-N 2 1 386.353 3.136 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)N(C)Cc1ccc(Cl)c(Cl)c1 ZINC000130560306 564685962 /nfs/dbraw/zinc/68/59/62/564685962.db2.gz QHGNMUXATMQTEB-UHFFFAOYSA-N 2 1 383.323 3.479 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)N(C)Cc1ccc(Cl)c(Cl)c1 ZINC000130560306 564685964 /nfs/dbraw/zinc/68/59/64/564685964.db2.gz QHGNMUXATMQTEB-UHFFFAOYSA-N 2 1 383.323 3.479 20 0 GGADMP C[NH+]1CCN(CCCC[NH2+][C@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000134316011 564800146 /nfs/dbraw/zinc/80/01/46/564800146.db2.gz OWTAZETXZCIDNV-KRWDZBQOSA-N 2 1 384.337 3.193 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000134383477 564801599 /nfs/dbraw/zinc/80/15/99/564801599.db2.gz IMUNXTQIEVHXGE-QGZVFWFLSA-N 2 1 384.337 3.193 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000076003061 564862716 /nfs/dbraw/zinc/86/27/16/564862716.db2.gz XOTXGOKPWDBYRE-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000076003061 564862721 /nfs/dbraw/zinc/86/27/21/564862721.db2.gz XOTXGOKPWDBYRE-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000076003064 564862891 /nfs/dbraw/zinc/86/28/91/564862891.db2.gz XOTXGOKPWDBYRE-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000076003064 564862895 /nfs/dbraw/zinc/86/28/95/564862895.db2.gz XOTXGOKPWDBYRE-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP Brc1ccccc1OCC[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000093792495 564890707 /nfs/dbraw/zinc/89/07/07/564890707.db2.gz VJDWRVQGODXZFO-UHFFFAOYSA-N 2 1 397.357 3.405 20 0 GGADMP O=C(CC[N@H+]1CC[C@H](C[NH+]2CCCC2)C1)Nc1ccc(Br)cc1 ZINC000150788115 564891386 /nfs/dbraw/zinc/89/13/86/564891386.db2.gz NIPFYLYUFMSRFO-OAHLLOKOSA-N 2 1 380.330 3.195 20 0 GGADMP O=C(CC[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1)Nc1cccc(Br)c1 ZINC000150846206 564893983 /nfs/dbraw/zinc/89/39/83/564893983.db2.gz XZPAOMYYXJMIEI-HNNXBMFYSA-N 2 1 380.330 3.195 20 0 GGADMP NC(=O)[C@@H]1CCCN1C1CC[NH+](Cc2sc3ccccc3c2Cl)CC1 ZINC000104067667 564953046 /nfs/dbraw/zinc/95/30/46/564953046.db2.gz HVTFOPQMTUEIAZ-HNNXBMFYSA-N 2 1 377.941 3.469 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000105476469 564967280 /nfs/dbraw/zinc/96/72/80/564967280.db2.gz UGZZOZDGDDLFKO-UHFFFAOYSA-N 2 1 384.351 3.386 20 0 GGADMP C[C@@H](CN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccc(Br)cc2)o1 ZINC000106484374 564983408 /nfs/dbraw/zinc/98/34/08/564983408.db2.gz GQRWKLVMRKXASK-HNNXBMFYSA-N 2 1 392.341 3.435 20 0 GGADMP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](CCOc3cc(Cl)ccc3Cl)C2)CC1 ZINC000369446199 565093053 /nfs/dbraw/zinc/09/30/53/565093053.db2.gz YALCNJPLBLBCRJ-QGZVFWFLSA-N 2 1 386.367 3.473 20 0 GGADMP CSc1ccc(Cl)c(C(=O)N(C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)c1 ZINC000370841825 565163851 /nfs/dbraw/zinc/16/38/51/565163851.db2.gz OMMLNGNPWNZJQO-OAHLLOKOSA-N 2 1 381.973 3.302 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)CC(=O)Nc1cccc(Br)c1 ZINC000268910062 565171411 /nfs/dbraw/zinc/17/14/11/565171411.db2.gz YPGIOCSEZUZXSW-ZDUSSCGKSA-N 2 1 379.302 3.351 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(Cc3cc4c(cc3Br)OCCO4)CC[C@@H]21 ZINC000158859882 565184801 /nfs/dbraw/zinc/18/48/01/565184801.db2.gz SXMLGPCKBIIEJE-BBRMVZONSA-N 2 1 381.314 3.136 20 0 GGADMP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cnc(-c4cccs4)s3)C2)CC1 ZINC000371331827 565187784 /nfs/dbraw/zinc/18/77/84/565187784.db2.gz KYJRTDHTEPDABI-MRXNPFEDSA-N 2 1 376.595 3.472 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000371437065 565194042 /nfs/dbraw/zinc/19/40/42/565194042.db2.gz ARODPEXNZIBZQB-XYPHTWIQSA-N 2 1 380.330 3.383 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000371437055 565194135 /nfs/dbraw/zinc/19/41/35/565194135.db2.gz ARODPEXNZIBZQB-COXVUDFISA-N 2 1 380.330 3.383 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(Br)s3)CC2)CC1 ZINC000371835532 565211878 /nfs/dbraw/zinc/21/18/78/565211878.db2.gz UAJMDMKMWOOTCS-UHFFFAOYSA-N 2 1 386.403 3.360 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(Br)cn1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185766517 565220201 /nfs/dbraw/zinc/22/02/01/565220201.db2.gz ZEUKJEXKOPMISD-ZIAGYGMSSA-N 2 1 395.345 3.025 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(Br)cn1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766517 565220207 /nfs/dbraw/zinc/22/02/07/565220207.db2.gz ZEUKJEXKOPMISD-ZIAGYGMSSA-N 2 1 395.345 3.025 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(Br)cn1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185766498 565220645 /nfs/dbraw/zinc/22/06/45/565220645.db2.gz ZEUKJEXKOPMISD-UONOGXRCSA-N 2 1 395.345 3.025 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(Br)cn1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766498 565220648 /nfs/dbraw/zinc/22/06/48/565220648.db2.gz ZEUKJEXKOPMISD-UONOGXRCSA-N 2 1 395.345 3.025 20 0 GGADMP OC1CC[NH+](CCC[NH2+][C@@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000295999084 565297697 /nfs/dbraw/zinc/29/76/97/565297697.db2.gz ODDCUKJQNHVUKB-IBGZPJMESA-N 2 1 381.358 3.207 20 0 GGADMP COc1c(Br)cccc1C[NH2+]Cc1ccnc(OCC[NH+](C)C)c1 ZINC000187344023 565325176 /nfs/dbraw/zinc/32/51/76/565325176.db2.gz RMLNNFHXLWZGGF-UHFFFAOYSA-N 2 1 394.313 3.083 20 0 GGADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(Br)cc(Br)c2N)C1 ZINC000187351595 565325823 /nfs/dbraw/zinc/32/58/23/565325823.db2.gz MQPYHRNETJUPDX-JTQLQIEISA-N 2 1 391.151 3.225 20 0 GGADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Br)cc(Br)c2N)C1 ZINC000187351595 565325829 /nfs/dbraw/zinc/32/58/29/565325829.db2.gz MQPYHRNETJUPDX-JTQLQIEISA-N 2 1 391.151 3.225 20 0 GGADMP C[N@@H+]1CC=C(C[NH2+]Cc2cc(Br)cc(Br)c2N)CC1 ZINC000274402032 565369833 /nfs/dbraw/zinc/36/98/33/565369833.db2.gz GWSIZJXRLBQVHG-UHFFFAOYSA-N 2 1 389.135 3.145 20 0 GGADMP C[C@@H](Cn1cc(Br)cn1)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165315495 565370016 /nfs/dbraw/zinc/37/00/16/565370016.db2.gz QKOAQPCUPAATDB-FUHWJXTLSA-N 2 1 391.357 3.188 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+][C@@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000297775885 565387126 /nfs/dbraw/zinc/38/71/26/565387126.db2.gz VYUYNUQSGURCEQ-AWEZNQCLSA-N 2 1 392.219 3.067 20 0 GGADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000188749604 565422040 /nfs/dbraw/zinc/42/20/40/565422040.db2.gz FNVNFHDMPQVIKF-ZWKOTPCHSA-N 2 1 396.373 3.248 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cscc3Br)CC2)CC1 ZINC000377703218 565494281 /nfs/dbraw/zinc/49/42/81/565494281.db2.gz WHWRVYAPQQJGEP-UHFFFAOYSA-N 2 1 386.403 3.360 20 0 GGADMP Brc1ccc2c(c1)[nH+]ccc2N1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000301563419 565496368 /nfs/dbraw/zinc/49/63/68/565496368.db2.gz PEZCJMTVWCMKIN-CQSZACIVSA-N 2 1 376.298 3.156 20 0 GGADMP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](CCOc3ccc(Cl)cc3Cl)C2)CC1 ZINC000377907855 565505670 /nfs/dbraw/zinc/50/56/70/565505670.db2.gz KKJPYRYLCUMKGX-KRWDZBQOSA-N 2 1 386.367 3.473 20 0 GGADMP COc1sc(C[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1Br ZINC000277646314 565512595 /nfs/dbraw/zinc/51/25/95/565512595.db2.gz DGKFUNPKBRUQLD-LBPRGKRZSA-N 2 1 377.348 3.110 20 0 GGADMP COc1sc(C[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1Br ZINC000277646314 565512598 /nfs/dbraw/zinc/51/25/98/565512598.db2.gz DGKFUNPKBRUQLD-LBPRGKRZSA-N 2 1 377.348 3.110 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+]Cc1cc(Cl)ccc1I ZINC000405319157 565587558 /nfs/dbraw/zinc/58/75/58/565587558.db2.gz YFWYSOIMWUNBKJ-UHFFFAOYSA-N 2 1 375.641 3.010 20 0 GGADMP Cc1nn(C)c(C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1Br ZINC000279043555 565592468 /nfs/dbraw/zinc/59/24/68/565592468.db2.gz CVCHBVRBVGKLHB-UHFFFAOYSA-N 2 1 395.345 3.111 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CC[NH+](CCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000173883774 565596670 /nfs/dbraw/zinc/59/66/70/565596670.db2.gz OUWHOJUACNIJPM-ZDUSSCGKSA-N 2 1 386.309 3.190 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@H+](CCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000173883774 565596675 /nfs/dbraw/zinc/59/66/75/565596675.db2.gz OUWHOJUACNIJPM-ZDUSSCGKSA-N 2 1 386.309 3.190 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000173883774 565596681 /nfs/dbraw/zinc/59/66/81/565596681.db2.gz OUWHOJUACNIJPM-ZDUSSCGKSA-N 2 1 386.309 3.190 20 0 GGADMP CCCn1ccnc1CCC[N@@H+](C)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000191489878 565608213 /nfs/dbraw/zinc/60/82/13/565608213.db2.gz OASNOPMGYFPZJT-KRWDZBQOSA-N 2 1 393.329 3.147 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC(C(F)(F)F)(C(F)(F)F)C2)CC1 ZINC000191499378 565608873 /nfs/dbraw/zinc/60/88/73/565608873.db2.gz YCBKAFKPWDXBMU-UHFFFAOYSA-N 2 1 375.401 3.219 20 0 GGADMP C[N@H+](Cc1ccc(Br)cc1N1CCOCC1)CC1CC[NH+](C)CC1 ZINC000191649195 565619274 /nfs/dbraw/zinc/61/92/74/565619274.db2.gz OEPIIIHOVWZMHN-UHFFFAOYSA-N 2 1 396.373 3.059 20 0 GGADMP C[NH+]1CCC(C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000174729385 565654692 /nfs/dbraw/zinc/65/46/92/565654692.db2.gz OIMBSRUNFDAKCE-UHFFFAOYSA-N 2 1 384.351 3.416 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000174956765 565669511 /nfs/dbraw/zinc/66/95/11/565669511.db2.gz HZALUTDGUFYUJO-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000174956765 565669517 /nfs/dbraw/zinc/66/95/17/565669517.db2.gz HZALUTDGUFYUJO-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000174956765 565669523 /nfs/dbraw/zinc/66/95/23/565669523.db2.gz HZALUTDGUFYUJO-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP C[NH+]1CCC(N2CCC([NH2+]Cc3c(F)cccc3Br)CC2)CC1 ZINC000192522444 565696942 /nfs/dbraw/zinc/69/69/42/565696942.db2.gz QMJROZYBHKDQGO-UHFFFAOYSA-N 2 1 384.337 3.236 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H]2CCc3ccc(Br)cc32)CC1 ZINC000193974424 565787301 /nfs/dbraw/zinc/78/73/01/565787301.db2.gz CWIDICNOLAIQGF-IBGZPJMESA-N 2 1 380.374 3.444 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH+]1C[C@H]2C[N@H+](C)C[C@H]2C1 ZINC000194534764 565821188 /nfs/dbraw/zinc/82/11/88/565821188.db2.gz XQGKEBRDESNLAK-IYBDPMFKSA-N 2 1 389.341 3.245 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH+]1C[C@H]2C[N@@H+](C)C[C@H]2C1 ZINC000194534764 565821191 /nfs/dbraw/zinc/82/11/91/565821191.db2.gz XQGKEBRDESNLAK-IYBDPMFKSA-N 2 1 389.341 3.245 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000194534764 565821196 /nfs/dbraw/zinc/82/11/96/565821196.db2.gz XQGKEBRDESNLAK-IYBDPMFKSA-N 2 1 389.341 3.245 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000194534764 565821200 /nfs/dbraw/zinc/82/12/00/565821200.db2.gz XQGKEBRDESNLAK-IYBDPMFKSA-N 2 1 389.341 3.245 20 0 GGADMP C[C@H]1[C@@H]([NH3+])CCN1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000332291802 565825565 /nfs/dbraw/zinc/82/55/65/565825565.db2.gz NMLWDGCFTVHPQS-SJCJKPOMSA-N 2 1 385.339 3.089 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1)[NH+](C)C ZINC000412972980 565826288 /nfs/dbraw/zinc/82/62/88/565826288.db2.gz OYHUZQITKCVLRX-SFHVURJKSA-N 2 1 396.373 3.116 20 0 GGADMP [NH3+][C@@H]1CCCN(C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000332516129 565841828 /nfs/dbraw/zinc/84/18/28/565841828.db2.gz HEUCPAMOUTVVCR-MRXNPFEDSA-N 2 1 385.339 3.091 20 0 GGADMP CC1CC[NH+](CCC[NH2+]Cc2cc(Br)c3c(c2)OCCO3)CC1 ZINC000195548567 565889054 /nfs/dbraw/zinc/88/90/54/565889054.db2.gz KDYIYMRAEIDLCW-UHFFFAOYSA-N 2 1 383.330 3.432 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]1C1CCN(c2cc[nH+]c3cc(Br)ccc32)CC1 ZINC000333636408 565889835 /nfs/dbraw/zinc/88/98/35/565889835.db2.gz BOJYHZOVYNMLMO-QAPCUYQASA-N 2 1 376.298 3.330 20 0 GGADMP CC[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000414192569 565902930 /nfs/dbraw/zinc/90/29/30/565902930.db2.gz SLGRMIQANZERQR-PBHICJAKSA-N 2 1 387.977 3.021 20 0 GGADMP CCCC[C@@H]([NH3+])C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000236730148 565943571 /nfs/dbraw/zinc/94/35/71/565943571.db2.gz UPXVMHHLGKZDGY-QGZVFWFLSA-N 2 1 382.346 3.047 20 0 GGADMP COCCC[NH+]1CCC([NH2+]CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000237203605 565954701 /nfs/dbraw/zinc/95/47/01/565954701.db2.gz HRUOQNWZFLZQQV-UHFFFAOYSA-N 2 1 395.341 3.315 20 0 GGADMP Cc1cc([C@@H]2CCC[N@H+]2C[C@@H]2CCCN(C(=O)C[NH3+])C2)ccc1Br ZINC000414755711 565958511 /nfs/dbraw/zinc/95/85/11/565958511.db2.gz PLAVOQKAVGSLDK-YJBOKZPZSA-N 2 1 394.357 3.092 20 0 GGADMP CC(C)C[N@H+](Cc1ccccc1Br)C[C@H]1CCCN(C(=O)C[NH3+])C1 ZINC000414757433 565958902 /nfs/dbraw/zinc/95/89/02/565958902.db2.gz SPKFGEPRXILNOR-MRXNPFEDSA-N 2 1 396.373 3.104 20 0 GGADMP C[C@]1(C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CCC[NH2+]C1 ZINC000237541366 565962264 /nfs/dbraw/zinc/96/22/64/565962264.db2.gz LOIUTWUUOVNWJX-IBGZPJMESA-N 2 1 384.351 3.464 20 0 GGADMP C[C@]1(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)CCCC[NH2+]1 ZINC000237541203 565963015 /nfs/dbraw/zinc/96/30/15/565963015.db2.gz CZQMWBTZBIGFII-LJQANCHMSA-N 2 1 394.357 3.062 20 0 GGADMP C[NH2+]C[C@@H](C)C[NH2+]Cc1cc(Br)ccc1OCc1ccccn1 ZINC000414836920 565963028 /nfs/dbraw/zinc/96/30/28/565963028.db2.gz JTZDBXJBZLEWRT-CQSZACIVSA-N 2 1 378.314 3.368 20 0 GGADMP C[C@@]1(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)CCCC[NH2+]1 ZINC000237571322 565964201 /nfs/dbraw/zinc/96/42/01/565964201.db2.gz CZQMWBTZBIGFII-IBGZPJMESA-N 2 1 394.357 3.062 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414914184 565964825 /nfs/dbraw/zinc/96/48/25/565964825.db2.gz XLBUCVYJSJDPNQ-GOSISDBHSA-N 2 1 385.346 3.344 20 0 GGADMP COc1cc(C[NH2+]C2(C)CC[NH2+]CC2)cc(Br)c1OC(F)F ZINC000414939739 565965917 /nfs/dbraw/zinc/96/59/17/565965917.db2.gz JLMZSUIDEQNASK-UHFFFAOYSA-N 2 1 379.245 3.291 20 0 GGADMP COc1sc(C[NH+]2CCC([C@H]3OCCC[C@@H]3[NH3+])CC2)cc1Br ZINC000415111391 565972881 /nfs/dbraw/zinc/97/28/81/565972881.db2.gz QVGFMFMSEVWIGU-LSDHHAIUSA-N 2 1 389.359 3.238 20 0 GGADMP COc1c(Br)cccc1C[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000415102956 565973074 /nfs/dbraw/zinc/97/30/74/565973074.db2.gz FBQBSHFQSFRHMQ-FUHWJXTLSA-N 2 1 383.330 3.176 20 0 GGADMP COc1sc(C[NH+]2CCC([C@H]3C[C@H]([NH3+])CCO3)CC2)cc1Br ZINC000415121257 565974686 /nfs/dbraw/zinc/97/46/86/565974686.db2.gz HWWHOPXSQWCOSA-IUODEOHRSA-N 2 1 389.359 3.238 20 0 GGADMP CSc1cc(Br)ccc1C[N@H+]1CCC[C@H](n2cc(C[NH3+])nn2)C1 ZINC000415132717 565976120 /nfs/dbraw/zinc/97/61/20/565976120.db2.gz UKEBTPMXQIKJER-HNNXBMFYSA-N 2 1 396.358 3.058 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCc3c2cccc3Br)CC1 ZINC000180015535 566025234 /nfs/dbraw/zinc/02/52/34/566025234.db2.gz RZMCWEFAJAHDDE-LJQANCHMSA-N 2 1 380.374 3.444 20 0 GGADMP C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2c(cc1Br)OCCO2 ZINC000246983725 566049083 /nfs/dbraw/zinc/04/90/83/566049083.db2.gz TVKRBFSSFUXALQ-MJBXVCDLSA-N 2 1 381.314 3.498 20 0 GGADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(Br)cc2N2CCOCC2)CC1 ZINC000180460543 566063763 /nfs/dbraw/zinc/06/37/63/566063763.db2.gz RNEMRVLJNNDILQ-UHFFFAOYSA-N 2 1 396.373 3.248 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(Cc3nnc(-c4ccc(Br)o4)o3)CC[C@H]21 ZINC000247942448 566068193 /nfs/dbraw/zinc/06/81/93/566068193.db2.gz DCNGSSMRVOXHNZ-VXGBXAGGSA-N 2 1 381.274 3.008 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCCOc2c(Br)cccc21 ZINC000247973599 566069188 /nfs/dbraw/zinc/06/91/88/566069188.db2.gz HOBJUXYATMPNPD-MAUKXSAKSA-N 2 1 397.357 3.489 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@H]1CCCOc2c(Br)cccc21 ZINC000247973603 566069985 /nfs/dbraw/zinc/06/99/85/566069985.db2.gz HOBJUXYATMPNPD-YJBOKZPZSA-N 2 1 397.357 3.489 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(Cc3cc4c(cc3Br)OCCO4)CC[C@H]21 ZINC000248165926 566073820 /nfs/dbraw/zinc/07/38/20/566073820.db2.gz SXMLGPCKBIIEJE-XJKSGUPXSA-N 2 1 381.314 3.136 20 0 GGADMP Cc1ccc(Br)cc1NC(=O)CC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000180829893 566093452 /nfs/dbraw/zinc/09/34/52/566093452.db2.gz QRMGUPHIGVOTFX-OFQRWUPVSA-N 2 1 382.346 3.404 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181277762 566129514 /nfs/dbraw/zinc/12/95/14/566129514.db2.gz OLYXVLXULHLQJW-TYNCELHUSA-N 2 1 378.318 3.053 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181277762 566129517 /nfs/dbraw/zinc/12/95/17/566129517.db2.gz OLYXVLXULHLQJW-TYNCELHUSA-N 2 1 378.318 3.053 20 0 GGADMP C[C@@H](CNC(=O)[C@](C)([NH3+])c1ccc(Br)cc1)[N@H+]1CCCC[C@H]1C ZINC000261721082 566130100 /nfs/dbraw/zinc/13/01/00/566130100.db2.gz KDRDZEHMIVZIAZ-QWQRMKEZSA-N 2 1 382.346 3.002 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000261722097 566130220 /nfs/dbraw/zinc/13/02/20/566130220.db2.gz NPLDENUWGIRTHL-SFHVURJKSA-N 2 1 377.330 3.422 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+](CCSc2ccc(Cl)cc2)C1)[C@@H]1CCC[NH2+]1 ZINC000261845756 566137757 /nfs/dbraw/zinc/13/77/57/566137757.db2.gz LYGFQDRQVTXANR-QAPCUYQASA-N 2 1 381.973 3.012 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+](CCSc2ccc(Cl)cc2)C1)[C@H]1CCC[NH2+]1 ZINC000261845752 566137926 /nfs/dbraw/zinc/13/79/26/566137926.db2.gz LYGFQDRQVTXANR-CRAIPNDOSA-N 2 1 381.973 3.012 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3nc(-c4cccc(Br)c4)no3)C[C@@H]21 ZINC000261969025 566141596 /nfs/dbraw/zinc/14/15/96/566141596.db2.gz YUBTZPRPTVIWQZ-AEGPPILISA-N 2 1 377.286 3.058 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3nc(-c4cccc(Br)c4)no3)C[C@@H]21 ZINC000261969025 566141602 /nfs/dbraw/zinc/14/16/02/566141602.db2.gz YUBTZPRPTVIWQZ-AEGPPILISA-N 2 1 377.286 3.058 20 0 GGADMP Brc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(N2CCOCC2)c1 ZINC000181457812 566141987 /nfs/dbraw/zinc/14/19/87/566141987.db2.gz JURVEHIWXFKLIR-ZWKOTPCHSA-N 2 1 394.357 3.002 20 0 GGADMP Brc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c(N2CCOCC2)c1 ZINC000181457812 566141988 /nfs/dbraw/zinc/14/19/88/566141988.db2.gz JURVEHIWXFKLIR-ZWKOTPCHSA-N 2 1 394.357 3.002 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000181459476 566142138 /nfs/dbraw/zinc/14/21/38/566142138.db2.gz IPTWOHIVEQJJFV-IIDMSEBBSA-N 2 1 396.373 3.104 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000181459476 566142142 /nfs/dbraw/zinc/14/21/42/566142142.db2.gz IPTWOHIVEQJJFV-IIDMSEBBSA-N 2 1 396.373 3.104 20 0 GGADMP C[NH2+]CCC1CC[NH+](CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000262021148 566144058 /nfs/dbraw/zinc/14/40/58/566144058.db2.gz XWCRCYJZSHQYHJ-UHFFFAOYSA-N 2 1 375.847 3.201 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000366262005 566144428 /nfs/dbraw/zinc/14/44/28/566144428.db2.gz XCOGLMAVDNBIRR-KBRIMQKVSA-N 2 1 380.330 3.383 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000262148328 566147010 /nfs/dbraw/zinc/14/70/10/566147010.db2.gz ZRTTWJABSAHCKN-LJQANCHMSA-N 2 1 389.341 3.437 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000262148328 566147018 /nfs/dbraw/zinc/14/70/18/566147018.db2.gz ZRTTWJABSAHCKN-LJQANCHMSA-N 2 1 389.341 3.437 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)c(Br)c1 ZINC000181696957 566159605 /nfs/dbraw/zinc/15/96/05/566159605.db2.gz GXCPCGMZCOBLRX-OAHLLOKOSA-N 2 1 398.389 3.382 20 0 GGADMP C[NH+](C)CC1CC[NH+](Cc2ccc(F)cc2I)CC1 ZINC000417700615 566172232 /nfs/dbraw/zinc/17/22/32/566172232.db2.gz GYFVMSHSXKKPIM-UHFFFAOYSA-N 2 1 376.257 3.204 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(Br)nc1 ZINC000290592326 566180870 /nfs/dbraw/zinc/18/08/70/566180870.db2.gz GOGZAKTXQUNQLF-KDOFPFPSSA-N 2 1 390.325 3.262 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(Br)nc1 ZINC000290592338 566181075 /nfs/dbraw/zinc/18/10/75/566181075.db2.gz GOGZAKTXQUNQLF-RDTXWAMCSA-N 2 1 390.325 3.262 20 0 GGADMP CC(C)[C@H]([NH3+])CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000417992750 566187525 /nfs/dbraw/zinc/18/75/25/566187525.db2.gz NABWYWIHJNHQBS-QGZVFWFLSA-N 2 1 387.355 3.240 20 0 GGADMP Brc1cncc(Br)c1CNC[C@H]1CC[N@H+](C2CC2)C1 ZINC000290961523 566198266 /nfs/dbraw/zinc/19/82/66/566198266.db2.gz WKNDCBCGVHFRLY-SNVBAGLBSA-N 2 1 389.135 3.181 20 0 GGADMP COc1ccc(C[N@@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Br ZINC000367617139 566209263 /nfs/dbraw/zinc/20/92/63/566209263.db2.gz JNXCVDZBONVWBG-KRWDZBQOSA-N 2 1 396.373 3.058 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)[C@@H]1CCCc2ccc(Br)cc21 ZINC000182963114 566232426 /nfs/dbraw/zinc/23/24/26/566232426.db2.gz ITUCZVZTEJGNFP-LJQANCHMSA-N 2 1 380.374 3.396 20 0 GGADMP CN1CC[NH+](CC2CC[NH+](Cc3csc(-c4ccsc4)n3)CC2)CC1 ZINC000265412893 566236654 /nfs/dbraw/zinc/23/66/54/566236654.db2.gz FQFKVGXDJSCATE-UHFFFAOYSA-N 2 1 376.595 3.331 20 0 GGADMP CN1CC[NH+](CC2CC[NH+](Cc3ccc(F)cc3Br)CC2)CC1 ZINC000265435778 566237161 /nfs/dbraw/zinc/23/71/61/566237161.db2.gz OKDUBDMPAOPXAR-UHFFFAOYSA-N 2 1 384.337 3.048 20 0 GGADMP Brc1cc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc2c1OCCCO2 ZINC000368789433 566245473 /nfs/dbraw/zinc/24/54/73/566245473.db2.gz DABIGJONOQPMRZ-LSDHHAIUSA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc2c1OCCCO2 ZINC000368789433 566245475 /nfs/dbraw/zinc/24/54/75/566245475.db2.gz DABIGJONOQPMRZ-LSDHHAIUSA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc2c1OCCCO2 ZINC000368789433 566245477 /nfs/dbraw/zinc/24/54/77/566245477.db2.gz DABIGJONOQPMRZ-LSDHHAIUSA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)cc2c1OCCCO2 ZINC000368789431 566245548 /nfs/dbraw/zinc/24/55/48/566245548.db2.gz DABIGJONOQPMRZ-GJZGRUSLSA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc2c1OCCCO2 ZINC000368789431 566245550 /nfs/dbraw/zinc/24/55/50/566245550.db2.gz DABIGJONOQPMRZ-GJZGRUSLSA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc2c1OCCCO2 ZINC000368789431 566245552 /nfs/dbraw/zinc/24/55/52/566245552.db2.gz DABIGJONOQPMRZ-GJZGRUSLSA-N 2 1 381.314 3.327 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000575124179 566252892 /nfs/dbraw/zinc/25/28/92/566252892.db2.gz RJVBWHWMHNRGMY-HUUCEWRRSA-N 2 1 380.330 3.018 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000575124180 566253546 /nfs/dbraw/zinc/25/35/46/566253546.db2.gz RJVBWHWMHNRGMY-LSDHHAIUSA-N 2 1 380.330 3.018 20 0 GGADMP Cc1c(Br)cccc1C[N@@H+]1CC[C@@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000534869440 566261665 /nfs/dbraw/zinc/26/16/65/566261665.db2.gz ZWIVYFNVWBQAAH-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP CC[C@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481913976 566263297 /nfs/dbraw/zinc/26/32/97/566263297.db2.gz QVPDNAHMJVRZBL-KRWDZBQOSA-N 2 1 387.977 3.165 20 0 GGADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000556202469 566274411 /nfs/dbraw/zinc/27/44/11/566274411.db2.gz RFZPWEGACWTDRW-HNNXBMFYSA-N 2 1 377.330 3.455 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000556202469 566274417 /nfs/dbraw/zinc/27/44/17/566274417.db2.gz RFZPWEGACWTDRW-HNNXBMFYSA-N 2 1 377.330 3.455 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cccc(Br)c2OC)C1 ZINC000482011980 566276003 /nfs/dbraw/zinc/27/60/03/566276003.db2.gz CSRKDJQHNTVOMV-MRXNPFEDSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cccc(Br)c2OC)C1 ZINC000482011980 566276011 /nfs/dbraw/zinc/27/60/11/566276011.db2.gz CSRKDJQHNTVOMV-MRXNPFEDSA-N 2 1 385.346 3.390 20 0 GGADMP C[NH+]1CCN(C(=O)CC[NH2+][C@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000482462172 566309350 /nfs/dbraw/zinc/30/93/50/566309350.db2.gz VBXHWNIOWUELLS-LBPRGKRZSA-N 2 1 376.353 3.186 20 0 GGADMP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cccc(Br)c1 ZINC000482561768 566317280 /nfs/dbraw/zinc/31/72/80/566317280.db2.gz DORSDYZETQQNBX-NVXWUHKLSA-N 2 1 382.346 3.077 20 0 GGADMP Cc1cc(C[N@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)ccc1Br ZINC000669691623 566322967 /nfs/dbraw/zinc/32/29/67/566322967.db2.gz FZJKLXWYDOHFJB-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP C[N@H+]1CC[C@@]2(C1)CCCN([C@@H]1CCc3cc(Br)ccc3NC1=O)C2 ZINC000625452065 566325105 /nfs/dbraw/zinc/32/51/05/566325105.db2.gz OOWUTYMTCGMRRU-IEBWSBKVSA-N 2 1 392.341 3.120 20 0 GGADMP [NH3+][C@@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(Cl)c1 ZINC000649308828 566360514 /nfs/dbraw/zinc/36/05/14/566360514.db2.gz AIWWITGAYVXVAP-KBXCAEBGSA-N 2 1 377.941 3.430 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Br)cc1OCCCO ZINC000462949651 566371107 /nfs/dbraw/zinc/37/11/07/566371107.db2.gz YSQLOGFUPVMEFZ-XIRDDKMYSA-N 2 1 397.357 3.488 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)cc1OCCCO ZINC000462949651 566371117 /nfs/dbraw/zinc/37/11/17/566371117.db2.gz YSQLOGFUPVMEFZ-XIRDDKMYSA-N 2 1 397.357 3.488 20 0 GGADMP Cc1cc(C[N@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)sc1Br ZINC000536663573 566391034 /nfs/dbraw/zinc/39/10/34/566391034.db2.gz MLDKGMMPDFKEFH-OAHLLOKOSA-N 2 1 386.403 3.419 20 0 GGADMP Cc1cc(C[N@@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)sc1Br ZINC000536663573 566391037 /nfs/dbraw/zinc/39/10/37/566391037.db2.gz MLDKGMMPDFKEFH-OAHLLOKOSA-N 2 1 386.403 3.419 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCc2nc(C(F)(F)F)cs2)[C@@H](C)C1 ZINC000483862364 566404861 /nfs/dbraw/zinc/40/48/61/566404861.db2.gz LOQBXOBMEMJLMA-KBPBESRZSA-N 2 1 379.492 3.431 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(Br)cc1OCCCO ZINC000463375311 566405042 /nfs/dbraw/zinc/40/50/42/566405042.db2.gz LCQMNWKXSOKRHT-CYBMUJFWSA-N 2 1 382.302 3.066 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1NCc1ccc(Cl)cc1I ZINC000447566703 566415690 /nfs/dbraw/zinc/41/56/90/566415690.db2.gz VTQIEHZMPYPOLR-QMTHXVAHSA-N 2 1 378.685 3.374 20 0 GGADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]C1CCN(Cc2ccc(Br)cc2)CC1 ZINC000484389753 566428328 /nfs/dbraw/zinc/42/83/28/566428328.db2.gz QHFXONSQBXXRBG-HNAYVOBHSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]C1CCN(Cc2ccc(Br)cc2)CC1 ZINC000484389753 566428334 /nfs/dbraw/zinc/42/83/34/566428334.db2.gz QHFXONSQBXXRBG-HNAYVOBHSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+][C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000484515648 566433616 /nfs/dbraw/zinc/43/36/16/566433616.db2.gz HWQUQKVRXROOFP-ZLDLUXBVSA-N 2 1 376.854 3.262 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+][C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000484515648 566433624 /nfs/dbraw/zinc/43/36/24/566433624.db2.gz HWQUQKVRXROOFP-ZLDLUXBVSA-N 2 1 376.854 3.262 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+][C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000484515644 566433813 /nfs/dbraw/zinc/43/38/13/566433813.db2.gz HWQUQKVRXROOFP-OSAQELSMSA-N 2 1 376.854 3.262 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+][C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000484515644 566433821 /nfs/dbraw/zinc/43/38/21/566433821.db2.gz HWQUQKVRXROOFP-OSAQELSMSA-N 2 1 376.854 3.262 20 0 GGADMP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1I ZINC000423090760 566475019 /nfs/dbraw/zinc/47/50/19/566475019.db2.gz WBMAZWLCYDZGJA-YGRLFVJLSA-N 2 1 378.685 3.422 20 0 GGADMP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(Cl)cc1I ZINC000423090759 566475581 /nfs/dbraw/zinc/47/55/81/566475581.db2.gz WBMAZWLCYDZGJA-QMTHXVAHSA-N 2 1 378.685 3.422 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1ccc(C(F)(F)F)s1 ZINC000671683346 566438360 /nfs/dbraw/zinc/43/83/60/566438360.db2.gz VLQLYRJYJMHALD-ZDUSSCGKSA-N 2 1 377.476 3.255 20 0 GGADMP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C[C@@H](O)COc1cccc(Cl)c1Cl ZINC000422899334 566465640 /nfs/dbraw/zinc/46/56/40/566465640.db2.gz HDXADKIXNQEYMR-LXZKKBNFSA-N 2 1 383.319 3.281 20 0 GGADMP COc1cc(Br)c(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1OC ZINC000422939521 566467471 /nfs/dbraw/zinc/46/74/71/566467471.db2.gz FZQCAHPCPBXIJW-FVQBIDKESA-N 2 1 383.330 3.477 20 0 GGADMP Cc1cc(Br)cn2cc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)nc12 ZINC000423042259 566470967 /nfs/dbraw/zinc/47/09/67/566470967.db2.gz YVVGXTSDHPUZST-BRWVUGGUSA-N 2 1 377.330 3.416 20 0 GGADMP COc1c(Br)cccc1C[N@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000650707675 566472373 /nfs/dbraw/zinc/47/23/73/566472373.db2.gz KQHRWUQUNRXYGO-YSVLISHTSA-N 2 1 383.330 3.176 20 0 GGADMP COc1ccc(Br)cc1C[N@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000650705341 566472398 /nfs/dbraw/zinc/47/23/98/566472398.db2.gz DZLGBKFEJXRSDD-XCRHUMRWSA-N 2 1 383.330 3.176 20 0 GGADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H](CO)Cc2ccccc2Br)c2ccccc21 ZINC000423076700 566473486 /nfs/dbraw/zinc/47/34/86/566473486.db2.gz RSQDQOZGUUZQJG-ZNOIYHFQSA-N 2 1 375.310 3.335 20 0 GGADMP COc1cc(I)c(Cl)cc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423094116 566475468 /nfs/dbraw/zinc/47/54/68/566475468.db2.gz JLDQTFQHYOBSIE-BDAKNGLRSA-N 2 1 382.673 3.169 20 0 GGADMP COC[C@@]1(C[NH2+][C@H](c2cccc(Br)c2)C2CCOCC2)CCC[NH2+]1 ZINC000423413274 566488071 /nfs/dbraw/zinc/48/80/71/566488071.db2.gz KBHJJFMPAAWFMS-OALUTQOASA-N 2 1 397.357 3.275 20 0 GGADMP COC[C@@]1(C[NH2+][C@@H](c2cccc(Br)c2)C2CCOCC2)CCC[NH2+]1 ZINC000423413273 566488760 /nfs/dbraw/zinc/48/87/60/566488760.db2.gz KBHJJFMPAAWFMS-MOPGFXCFSA-N 2 1 397.357 3.275 20 0 GGADMP Brc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423490605 566491437 /nfs/dbraw/zinc/49/14/37/566491437.db2.gz IGMYFKVWLXMFEN-GUYCJALGSA-N 2 1 378.314 3.276 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+]CCC[NH2+]C1CC1)CCCO2 ZINC000423528026 566493309 /nfs/dbraw/zinc/49/33/09/566493309.db2.gz NISSUBCRHUUXNA-OAHLLOKOSA-N 2 1 386.277 3.237 20 0 GGADMP Cc1cc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)sc1Br ZINC000512050877 566508649 /nfs/dbraw/zinc/50/86/49/566508649.db2.gz FGTAELLBTWPOTD-OLZOCXBDSA-N 2 1 388.375 3.057 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1)Nc1cccc(Br)c1 ZINC000578324109 566512448 /nfs/dbraw/zinc/51/24/48/566512448.db2.gz RKZJRYXCHUKPAR-GJZGRUSLSA-N 2 1 380.330 3.099 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ncc(I)s2)C1 ZINC000512142943 566517126 /nfs/dbraw/zinc/51/71/26/566517126.db2.gz BXDZYDIMLGTRIS-GFCCVEGCSA-N 2 1 393.338 3.349 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1CC(=O)NCCc1cccc(Cl)c1Cl)CC[NH2+]CC2 ZINC000424294431 566526446 /nfs/dbraw/zinc/52/64/46/566526446.db2.gz QIOFJMMLHFUWFH-CQSZACIVSA-N 2 1 384.351 3.116 20 0 GGADMP Cc1cc(NC(=O)C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)ccc1Br ZINC000424292922 566527248 /nfs/dbraw/zinc/52/72/48/566527248.db2.gz OVJFQJWVOHHPMP-AWEZNQCLSA-N 2 1 380.330 3.160 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1CC(=O)N(C)Cc1cc(Cl)cc(Cl)c1)CC[NH2+]CC2 ZINC000424301557 566527553 /nfs/dbraw/zinc/52/75/53/566527553.db2.gz XQCSAKADAOAZBN-CQSZACIVSA-N 2 1 384.351 3.416 20 0 GGADMP C[C@H]1CC2(C[N@H+]1Cc1cc(Br)c3c(c1)OCCO3)CC[NH2+]CC2 ZINC000424368970 566530494 /nfs/dbraw/zinc/53/04/94/566530494.db2.gz AZBJIAANYPTJBF-ZDUSSCGKSA-N 2 1 381.314 3.184 20 0 GGADMP CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2ccnc3c(Br)cccc23)CC1 ZINC000449128681 566531526 /nfs/dbraw/zinc/53/15/26/566531526.db2.gz ZUNRMUJUBHKTAH-INIZCTEOSA-N 2 1 392.341 3.180 20 0 GGADMP Cc1cc(C[N@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)ccc1Br ZINC000538762627 566532960 /nfs/dbraw/zinc/53/29/60/566532960.db2.gz ZVSSHJNHTFPJSZ-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]Cc1ccnc2c(Br)cccc12 ZINC000449151908 566532961 /nfs/dbraw/zinc/53/29/61/566532961.db2.gz YXPFKOXUTHXHIB-INIZCTEOSA-N 2 1 392.341 3.324 20 0 GGADMP Cc1cc(C[N@@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)ccc1Br ZINC000538762627 566532966 /nfs/dbraw/zinc/53/29/66/566532966.db2.gz ZVSSHJNHTFPJSZ-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP O[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2cc(F)cc(Br)c2)CC1 ZINC000449195580 566536176 /nfs/dbraw/zinc/53/61/76/566536176.db2.gz ZMFKKNWYFNUAKG-ROUUACIJSA-N 2 1 385.321 3.446 20 0 GGADMP C[NH+](C)CCOc1cc(C[NH2+]Cc2cccc(F)c2Br)ccn1 ZINC000449220562 566537878 /nfs/dbraw/zinc/53/78/78/566537878.db2.gz HXTISASUDFEMJT-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)NCCc1ccc(Cl)s1 ZINC000465695666 566541089 /nfs/dbraw/zinc/54/10/89/566541089.db2.gz ZNBKQXZBLNUUSB-HNNXBMFYSA-N 2 1 386.993 3.002 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]Cc2ccnc3c(Br)cccc23)CC1(C)C ZINC000449301661 566546349 /nfs/dbraw/zinc/54/63/49/566546349.db2.gz HUJDOTDYWLTTLU-UHFFFAOYSA-N 2 1 391.357 3.113 20 0 GGADMP Brc1cc2c(cc1CN1CCC[C@@H](c3ncc[nH]3)C1)OCCO2 ZINC000673712066 566551734 /nfs/dbraw/zinc/55/17/34/566551734.db2.gz NLVQIXUCWDSHPH-GFCCVEGCSA-N 2 1 378.270 3.323 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cn3cc(Br)ccc3n2)C1 ZINC000673756727 566553541 /nfs/dbraw/zinc/55/35/41/566553541.db2.gz IXPQXAWEBSWEKG-QGZVFWFLSA-N 2 1 395.345 3.030 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cn3cc(Br)ccc3n2)C1 ZINC000673756727 566553551 /nfs/dbraw/zinc/55/35/51/566553551.db2.gz IXPQXAWEBSWEKG-QGZVFWFLSA-N 2 1 395.345 3.030 20 0 GGADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCn2cc(Br)ccc2=O)CC1 ZINC000449379563 566554976 /nfs/dbraw/zinc/55/49/76/566554976.db2.gz TXFZBKHECUQYQW-CRAIPNDOSA-N 2 1 396.373 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCOc2ncc(Cl)cc2Cl)[C@H](C)C1 ZINC000539058042 566556098 /nfs/dbraw/zinc/55/60/98/566556098.db2.gz HXWQLWVYYDXBIT-RHSMWYFYSA-N 2 1 390.355 3.494 20 0 GGADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856284 566561946 /nfs/dbraw/zinc/56/19/46/566561946.db2.gz NEGRZQFQUDPSSN-HZPDHXFCSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856284 566561951 /nfs/dbraw/zinc/56/19/51/566561951.db2.gz NEGRZQFQUDPSSN-HZPDHXFCSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856284 566561957 /nfs/dbraw/zinc/56/19/57/566561957.db2.gz NEGRZQFQUDPSSN-HZPDHXFCSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856284 566561961 /nfs/dbraw/zinc/56/19/61/566561961.db2.gz NEGRZQFQUDPSSN-HZPDHXFCSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856283 566562466 /nfs/dbraw/zinc/56/24/66/566562466.db2.gz NEGRZQFQUDPSSN-HOTGVXAUSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856283 566562474 /nfs/dbraw/zinc/56/24/74/566562474.db2.gz NEGRZQFQUDPSSN-HOTGVXAUSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856283 566562481 /nfs/dbraw/zinc/56/24/81/566562481.db2.gz NEGRZQFQUDPSSN-HOTGVXAUSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856283 566562485 /nfs/dbraw/zinc/56/24/85/566562485.db2.gz NEGRZQFQUDPSSN-HOTGVXAUSA-N 2 1 387.351 3.397 20 0 GGADMP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C[C@@H](O)C[NH+]1CCCC1 ZINC000539308165 566572376 /nfs/dbraw/zinc/57/23/76/566572376.db2.gz HVCFSAOIXILTKM-SUYBPPKGSA-N 2 1 385.371 3.278 20 0 GGADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCCOc3ccc(I)cc32)CC1 ZINC000539507297 566585490 /nfs/dbraw/zinc/58/54/90/566585490.db2.gz LDIVRUGUKGDDSM-INIZCTEOSA-N 2 1 398.288 3.356 20 0 GGADMP CC(C)[N@H+]1CCc2nc(CNc3nc4cccc(Cl)c4n3C)sc2C1 ZINC000466634742 566588507 /nfs/dbraw/zinc/58/85/07/566588507.db2.gz LEQSDMOUGQWTND-UHFFFAOYSA-N 2 1 375.929 3.484 20 0 GGADMP CC(C)N1CCc2nc(CNc3nc4cccc(Cl)c4n3C)sc2C1 ZINC000466634742 566588518 /nfs/dbraw/zinc/58/85/18/566588518.db2.gz LEQSDMOUGQWTND-UHFFFAOYSA-N 2 1 375.929 3.484 20 0 GGADMP COc1cc2[nH+]ccc(NC[C@@H]3CC[N@H+](C4CC4)C3)c2cc1Br ZINC000579229950 566591368 /nfs/dbraw/zinc/59/13/68/566591368.db2.gz LPTASSRWBNXUNG-LBPRGKRZSA-N 2 1 376.298 3.324 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cccc(Br)c2C)[C@@H](C)C1 ZINC000449686739 566592662 /nfs/dbraw/zinc/59/26/62/566592662.db2.gz XZXVMODQRFUWTL-GMBSWORKSA-N 2 1 383.374 3.228 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](CC(=O)Nc3cc(Cl)ccc3Cl)C2)C1 ZINC000652346159 566603472 /nfs/dbraw/zinc/60/34/72/566603472.db2.gz UYOJLRQIGSEZRG-SUYBPPKGSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](CC(=O)Nc3cc(Cl)ccc3Cl)C2)C1 ZINC000652346159 566603479 /nfs/dbraw/zinc/60/34/79/566603479.db2.gz UYOJLRQIGSEZRG-SUYBPPKGSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](CC(=O)Nc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000652345665 566603494 /nfs/dbraw/zinc/60/34/94/566603494.db2.gz IHFQPDFOMCQOIS-OGHNNQOOSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3cc(Br)cc(F)c3F)C2)C1 ZINC000652350226 566605759 /nfs/dbraw/zinc/60/57/59/566605759.db2.gz MSBRBHUXOUWASD-XFJVYGCCSA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](Cc3cc(Br)cc(F)c3F)C2)C1 ZINC000652350226 566605765 /nfs/dbraw/zinc/60/57/65/566605765.db2.gz MSBRBHUXOUWASD-XFJVYGCCSA-N 2 1 389.284 3.446 20 0 GGADMP COc1cc2[nH+]ccc(NC3C[C@H]4CC[C@@H](C3)[N@@H+]4C)c2cc1Br ZINC000425268885 566625872 /nfs/dbraw/zinc/62/58/72/566625872.db2.gz QAECSRNOAAFGHY-YHWZYXNKSA-N 2 1 376.298 3.465 20 0 GGADMP Brc1cnn(CC[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c1 ZINC000560580582 566638822 /nfs/dbraw/zinc/63/88/22/566638822.db2.gz KVUIMZZSTNZZAT-BHIYHBOVSA-N 2 1 389.341 3.146 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@@H]1CCC[NH2+]CC1 ZINC000653119862 566651541 /nfs/dbraw/zinc/65/15/41/566651541.db2.gz ZHRLNKYKWUIDST-OAHLLOKOSA-N 2 1 384.351 3.464 20 0 GGADMP O=C(NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CCC[NH2+]CC1 ZINC000653153735 566654649 /nfs/dbraw/zinc/65/46/49/566654649.db2.gz YFHZXQIPMFCQBO-HNNXBMFYSA-N 2 1 384.351 3.464 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](CCOc2cc(F)cc(Br)c2)CC[C@@H]1C(F)(F)F ZINC000629560486 566665513 /nfs/dbraw/zinc/66/55/13/566665513.db2.gz DLJMFUNTSGAEID-YGRLFVJLSA-N 2 1 399.226 3.426 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCOc2cc(F)cc(Br)c2)CC[C@@H]1C(F)(F)F ZINC000629560486 566665522 /nfs/dbraw/zinc/66/55/22/566665522.db2.gz DLJMFUNTSGAEID-YGRLFVJLSA-N 2 1 399.226 3.426 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](CCOc2cc(F)cc(Br)c2)CC[C@H]1C(F)(F)F ZINC000629560485 566666026 /nfs/dbraw/zinc/66/60/26/566666026.db2.gz DLJMFUNTSGAEID-QMTHXVAHSA-N 2 1 399.226 3.426 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCOc2cc(F)cc(Br)c2)CC[C@H]1C(F)(F)F ZINC000629560485 566666031 /nfs/dbraw/zinc/66/60/31/566666031.db2.gz DLJMFUNTSGAEID-QMTHXVAHSA-N 2 1 399.226 3.426 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](CCC(=O)Nc2ccc(Cl)cc2F)CC[C@H]1C(F)(F)F ZINC000629569625 566667095 /nfs/dbraw/zinc/66/70/95/566667095.db2.gz YEJVOVINCWLIDS-ZYHUDNBSSA-N 2 1 381.801 3.267 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc(Cl)cc2F)CC[C@H]1C(F)(F)F ZINC000629569625 566667104 /nfs/dbraw/zinc/66/71/04/566667104.db2.gz YEJVOVINCWLIDS-ZYHUDNBSSA-N 2 1 381.801 3.267 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](CCOc2ccc(Br)cc2)CC[C@H]1C(F)(F)F ZINC000629568159 566667319 /nfs/dbraw/zinc/66/73/19/566667319.db2.gz RUEBHZDREAMORG-SMDDNHRTSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCOc2ccc(Br)cc2)CC[C@H]1C(F)(F)F ZINC000629568159 566667326 /nfs/dbraw/zinc/66/73/26/566667326.db2.gz RUEBHZDREAMORG-SMDDNHRTSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](CCC(=O)Nc2ccc(Cl)cc2F)CC[C@@H]1C(F)(F)F ZINC000629569622 566667517 /nfs/dbraw/zinc/66/75/17/566667517.db2.gz YEJVOVINCWLIDS-JQWIXIFHSA-N 2 1 381.801 3.267 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCC(=O)Nc2ccc(Cl)cc2F)CC[C@@H]1C(F)(F)F ZINC000629569622 566667523 /nfs/dbraw/zinc/66/75/23/566667523.db2.gz YEJVOVINCWLIDS-JQWIXIFHSA-N 2 1 381.801 3.267 20 0 GGADMP O[C@]1(C[NH2+]Cc2ccc(F)c(Br)c2)CC[N@H+](Cc2ccccc2)C1 ZINC000607366215 566669837 /nfs/dbraw/zinc/66/98/37/566669837.db2.gz AYJVGIICRKCDEX-IBGZPJMESA-N 2 1 393.300 3.315 20 0 GGADMP O[C@]1(C[NH2+]Cc2ccc(F)c(Br)c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000607366215 566669839 /nfs/dbraw/zinc/66/98/39/566669839.db2.gz AYJVGIICRKCDEX-IBGZPJMESA-N 2 1 393.300 3.315 20 0 GGADMP C[C@@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc(Br)c1 ZINC000467865020 566672373 /nfs/dbraw/zinc/67/23/73/566672373.db2.gz PTXUGIFWPRVNFL-CQSZACIVSA-N 2 1 382.346 3.042 20 0 GGADMP O[C@H]1CCCC[C@@H]1C[N@@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000580198021 566673322 /nfs/dbraw/zinc/67/33/22/566673322.db2.gz OBMMKGMXPJOJHH-ZBFHGGJFSA-N 2 1 382.302 3.292 20 0 GGADMP CC(C)c1nn(-c2ccc(Br)cc2)cc1C[N@@H+](C)CCOCC[NH3+] ZINC000629665723 566677264 /nfs/dbraw/zinc/67/72/64/566677264.db2.gz OKQLNPCOTXETQV-UHFFFAOYSA-N 2 1 395.345 3.165 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cscc3Cl)c2)C1 ZINC000676415665 566690475 /nfs/dbraw/zinc/69/04/75/566690475.db2.gz GORDJBKGVXUYBM-INIZCTEOSA-N 2 1 377.941 3.389 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cscc3Cl)c2)C1 ZINC000676415665 566690479 /nfs/dbraw/zinc/69/04/79/566690479.db2.gz GORDJBKGVXUYBM-INIZCTEOSA-N 2 1 377.941 3.389 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)Nc1ccccc1Br ZINC000561278916 566690648 /nfs/dbraw/zinc/69/06/48/566690648.db2.gz SYDGIQKEQPCASA-SJORKVTESA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)Nc1ccccc1Br ZINC000561278916 566690655 /nfs/dbraw/zinc/69/06/55/566690655.db2.gz SYDGIQKEQPCASA-SJORKVTESA-N 2 1 380.330 3.384 20 0 GGADMP C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccnc2c(Br)cccc12 ZINC000561356684 566698226 /nfs/dbraw/zinc/69/82/26/566698226.db2.gz XZUBHNHVYCCVKX-KGLIPLIRSA-N 2 1 376.298 3.297 20 0 GGADMP C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccnc2c(Br)cccc12 ZINC000561356685 566698541 /nfs/dbraw/zinc/69/85/41/566698541.db2.gz XZUBHNHVYCCVKX-UONOGXRCSA-N 2 1 376.298 3.297 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000608507945 566722225 /nfs/dbraw/zinc/72/22/25/566722225.db2.gz HDXFSWZQYLDZAQ-GJZGRUSLSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000608507945 566722227 /nfs/dbraw/zinc/72/22/27/566722227.db2.gz HDXFSWZQYLDZAQ-GJZGRUSLSA-N 2 1 375.340 3.397 20 0 GGADMP Brc1ccc([C@H]([NH2+]Cc2nnc(C3CC[NH2+]CC3)[nH]2)C2CC2)cc1 ZINC000581245822 566760073 /nfs/dbraw/zinc/76/00/73/566760073.db2.gz OHSAJZWUTGCKPM-QGZVFWFLSA-N 2 1 390.329 3.275 20 0 GGADMP O=C(NC1CC[NH2+]CC1)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000581299677 566765134 /nfs/dbraw/zinc/76/51/34/566765134.db2.gz ULTLGLCWXYIQEY-UHFFFAOYSA-N 2 1 385.339 3.009 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](CCC[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000581523640 566784526 /nfs/dbraw/zinc/78/45/26/566784526.db2.gz KCTLDZCRPYJNPM-RHSMWYFYSA-N 2 1 381.973 3.444 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000581523640 566784531 /nfs/dbraw/zinc/78/45/31/566784531.db2.gz KCTLDZCRPYJNPM-RHSMWYFYSA-N 2 1 381.973 3.444 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cnc2c(C)cc(Br)cn12 ZINC000542248762 566786640 /nfs/dbraw/zinc/78/66/40/566786640.db2.gz WKEZFDZOAGEZHP-GFCCVEGCSA-N 2 1 376.302 3.336 20 0 GGADMP [NH3+]CCC[N@@H+](CC(=O)Nc1ccc(Br)cc1F)CC1CCCC1 ZINC000489857445 566814736 /nfs/dbraw/zinc/81/47/36/566814736.db2.gz JBRKXXXTZGWKRQ-UHFFFAOYSA-N 2 1 386.309 3.368 20 0 GGADMP [NH3+]CCC[N@H+](CC(=O)Nc1ccc(Br)cc1F)CC1CCCC1 ZINC000489857445 566814742 /nfs/dbraw/zinc/81/47/42/566814742.db2.gz JBRKXXXTZGWKRQ-UHFFFAOYSA-N 2 1 386.309 3.368 20 0 GGADMP [NH3+]CCCOC1CC[NH+](Cc2ccc(OC(F)F)c(Br)c2)CC1 ZINC000469859070 566821757 /nfs/dbraw/zinc/82/17/57/566821757.db2.gz LZJYSBRSSKWMEL-UHFFFAOYSA-N 2 1 393.272 3.380 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3cnn(-c4ccc(Br)cc4)c3)C[C@@H]21 ZINC000469891052 566824773 /nfs/dbraw/zinc/82/47/73/566824773.db2.gz VAMTURZWSWCTEX-FHLIZLRMSA-N 2 1 375.314 3.194 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3cnn(-c4ccc(Br)cc4)c3)C[C@H]21 ZINC000469891056 566824980 /nfs/dbraw/zinc/82/49/80/566824980.db2.gz VAMTURZWSWCTEX-ZTFGCOKTSA-N 2 1 375.314 3.194 20 0 GGADMP Fc1ccc(CC[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1Br ZINC000655702510 566836362 /nfs/dbraw/zinc/83/63/62/566836362.db2.gz ZOBJESURMCCTRJ-INIZCTEOSA-N 2 1 385.321 3.364 20 0 GGADMP COCC[N@H+](C)CCC[NH2+]Cc1cn(-c2ccccc2Br)nc1C ZINC000655712442 566837826 /nfs/dbraw/zinc/83/78/26/566837826.db2.gz NPIJHWVHIFJYKW-UHFFFAOYSA-N 2 1 395.345 3.001 20 0 GGADMP COCC[N@@H+](C)CCC[NH2+]Cc1cn(-c2ccccc2Br)nc1C ZINC000655712442 566837829 /nfs/dbraw/zinc/83/78/29/566837829.db2.gz NPIJHWVHIFJYKW-UHFFFAOYSA-N 2 1 395.345 3.001 20 0 GGADMP Brc1ccccc1C1(C[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)CC1 ZINC000655715542 566838428 /nfs/dbraw/zinc/83/84/28/566838428.db2.gz LGQXLQSTENXQDD-MRXNPFEDSA-N 2 1 379.342 3.324 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2ccc(Br)c3cccnc23)CC1 ZINC000679202193 566840837 /nfs/dbraw/zinc/84/08/37/566840837.db2.gz AGAGFKZCIMYOFZ-UHFFFAOYSA-N 2 1 391.357 3.115 20 0 GGADMP Brc1ccc(OCC[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000655725431 566841250 /nfs/dbraw/zinc/84/12/50/566841250.db2.gz TWIUQINKIQIDKU-SFHVURJKSA-N 2 1 383.330 3.061 20 0 GGADMP Cc1nn(-c2cccc(Br)c2)cc1C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000655733158 566841474 /nfs/dbraw/zinc/84/14/74/566841474.db2.gz JJUCBWAYEHYYRH-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP Cc1nn(-c2cccc(Br)c2)cc1C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000655733158 566841479 /nfs/dbraw/zinc/84/14/79/566841479.db2.gz JJUCBWAYEHYYRH-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@@H](O)COc1cccc(Br)c1 ZINC000562986959 566841554 /nfs/dbraw/zinc/84/15/54/566841554.db2.gz DYFBMXVKLLTGJY-SJLPKXTDSA-N 2 1 399.373 3.433 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C[C@@H](O)COc1cccc(Br)c1 ZINC000562986958 566841979 /nfs/dbraw/zinc/84/19/79/566841979.db2.gz DYFBMXVKLLTGJY-FUHWJXTLSA-N 2 1 399.373 3.433 20 0 GGADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@H](O)COCc2cccs2)[C@@H]1c1cccs1 ZINC000562994569 566842363 /nfs/dbraw/zinc/84/23/63/566842363.db2.gz CBQCAEKRTAYDAB-GPMSIDNRSA-N 2 1 380.579 3.360 20 0 GGADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@@H](O)COCc2cccs2)[C@@H]1c1cccs1 ZINC000562994569 566842369 /nfs/dbraw/zinc/84/23/69/566842369.db2.gz CBQCAEKRTAYDAB-GPMSIDNRSA-N 2 1 380.579 3.360 20 0 GGADMP Cc1nn(-c2ccccc2Br)cc1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000655756797 566844724 /nfs/dbraw/zinc/84/47/24/566844724.db2.gz YMPDJLWDRRKVGL-UHFFFAOYSA-N 2 1 375.314 3.295 20 0 GGADMP Brc1ccc2[nH]c(C[NH2+]C3CC[NH+]([C@@H]4CCOC4)CC3)cc2c1 ZINC000655757036 566845123 /nfs/dbraw/zinc/84/51/23/566845123.db2.gz OCPOBXXDRBLPCA-QGZVFWFLSA-N 2 1 378.314 3.273 20 0 GGADMP Cc1nn(-c2cccc(Br)c2)cc1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000655755667 566845850 /nfs/dbraw/zinc/84/58/50/566845850.db2.gz HUDJWEPNNIDNOB-UHFFFAOYSA-N 2 1 375.314 3.295 20 0 GGADMP COc1ccnc(N2CC[NH+](CCOc3ccc(Br)cc3)CC2)c1 ZINC000517908742 566853204 /nfs/dbraw/zinc/85/32/04/566853204.db2.gz JHCQFGHHFWQSTE-UHFFFAOYSA-N 2 1 392.297 3.054 20 0 GGADMP Clc1cccc(-n2cc(C[N@H+]3CCC[C@@H]([C@@H]4CC[NH2+]C4)C3)nn2)c1Cl ZINC000563136289 566857692 /nfs/dbraw/zinc/85/76/92/566857692.db2.gz XEBGOCLXIYUVTO-ZIAGYGMSSA-N 2 1 380.323 3.396 20 0 GGADMP Clc1cccc(-n2cc(C[N@H+]3CCC[C@@H]([C@H]4CC[NH2+]C4)C3)nn2)c1Cl ZINC000563136288 566858193 /nfs/dbraw/zinc/85/81/93/566858193.db2.gz XEBGOCLXIYUVTO-UONOGXRCSA-N 2 1 380.323 3.396 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCC(=O)Nc2c(Cl)cccc2Cl)CC12CCOCC2 ZINC000563154562 566859881 /nfs/dbraw/zinc/85/98/81/566859881.db2.gz PSGZTOHEUFCGME-ZDUSSCGKSA-N 2 1 386.323 3.009 20 0 GGADMP CCOc1cc(C[N@H+](C)C2CC([NH3+])C2)cc(Br)c1OC(F)F ZINC000582420371 566862225 /nfs/dbraw/zinc/86/22/25/566862225.db2.gz OTYQDAJRWFTAOR-UHFFFAOYSA-N 2 1 379.245 3.371 20 0 GGADMP CCOc1cc(C[N@@H+](C)C2CC([NH3+])C2)cc(Br)c1OC(F)F ZINC000582420371 566862232 /nfs/dbraw/zinc/86/22/32/566862232.db2.gz OTYQDAJRWFTAOR-UHFFFAOYSA-N 2 1 379.245 3.371 20 0 GGADMP COc1c(Br)cc(C[NH2+]CC2([NH3+])CCC2)cc1Br ZINC000563415160 566882065 /nfs/dbraw/zinc/88/20/65/566882065.db2.gz ILXFDHXYWATKDA-UHFFFAOYSA-N 2 1 378.108 3.191 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1Br)[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000582726769 566889822 /nfs/dbraw/zinc/88/98/22/566889822.db2.gz LRFSUVOGBMNCJP-QLFBSQMISA-N 2 1 380.330 3.098 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1Br)[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000582726769 566889829 /nfs/dbraw/zinc/88/98/29/566889829.db2.gz LRFSUVOGBMNCJP-QLFBSQMISA-N 2 1 380.330 3.098 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](Cc2ccc(Br)c3cccnc23)CC12CCOCC2 ZINC000582905610 566905156 /nfs/dbraw/zinc/90/51/56/566905156.db2.gz VRYOPMVAWLMKNZ-HNNXBMFYSA-N 2 1 390.325 3.185 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](Cc2ccc(Br)c3cccnc23)CC12CCOCC2 ZINC000582905610 566905164 /nfs/dbraw/zinc/90/51/64/566905164.db2.gz VRYOPMVAWLMKNZ-HNNXBMFYSA-N 2 1 390.325 3.185 20 0 GGADMP COc1cc(C[NH2+]C[C@@H](C)C[NH+](C)C)cc(Br)c1OC(F)F ZINC000491589118 566911225 /nfs/dbraw/zinc/91/12/25/566911225.db2.gz OARGEXHCMOCRGT-SNVBAGLBSA-N 2 1 381.261 3.346 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)CC[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000680479009 566911291 /nfs/dbraw/zinc/91/12/91/566911291.db2.gz RBWGMAUVHYGINY-CVEARBPZSA-N 2 1 380.330 3.303 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](CCC(=O)Nc2ccccc2Br)C1 ZINC000470961755 566918446 /nfs/dbraw/zinc/91/84/46/566918446.db2.gz YNKBHAJIDQRUOE-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000470961755 566918451 /nfs/dbraw/zinc/91/84/51/566918451.db2.gz YNKBHAJIDQRUOE-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000470961755 566918456 /nfs/dbraw/zinc/91/84/56/566918456.db2.gz YNKBHAJIDQRUOE-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cncc(Br)c1 ZINC000583333390 566940392 /nfs/dbraw/zinc/94/03/92/566940392.db2.gz NSZHFHOCFVMSDL-DOPJRALCSA-N 2 1 382.346 3.263 20 0 GGADMP C[N@H+](CC/C=C\c1ccc(Br)cc1)CCCN1CC[NH+](C)CC1 ZINC000492987569 566941022 /nfs/dbraw/zinc/94/10/22/566941022.db2.gz AAYKKRPTGAGKIL-UTCJRWHESA-N 2 1 380.374 3.422 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cncc(Br)c1 ZINC000583333391 566941529 /nfs/dbraw/zinc/94/15/29/566941529.db2.gz NSZHFHOCFVMSDL-KKXDTOCCSA-N 2 1 382.346 3.263 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](C[NH2+]C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000564078552 566943598 /nfs/dbraw/zinc/94/35/98/566943598.db2.gz SSKXILIFPSBFAQ-GOEBONIOSA-N 2 1 375.340 3.301 20 0 GGADMP O[C@@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)COCc1cccs1 ZINC000564079008 566943695 /nfs/dbraw/zinc/94/36/95/566943695.db2.gz YWIMLJXXEVWRLT-SJORKVTESA-N 2 1 380.579 3.189 20 0 GGADMP O[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)COCc1cccs1 ZINC000564079008 566943702 /nfs/dbraw/zinc/94/37/02/566943702.db2.gz YWIMLJXXEVWRLT-SJORKVTESA-N 2 1 380.579 3.189 20 0 GGADMP O[C@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)COCc1cccs1 ZINC000564079006 566943792 /nfs/dbraw/zinc/94/37/92/566943792.db2.gz YWIMLJXXEVWRLT-IAGOWNOFSA-N 2 1 380.579 3.189 20 0 GGADMP O[C@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)COCc1cccs1 ZINC000564079006 566943796 /nfs/dbraw/zinc/94/37/96/566943796.db2.gz YWIMLJXXEVWRLT-IAGOWNOFSA-N 2 1 380.579 3.189 20 0 GGADMP COCC[NH+]1CCC([NH2+]CCCc2ccc(Br)cc2OC)CC1 ZINC000544375766 566958104 /nfs/dbraw/zinc/95/81/04/566958104.db2.gz KPWYOBAMTFLLBF-UHFFFAOYSA-N 2 1 385.346 3.091 20 0 GGADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000583623330 566969742 /nfs/dbraw/zinc/96/97/42/566969742.db2.gz DRIPIKSJPASQMM-MRXNPFEDSA-N 2 1 396.373 3.106 20 0 GGADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000583623330 566969747 /nfs/dbraw/zinc/96/97/47/566969747.db2.gz DRIPIKSJPASQMM-MRXNPFEDSA-N 2 1 396.373 3.106 20 0 GGADMP CSc1cc(Br)ccc1C[N@@H+]1C[C@H](C[NH3+])C2(C1)CCOCC2 ZINC000583693288 566974214 /nfs/dbraw/zinc/97/42/14/566974214.db2.gz JHQMPJJRWMWDHH-AWEZNQCLSA-N 2 1 385.371 3.358 20 0 GGADMP CSc1cc(Br)ccc1C[N@H+]1C[C@H](C[NH3+])C2(C1)CCOCC2 ZINC000583693288 566974224 /nfs/dbraw/zinc/97/42/24/566974224.db2.gz JHQMPJJRWMWDHH-AWEZNQCLSA-N 2 1 385.371 3.358 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2nnc(C3CC[NH2+]CC3)[nH]2)c2cccc(Br)c21 ZINC000564841025 567012731 /nfs/dbraw/zinc/01/27/31/567012731.db2.gz LSVNCCMDPMJKDH-XHDPSFHLSA-N 2 1 390.329 3.372 20 0 GGADMP O=C(CC[NH+]1CCC([NH2+]CC2CC2)CC1)Nc1ccc(Br)cc1F ZINC000430560866 567020988 /nfs/dbraw/zinc/02/09/88/567020988.db2.gz XVUYFDBRNBUNLE-UHFFFAOYSA-N 2 1 398.320 3.381 20 0 GGADMP O=C(CC[NH+]1CCC([NH2+]CC2CC2)CC1)Nc1ccccc1Br ZINC000430555564 567021535 /nfs/dbraw/zinc/02/15/35/567021535.db2.gz SJWOTTVPAAVGQA-UHFFFAOYSA-N 2 1 380.330 3.242 20 0 GGADMP CC(C)[C@H]([NH3+])CC[N@H+](C)[C@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000430583539 567023083 /nfs/dbraw/zinc/02/30/83/567023083.db2.gz MWKCAYCFBOYRSP-RHSMWYFYSA-N 2 1 384.362 3.101 20 0 GGADMP CC(C)[C@H]([NH3+])CC[N@@H+](C)[C@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000430583539 567023085 /nfs/dbraw/zinc/02/30/85/567023085.db2.gz MWKCAYCFBOYRSP-RHSMWYFYSA-N 2 1 384.362 3.101 20 0 GGADMP C[C@@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@]1(O)CC[N@H+](C)C1 ZINC000545161392 567024312 /nfs/dbraw/zinc/02/43/12/567024312.db2.gz UHGOQFZFVQEEIC-IFXJQAMLSA-N 2 1 393.325 3.026 20 0 GGADMP C[C@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@@]1(O)CC[N@H+](C)C1 ZINC000545161393 567024453 /nfs/dbraw/zinc/02/44/53/567024453.db2.gz UHGOQFZFVQEEIC-KUHUBIRLSA-N 2 1 393.325 3.026 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(OCCC[NH3+])CC1)c1ccc(Cl)cc1Cl ZINC000430599524 567024515 /nfs/dbraw/zinc/02/45/15/567024515.db2.gz VWVLIPQJDFVFIO-ZDUSSCGKSA-N 2 1 388.339 3.000 20 0 GGADMP [NH3+]CCCOC1CC[NH+](Cc2ncc(-c3cccc(Br)c3)o2)CC1 ZINC000430594297 567024969 /nfs/dbraw/zinc/02/49/69/567024969.db2.gz QMUBUFVQISOTLD-UHFFFAOYSA-N 2 1 394.313 3.434 20 0 GGADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469164 567027089 /nfs/dbraw/zinc/02/70/89/567027089.db2.gz HOYJVIDXTINSBH-NVXWUHKLSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469164 567027091 /nfs/dbraw/zinc/02/70/91/567027091.db2.gz HOYJVIDXTINSBH-NVXWUHKLSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469164 567027099 /nfs/dbraw/zinc/02/70/99/567027099.db2.gz HOYJVIDXTINSBH-NVXWUHKLSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469164 567027105 /nfs/dbraw/zinc/02/71/05/567027105.db2.gz HOYJVIDXTINSBH-NVXWUHKLSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492721 567029569 /nfs/dbraw/zinc/02/95/69/567029569.db2.gz CHZHYIDAMIRZGC-NVXWUHKLSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492721 567029577 /nfs/dbraw/zinc/02/95/77/567029577.db2.gz CHZHYIDAMIRZGC-NVXWUHKLSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492721 567029583 /nfs/dbraw/zinc/02/95/83/567029583.db2.gz CHZHYIDAMIRZGC-NVXWUHKLSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492721 567029591 /nfs/dbraw/zinc/02/95/91/567029591.db2.gz CHZHYIDAMIRZGC-NVXWUHKLSA-N 2 1 387.351 3.397 20 0 GGADMP Cc1c(Br)cncc1C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000657398528 567054589 /nfs/dbraw/zinc/05/45/89/567054589.db2.gz CQGJOMRAJUQMCC-QZTJIDSGSA-N 2 1 382.346 3.010 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3cncc(Br)c3C)CC2)nc(C)[nH+]1 ZINC000657390032 567054708 /nfs/dbraw/zinc/05/47/08/567054708.db2.gz RWGOIWMPCLTRND-UHFFFAOYSA-N 2 1 390.329 3.318 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000453106250 567055067 /nfs/dbraw/zinc/05/50/67/567055067.db2.gz YKIIIFQMEGEDGL-FQEVSTJZSA-N 2 1 394.401 3.387 20 0 GGADMP COc1ccc(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c(Br)c1O ZINC000584687564 567061585 /nfs/dbraw/zinc/06/15/85/567061585.db2.gz CZKYRQVXHRNWEH-CQSZACIVSA-N 2 1 383.330 3.327 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@@H](Cc2ccccc2Br)C2CC2)CC1(C)C ZINC000453226432 567065787 /nfs/dbraw/zinc/06/57/87/567065787.db2.gz VHARDIUNPNGPIG-IBGZPJMESA-N 2 1 394.401 3.386 20 0 GGADMP Brc1ccc2[nH]cc(CC[NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCC[NH2+]3)c2c1 ZINC000584840298 567075081 /nfs/dbraw/zinc/07/50/81/567075081.db2.gz VGBCLPOTGNQFCU-WDYCEAGBSA-N 2 1 392.341 3.220 20 0 GGADMP Brc1ccc2[nH]cc(CC[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)c2c1 ZINC000584840296 567076341 /nfs/dbraw/zinc/07/63/41/567076341.db2.gz VGBCLPOTGNQFCU-SUMDDJOVSA-N 2 1 392.341 3.220 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H](CO)Cc1ccc(F)c(Br)c1 ZINC000453336296 567076674 /nfs/dbraw/zinc/07/66/74/567076674.db2.gz ALTICLYBEBGOCY-ACXGAUJLSA-N 2 1 387.337 3.058 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000453345320 567078450 /nfs/dbraw/zinc/07/84/50/567078450.db2.gz FFJWOQRCWBNISJ-GTACMHHNSA-N 2 1 383.374 3.227 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H](CO)Cc1cc(Br)ccc1F ZINC000453370231 567082067 /nfs/dbraw/zinc/08/20/67/567082067.db2.gz NEIWSEXNFMERCB-UHQDVWGKSA-N 2 1 387.337 3.058 20 0 GGADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000453404738 567087214 /nfs/dbraw/zinc/08/72/14/567087214.db2.gz PPWYOOCVYDVBLK-NSHDSACASA-N 2 1 394.368 3.166 20 0 GGADMP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000522001173 567092723 /nfs/dbraw/zinc/09/27/23/567092723.db2.gz HNHOEDNPEXMZIE-UKRRQHHQSA-N 2 1 375.314 3.465 20 0 GGADMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000522001173 567092735 /nfs/dbraw/zinc/09/27/35/567092735.db2.gz HNHOEDNPEXMZIE-UKRRQHHQSA-N 2 1 375.314 3.465 20 0 GGADMP Brc1cccc2c(C[NH2+]C3CC[NH+]([C@@H]4CCOC4)CC3)ccnc12 ZINC000657752776 567093175 /nfs/dbraw/zinc/09/31/75/567093175.db2.gz QYIZXHFVGSQZDT-MRXNPFEDSA-N 2 1 390.325 3.340 20 0 GGADMP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000522001171 567093752 /nfs/dbraw/zinc/09/37/52/567093752.db2.gz HNHOEDNPEXMZIE-HIFRSBDPSA-N 2 1 375.314 3.465 20 0 GGADMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000522001171 567093756 /nfs/dbraw/zinc/09/37/56/567093756.db2.gz HNHOEDNPEXMZIE-HIFRSBDPSA-N 2 1 375.314 3.465 20 0 GGADMP CC(C)[C@H](Cc1ccc(Br)cc1)[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000657845517 567100692 /nfs/dbraw/zinc/10/06/92/567100692.db2.gz LQZYBQBZGRGYRJ-IBGZPJMESA-N 2 1 383.374 3.453 20 0 GGADMP CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000565834279 567104816 /nfs/dbraw/zinc/10/48/16/567104816.db2.gz DTYKUCAZSXKNHS-JKSUJKDBSA-N 2 1 384.351 3.273 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1)c1ccc(Cl)c(Cl)c1 ZINC000566245415 567141996 /nfs/dbraw/zinc/14/19/96/567141996.db2.gz QSOWUFCSBDIARL-IMJJTQAJSA-N 2 1 384.351 3.492 20 0 GGADMP CC(C)[N@H+](C)CCC[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000474367931 567164250 /nfs/dbraw/zinc/16/42/50/567164250.db2.gz RDGFNCMMFNHCJU-UHFFFAOYSA-N 2 1 384.362 3.106 20 0 GGADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000474367931 567164254 /nfs/dbraw/zinc/16/42/54/567164254.db2.gz RDGFNCMMFNHCJU-UHFFFAOYSA-N 2 1 384.362 3.106 20 0 GGADMP C[NH+](C)CC1CC[NH+](Cc2nc(-c3cc(Br)cs3)no2)CC1 ZINC000590125656 567209354 /nfs/dbraw/zinc/20/93/54/567209354.db2.gz ZPCCAYIMNNTMSQ-UHFFFAOYSA-N 2 1 385.331 3.334 20 0 GGADMP CN(CC(C)(C)[NH3+])C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000659479498 567217301 /nfs/dbraw/zinc/21/73/01/567217301.db2.gz KKWALHYRPWBGFC-UHFFFAOYSA-N 2 1 387.355 3.337 20 0 GGADMP O[C@H](C[NH2+][C@@H]1CCCc2c3cc(Br)ccc3[nH]c21)C[NH+]1CCCC1 ZINC000567307645 567234664 /nfs/dbraw/zinc/23/46/64/567234664.db2.gz OAMONHRGHVLORG-RDTXWAMCSA-N 2 1 392.341 3.354 20 0 GGADMP O=C(C[NH+]1CCC(c2c[nH]cn2)CC1)c1c[nH]c2ncc(Br)cc12 ZINC000660095335 567259488 /nfs/dbraw/zinc/25/94/88/567259488.db2.gz OSTZCIBPHYAFCL-UHFFFAOYSA-N 2 1 388.269 3.111 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000567678076 567266531 /nfs/dbraw/zinc/26/65/31/567266531.db2.gz JJTHFIRGTOIYSK-FUHWJXTLSA-N 2 1 399.373 3.291 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000567688811 567266866 /nfs/dbraw/zinc/26/68/66/567266866.db2.gz ZSRZVURPJKLFIA-FUHWJXTLSA-N 2 1 399.373 3.146 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000567688812 567267842 /nfs/dbraw/zinc/26/78/42/567267842.db2.gz ZSRZVURPJKLFIA-SJLPKXTDSA-N 2 1 399.373 3.146 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000567681649 567267981 /nfs/dbraw/zinc/26/79/81/567267981.db2.gz XWIXNWSGYYWQSJ-ZBFHGGJFSA-N 2 1 375.340 3.443 20 0 GGADMP C[C@H]1C[C@H]1C[N@@H+](CCN1CC[NH+](C)CC1)Cc1ccc(Br)cc1F ZINC000685469247 567278516 /nfs/dbraw/zinc/27/85/16/567278516.db2.gz UBQVVNFLLKIONF-RDJZCZTQSA-N 2 1 398.364 3.294 20 0 GGADMP Cc1cc(Br)cn2c(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)cnc12 ZINC000567871112 567286134 /nfs/dbraw/zinc/28/61/34/567286134.db2.gz QMICBCRHGZXERJ-HNNXBMFYSA-N 2 1 377.330 3.227 20 0 GGADMP CC(C)(O)C[NH+]1CCC([NH2+][C@H](CCO)c2cc(Cl)cc(Cl)c2)CC1 ZINC000639356447 567304455 /nfs/dbraw/zinc/30/44/55/567304455.db2.gz JLPYJSVOWILFMW-QGZVFWFLSA-N 2 1 375.340 3.242 20 0 GGADMP CC[C@H]([NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1)c1ccc(Br)cc1 ZINC000568102295 567304854 /nfs/dbraw/zinc/30/48/54/567304854.db2.gz HAUTVYPUQWJEAG-HNNXBMFYSA-N 2 1 378.318 3.275 20 0 GGADMP CN(CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)c1ccc(Br)cn1 ZINC000500693564 567339606 /nfs/dbraw/zinc/33/96/06/567339606.db2.gz DWXLPKDBPVSBQZ-UHFFFAOYSA-N 2 1 395.389 3.477 20 0 GGADMP Clc1ccc(-n2cc(C[N@H+]3CCC[C@@H]([C@H]4CC[NH2+]C4)C3)nn2)cc1Cl ZINC000568628683 567344858 /nfs/dbraw/zinc/34/48/58/567344858.db2.gz VFKLXGDSIFVCPG-UONOGXRCSA-N 2 1 380.323 3.396 20 0 GGADMP COc1ccc(Br)cc1C[N@@H+](C)CCCN1CC[NH+](C(C)C)CC1 ZINC000500979147 567357690 /nfs/dbraw/zinc/35/76/90/567357690.db2.gz BBDUHNWSZQSKST-UHFFFAOYSA-N 2 1 398.389 3.306 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000435377935 567357998 /nfs/dbraw/zinc/35/79/98/567357998.db2.gz BHZDBUYBKXHPEO-DOMZBBRYSA-N 2 1 377.330 3.421 20 0 GGADMP OCC[NH2+]C1CCN(c2cc(C3CC3)[nH+]c3c(Br)cccc23)CC1 ZINC000568820627 567359258 /nfs/dbraw/zinc/35/92/58/567359258.db2.gz DNTBDOVYDQFSEH-UHFFFAOYSA-N 2 1 390.325 3.425 20 0 GGADMP C[NH2+]C[C@@H]1CC[N@H+](Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000435387170 567359638 /nfs/dbraw/zinc/35/96/38/567359638.db2.gz XSUNNWJSOPDLIF-HNNXBMFYSA-N 2 1 377.330 3.293 20 0 GGADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000435387170 567359645 /nfs/dbraw/zinc/35/96/45/567359645.db2.gz XSUNNWJSOPDLIF-HNNXBMFYSA-N 2 1 377.330 3.293 20 0 GGADMP [NH3+]C1CC[NH+](CCc2cn(Cc3sc4ccccc4c3Cl)nn2)CC1 ZINC000640896079 567401518 /nfs/dbraw/zinc/40/15/18/567401518.db2.gz YXSPPNSVLKJLNG-UHFFFAOYSA-N 2 1 375.929 3.160 20 0 GGADMP C[C@@H]1C[N@H+](CCC[NH2+][C@@H]2CCc3cccc(Br)c3C2)CCCO1 ZINC000549816779 567412479 /nfs/dbraw/zinc/41/24/79/567412479.db2.gz ZMMKMHDJGDRQKU-NVXWUHKLSA-N 2 1 381.358 3.397 20 0 GGADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H]2CCc3cccc(Br)c3C2)CCCO1 ZINC000549816779 567412487 /nfs/dbraw/zinc/41/24/87/567412487.db2.gz ZMMKMHDJGDRQKU-NVXWUHKLSA-N 2 1 381.358 3.397 20 0 GGADMP [NH3+]CCC(=O)NC[C@@H]1CCCC[N@@H+]1Cc1oc2ccccc2c1Br ZINC000662270715 567423675 /nfs/dbraw/zinc/42/36/75/567423675.db2.gz CIWKLVFETSXLNX-ZDUSSCGKSA-N 2 1 394.313 3.015 20 0 GGADMP [NH3+]CCC(=O)NC[C@@H]1CCCC[N@H+]1Cc1oc2ccccc2c1Br ZINC000662270715 567423680 /nfs/dbraw/zinc/42/36/80/567423680.db2.gz CIWKLVFETSXLNX-ZDUSSCGKSA-N 2 1 394.313 3.015 20 0 GGADMP O=C(C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1)Nc1ccc(Br)cc1 ZINC000662290268 567426000 /nfs/dbraw/zinc/42/60/00/567426000.db2.gz OJRNXONOCKYLFQ-OAHLLOKOSA-N 2 1 380.330 3.099 20 0 GGADMP C[C@@H]1CCC[N@H+](CCCCNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662387140 567431833 /nfs/dbraw/zinc/43/18/33/567431833.db2.gz BUVXMDXIZHNGQO-RHSMWYFYSA-N 2 1 382.346 3.077 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662387140 567431837 /nfs/dbraw/zinc/43/18/37/567431837.db2.gz BUVXMDXIZHNGQO-RHSMWYFYSA-N 2 1 382.346 3.077 20 0 GGADMP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)[C@H]([NH3+])c1ccccc1Br ZINC000662390133 567432651 /nfs/dbraw/zinc/43/26/51/567432651.db2.gz WEHUXYXJTLNNLM-WMLDXEAASA-N 2 1 382.346 3.220 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)[C@H]([NH3+])c1ccccc1Br ZINC000662390133 567432660 /nfs/dbraw/zinc/43/26/60/567432660.db2.gz WEHUXYXJTLNNLM-WMLDXEAASA-N 2 1 382.346 3.220 20 0 GGADMP CC(C)[N@H+](C)CC1CCN(C(=O)[C@H]([NH3+])c2ccccc2Br)CC1 ZINC000662400821 567432974 /nfs/dbraw/zinc/43/29/74/567432974.db2.gz FJVIGOKELMYPCM-QGZVFWFLSA-N 2 1 382.346 3.028 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)[C@H]([NH3+])c2ccccc2Br)CC1 ZINC000662400821 567432980 /nfs/dbraw/zinc/43/29/80/567432980.db2.gz FJVIGOKELMYPCM-QGZVFWFLSA-N 2 1 382.346 3.028 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)c1ccc(F)cc1 ZINC000662396440 567433059 /nfs/dbraw/zinc/43/30/59/567433059.db2.gz BDRDFTNEZRXPGL-SJORKVTESA-N 2 1 394.288 3.007 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)[C@@H]([NH3+])c2ccccc2Br)cc1 ZINC000662398845 567433119 /nfs/dbraw/zinc/43/31/19/567433119.db2.gz JQIBKEITNUMSJU-KRWDZBQOSA-N 2 1 392.297 3.028 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)[C@H]([NH3+])c1ccccc1Br ZINC000662390132 567433346 /nfs/dbraw/zinc/43/33/46/567433346.db2.gz WEHUXYXJTLNNLM-RHSMWYFYSA-N 2 1 382.346 3.220 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)[C@H]([NH3+])c1ccccc1Br ZINC000662390132 567433352 /nfs/dbraw/zinc/43/33/52/567433352.db2.gz WEHUXYXJTLNNLM-RHSMWYFYSA-N 2 1 382.346 3.220 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)[C@@H]([NH3+])c1ccccc1Br ZINC000662390131 567433594 /nfs/dbraw/zinc/43/35/94/567433594.db2.gz WEHUXYXJTLNNLM-PBHICJAKSA-N 2 1 382.346 3.220 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)[C@@H]([NH3+])c1ccccc1Br ZINC000662390131 567433599 /nfs/dbraw/zinc/43/35/99/567433599.db2.gz WEHUXYXJTLNNLM-PBHICJAKSA-N 2 1 382.346 3.220 20 0 GGADMP CC(C)c1ccc([C@H]([NH3+])CNC(=O)[C@@H]([NH3+])c2ccccc2Br)cc1 ZINC000662410141 567435109 /nfs/dbraw/zinc/43/51/09/567435109.db2.gz HLVRNSRSUTUBKY-MSOLQXFVSA-N 2 1 390.325 3.389 20 0 GGADMP CC(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@@H]([NH3+])c2ccccc2Br)cc1 ZINC000662410143 567435117 /nfs/dbraw/zinc/43/51/17/567435117.db2.gz HLVRNSRSUTUBKY-ROUUACIJSA-N 2 1 390.325 3.389 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)[C@H]([NH3+])c2ccccc2Br)[NH+](C)C)cc1 ZINC000662417915 567435127 /nfs/dbraw/zinc/43/51/27/567435127.db2.gz OJDAECKKYQLPRA-QZTJIDSGSA-N 2 1 390.325 3.176 20 0 GGADMP C[C@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)[N@H+](C)Cc1ccccc1 ZINC000662454475 567437847 /nfs/dbraw/zinc/43/78/47/567437847.db2.gz NZHVZBINUITWRH-RDTXWAMCSA-N 2 1 390.325 3.086 20 0 GGADMP C[C@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)[N@@H+](C)Cc1ccccc1 ZINC000662454475 567437850 /nfs/dbraw/zinc/43/78/50/567437850.db2.gz NZHVZBINUITWRH-RDTXWAMCSA-N 2 1 390.325 3.086 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)c2cc3c(s2)CC[NH2+]C3)[C@H]1c1cccs1 ZINC000662474177 567439749 /nfs/dbraw/zinc/43/97/49/567439749.db2.gz UBOUFBWPEBGTDC-UGSOOPFHSA-N 2 1 375.563 3.268 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)[C@H]([NH3+])c2ccccc2Br)CC1 ZINC000662464814 567440069 /nfs/dbraw/zinc/44/00/69/567440069.db2.gz SJGBRAKZWXKXIR-GOSISDBHSA-N 2 1 396.373 3.419 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)[C@H]([NH3+])c2ccccc2Br)CC1 ZINC000662464814 567440071 /nfs/dbraw/zinc/44/00/71/567440071.db2.gz SJGBRAKZWXKXIR-GOSISDBHSA-N 2 1 396.373 3.419 20 0 GGADMP Cc1cc(C[NH+](C)C)cc(NC(=O)[C@H]([NH3+])c2ccccc2Br)c1 ZINC000662508458 567443440 /nfs/dbraw/zinc/44/34/40/567443440.db2.gz BCKTUWKROGAJKO-QGZVFWFLSA-N 2 1 376.298 3.458 20 0 GGADMP C[NH2+][C@H](C(=O)Nc1nc2c(s1)C[C@@H]([NH3+])CC2)c1cccc(Cl)c1Cl ZINC000662519360 567444732 /nfs/dbraw/zinc/44/47/32/567444732.db2.gz TVTAHSYRKVFPKM-RTHLEPHNSA-N 2 1 385.320 3.165 20 0 GGADMP CC[N@@H+](CCN1CC[NH2+]CC1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000569971859 567447618 /nfs/dbraw/zinc/44/76/18/567447618.db2.gz JAMZPLWIBQSPTC-MRXNPFEDSA-N 2 1 384.387 3.213 20 0 GGADMP C[NH2+][C@@H](C(=O)N1CCC([C@@H]2[NH2+]CC2(C)C)CC1)c1cccc(Cl)c1Cl ZINC000662578008 567450601 /nfs/dbraw/zinc/45/06/01/567450601.db2.gz OMZKNIUHGAMYKB-SJORKVTESA-N 2 1 384.351 3.491 20 0 GGADMP C[NH2+][C@@H](C(=O)N1CCC([C@H]2[NH2+]CC2(C)C)CC1)c1cccc(Cl)c1Cl ZINC000662578006 567451060 /nfs/dbraw/zinc/45/10/60/567451060.db2.gz OMZKNIUHGAMYKB-IAGOWNOFSA-N 2 1 384.351 3.491 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C[C@H](O)COc1ccc(Br)cc1 ZINC000570037151 567454330 /nfs/dbraw/zinc/45/43/30/567454330.db2.gz OPRACTDWSJYHTB-WMZOPIPTSA-N 2 1 399.373 3.433 20 0 GGADMP C[C@@H]1CCSCC[N@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000502842381 567457507 /nfs/dbraw/zinc/45/75/07/567457507.db2.gz MWLGUPHDNIPEFD-MRXNPFEDSA-N 2 1 379.595 3.001 20 0 GGADMP C[NH+](C)CCc1ccc(NC(=O)[C@@H]([NH3+])c2ccccc2Br)cc1 ZINC000662703375 567458051 /nfs/dbraw/zinc/45/80/51/567458051.db2.gz HEPNXWBVORDXTB-KRWDZBQOSA-N 2 1 376.298 3.192 20 0 GGADMP C[N@@H+]1CC[C@H]([NH2+]CCCn2cc(Br)cn2)C[C@H]1c1ccccc1 ZINC000550818272 567463098 /nfs/dbraw/zinc/46/30/98/567463098.db2.gz JLZVBSGLULJBIF-ROUUACIJSA-N 2 1 377.330 3.461 20 0 GGADMP C[N@H+]1CC[C@H]([NH2+]CCCn2cc(Br)cn2)C[C@H]1c1ccccc1 ZINC000550818272 567463103 /nfs/dbraw/zinc/46/31/03/567463103.db2.gz JLZVBSGLULJBIF-ROUUACIJSA-N 2 1 377.330 3.461 20 0 GGADMP C[NH2+][C@@H](C(=O)NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000663002140 567473329 /nfs/dbraw/zinc/47/33/29/567473329.db2.gz CCNQFOCWZJYOPL-KBXCAEBGSA-N 2 1 384.351 3.492 20 0 GGADMP C[NH2+][C@@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000663002140 567473334 /nfs/dbraw/zinc/47/33/34/567473334.db2.gz CCNQFOCWZJYOPL-KBXCAEBGSA-N 2 1 384.351 3.492 20 0 GGADMP C[NH+]1CCC(O)(C[NH2+][C@H](c2ccc(Br)o2)c2ccc(F)cc2)CC1 ZINC000551051293 567476075 /nfs/dbraw/zinc/47/60/75/567476075.db2.gz LVEHWVROYAWRLM-KRWDZBQOSA-N 2 1 397.288 3.317 20 0 GGADMP [NH3+]Cc1cn([C@H]2CCC[N@@H+](CCSc3cc(Cl)ccc3Cl)C2)nn1 ZINC000570383779 567480408 /nfs/dbraw/zinc/48/04/08/567480408.db2.gz DAHASOHKBVSXND-AWEZNQCLSA-N 2 1 386.352 3.473 20 0 GGADMP C[NH+](C)CCOCC[NH2+][C@@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000551175080 567484240 /nfs/dbraw/zinc/48/42/40/567484240.db2.gz GZAJEPGZMQAKPG-QGZVFWFLSA-N 2 1 385.277 3.438 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)Nc1cccc(Br)c1 ZINC000643061753 567492007 /nfs/dbraw/zinc/49/20/07/567492007.db2.gz SPWAFXQMVGIWRR-DLBZAZTESA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)Nc1cccc(Br)c1 ZINC000643061753 567492013 /nfs/dbraw/zinc/49/20/13/567492013.db2.gz SPWAFXQMVGIWRR-DLBZAZTESA-N 2 1 380.330 3.384 20 0 GGADMP C[C@@H]1C[NH+](CCCNc2cc[nH+]c3ccc(Br)cc23)C[C@@H](C)O1 ZINC000503568778 567494984 /nfs/dbraw/zinc/49/49/84/567494984.db2.gz JFYROZASNRXYOE-ZIAGYGMSSA-N 2 1 378.314 3.330 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+][C@@H]2CCCc3cc(Br)ccc32)C1 ZINC000479061471 567499052 /nfs/dbraw/zinc/49/90/52/567499052.db2.gz NTLUCUHDBMJBTB-MAUKXSAKSA-N 2 1 394.357 3.004 20 0 GGADMP O[C@H](C[NH2+][C@H]1CCCSc2ccc(Br)cc21)C[NH+]1CCCC1 ZINC000663438447 567509127 /nfs/dbraw/zinc/50/91/27/567509127.db2.gz ICIOPFNVQMKRIF-ZBFHGGJFSA-N 2 1 385.371 3.422 20 0 GGADMP O[C@H](C[NH2+][C@@H]1CCCSc2ccc(Br)cc21)C[NH+]1CCCC1 ZINC000663438443 567509189 /nfs/dbraw/zinc/50/91/89/567509189.db2.gz ICIOPFNVQMKRIF-GDBMZVCRSA-N 2 1 385.371 3.422 20 0 GGADMP C[C@H](O)C[NH+]1CCC(C[N@H+](C)Cc2ncc(Cl)cc2Br)CC1 ZINC000529532264 567527357 /nfs/dbraw/zinc/52/73/57/567527357.db2.gz XPSDNTUDIGQINC-LBPRGKRZSA-N 2 1 390.753 3.022 20 0 GGADMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ncc(Cl)cc2Br)CC1 ZINC000529532264 567527363 /nfs/dbraw/zinc/52/73/63/567527363.db2.gz XPSDNTUDIGQINC-LBPRGKRZSA-N 2 1 390.753 3.022 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CC2 ZINC000595003436 567534070 /nfs/dbraw/zinc/53/40/70/567534070.db2.gz GPXDFZYGDRQITN-QGZVFWFLSA-N 2 1 382.289 3.495 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CC2 ZINC000595008521 567534437 /nfs/dbraw/zinc/53/44/37/567534437.db2.gz UTWRFRZZEJBLGD-SJKOYZFVSA-N 2 1 382.289 3.352 20 0 GGADMP Brc1ccc(-c2noc(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)n2)s1 ZINC000571209399 567546866 /nfs/dbraw/zinc/54/68/66/567546866.db2.gz WKCFXYKWBCJBHD-LBPRGKRZSA-N 2 1 397.342 3.382 20 0 GGADMP C[N@@H+](Cc1ccccc1)C[C@@H](O)C[NH2+]CCc1ccccc1Br ZINC000644532479 567557022 /nfs/dbraw/zinc/55/70/22/567557022.db2.gz ULSZLCGAAYSNDN-SFHVURJKSA-N 2 1 377.326 3.074 20 0 GGADMP C[N@H+](Cc1ccccc1)C[C@@H](O)C[NH2+]CCc1ccccc1Br ZINC000644532479 567557024 /nfs/dbraw/zinc/55/70/24/567557024.db2.gz ULSZLCGAAYSNDN-SFHVURJKSA-N 2 1 377.326 3.074 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](C[NH2+]C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000644588777 567561208 /nfs/dbraw/zinc/56/12/08/567561208.db2.gz UBQNWKYCSQRVAV-GJZGRUSLSA-N 2 1 375.340 3.301 20 0 GGADMP C[N@@H+](Cc1ccccc1)C[C@@H](O)C[NH2+]CCc1cccc(Br)c1 ZINC000644667141 567569307 /nfs/dbraw/zinc/56/93/07/567569307.db2.gz ABZCCZXRPHADIK-IBGZPJMESA-N 2 1 377.326 3.074 20 0 GGADMP C[N@H+](Cc1ccccc1)C[C@@H](O)C[NH2+]CCc1cccc(Br)c1 ZINC000644667141 567569316 /nfs/dbraw/zinc/56/93/16/567569316.db2.gz ABZCCZXRPHADIK-IBGZPJMESA-N 2 1 377.326 3.074 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Cc1cc(Cl)ccc1Cl ZINC000505789904 567597244 /nfs/dbraw/zinc/59/72/44/567597244.db2.gz NOKDDQXBTLHXSN-QGZVFWFLSA-N 2 1 386.367 3.410 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+][C@@H]1CCCOc2ccc(I)cc21 ZINC000530460336 567603615 /nfs/dbraw/zinc/60/36/15/567603615.db2.gz MLXUSIUDTGDYPH-OAHLLOKOSA-N 2 1 397.260 3.071 20 0 GGADMP C[C@H]1CCc2ccc(Br)cc2[C@H]([NH2+]Cc2nc(C[NH3+])cc(=O)[nH]2)C1 ZINC000665292482 567617155 /nfs/dbraw/zinc/61/71/55/567617155.db2.gz AVFGBXMSQWRGHD-MEDUHNTESA-N 2 1 391.313 3.207 20 0 GGADMP Oc1cccc(CNCc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1Br ZINC000459472792 567627130 /nfs/dbraw/zinc/62/71/30/567627130.db2.gz WIDNNPBKIIXTGA-QGZVFWFLSA-N 2 1 391.309 3.011 20 0 GGADMP Oc1cccc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)c1Br ZINC000459472792 567627136 /nfs/dbraw/zinc/62/71/36/567627136.db2.gz WIDNNPBKIIXTGA-QGZVFWFLSA-N 2 1 391.309 3.011 20 0 GGADMP Oc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1Br ZINC000459472792 567627141 /nfs/dbraw/zinc/62/71/41/567627141.db2.gz WIDNNPBKIIXTGA-QGZVFWFLSA-N 2 1 391.309 3.011 20 0 GGADMP Oc1cccc(CNCc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1Br ZINC000459472789 567627648 /nfs/dbraw/zinc/62/76/48/567627648.db2.gz WIDNNPBKIIXTGA-KRWDZBQOSA-N 2 1 391.309 3.011 20 0 GGADMP Oc1cccc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)c1Br ZINC000459472789 567627653 /nfs/dbraw/zinc/62/76/53/567627653.db2.gz WIDNNPBKIIXTGA-KRWDZBQOSA-N 2 1 391.309 3.011 20 0 GGADMP Oc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1Br ZINC000459472789 567627656 /nfs/dbraw/zinc/62/76/56/567627656.db2.gz WIDNNPBKIIXTGA-KRWDZBQOSA-N 2 1 391.309 3.011 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)[C@@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000645515965 567637007 /nfs/dbraw/zinc/63/70/07/567637007.db2.gz GCRHQBUYYJJYDH-KXBFYZLASA-N 2 1 396.373 3.251 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459728089 567655298 /nfs/dbraw/zinc/65/52/98/567655298.db2.gz CRIAUANOSYYGJG-CABCVRRESA-N 2 1 382.346 3.488 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459728091 567655312 /nfs/dbraw/zinc/65/53/12/567655312.db2.gz CRIAUANOSYYGJG-HUUCEWRRSA-N 2 1 382.346 3.488 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2CCOc1ccc(Br)cc1 ZINC000441250270 567657841 /nfs/dbraw/zinc/65/78/41/567657841.db2.gz YQLDKVPWUUFGMY-BPQIPLTHSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2CCOc1ccc(Br)cc1 ZINC000441250270 567657845 /nfs/dbraw/zinc/65/78/45/567657845.db2.gz YQLDKVPWUUFGMY-BPQIPLTHSA-N 2 1 383.330 3.011 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459777239 567658077 /nfs/dbraw/zinc/65/80/77/567658077.db2.gz KIVPULNNHNFDLD-LSDHHAIUSA-N 2 1 382.346 3.488 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2CCOc1ccc(Br)cc1 ZINC000441250272 567658237 /nfs/dbraw/zinc/65/82/37/567658237.db2.gz YQLDKVPWUUFGMY-NJAFHUGGSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2CCOc1ccc(Br)cc1 ZINC000441250272 567658243 /nfs/dbraw/zinc/65/82/43/567658243.db2.gz YQLDKVPWUUFGMY-NJAFHUGGSA-N 2 1 383.330 3.011 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc1OC ZINC000572763217 567662433 /nfs/dbraw/zinc/66/24/33/567662433.db2.gz TXEHPXYAUJTQPP-UONOGXRCSA-N 2 1 383.330 3.288 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc1OC ZINC000572763218 567663378 /nfs/dbraw/zinc/66/33/78/567663378.db2.gz TXEHPXYAUJTQPP-ZIAGYGMSSA-N 2 1 383.330 3.288 20 0 GGADMP Cc1nc2c(s1)[C@@H]([NH2+]C[C@@H](c1cccs1)N1CC[NH+](C)CC1)CCC2 ZINC000531676933 567673109 /nfs/dbraw/zinc/67/31/09/567673109.db2.gz TVCQFDFMRKERNS-RDJZCZTQSA-N 2 1 376.595 3.469 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000531937206 567690024 /nfs/dbraw/zinc/69/00/24/567690024.db2.gz MFEUFGBWQFWYPI-COXVUDFISA-N 2 1 380.330 3.383 20 0 GGADMP C[NH+]1CCC2(CC1)C[N@@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)CCO2 ZINC000646104902 567695341 /nfs/dbraw/zinc/69/53/41/567695341.db2.gz VAOIUKYYLYFJFF-UHFFFAOYSA-N 2 1 386.323 3.119 20 0 GGADMP Brc1ccc(-c2noc(C[N@H+]3CCC[C@H]([C@@H]4CC[NH2+]C4)C3)n2)s1 ZINC000573207340 567696406 /nfs/dbraw/zinc/69/64/06/567696406.db2.gz NQVJDVHDXVPOGD-NEPJUHHUSA-N 2 1 397.342 3.382 20 0 GGADMP COc1cc(C[NH2+]C[C@H](c2cccs2)N2CC[NH+](C)CC2)ccc1Cl ZINC000623335797 567701850 /nfs/dbraw/zinc/70/18/50/567701850.db2.gz FBKCYNFEEGJPCY-QGZVFWFLSA-N 2 1 379.957 3.488 20 0 GGADMP COc1cc(C[NH2+]C[C@@H](c2cccs2)N2CC[NH+](C)CC2)ccc1Cl ZINC000623335796 567702085 /nfs/dbraw/zinc/70/20/85/567702085.db2.gz FBKCYNFEEGJPCY-KRWDZBQOSA-N 2 1 379.957 3.488 20 0 GGADMP Cc1cc(Br)ccc1C(=O)N1CCC([NH2+]C[C@H]2CCCC[NH2+]2)CC1 ZINC000666770402 567703612 /nfs/dbraw/zinc/70/36/12/567703612.db2.gz YSTUZVPZLTXQEU-QGZVFWFLSA-N 2 1 394.357 3.094 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]Cc1ccc(Br)c(F)c1F ZINC000623412662 567707180 /nfs/dbraw/zinc/70/71/80/567707180.db2.gz UWNQMJAEEDWVPU-ZDUSSCGKSA-N 2 1 377.273 3.054 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]Cc1ccc(Br)c(F)c1F ZINC000623412661 567707460 /nfs/dbraw/zinc/70/74/60/567707460.db2.gz UWNQMJAEEDWVPU-CYBMUJFWSA-N 2 1 377.273 3.054 20 0 GGADMP COc1c(Br)cc(Br)cc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666855173 567707902 /nfs/dbraw/zinc/70/79/02/567707902.db2.gz BVNSOZQNXGCLHT-LBPRGKRZSA-N 2 1 392.135 3.452 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@H]2CCCc3ccc(Br)cc32)CC1(C)C ZINC000442866626 567713937 /nfs/dbraw/zinc/71/39/37/567713937.db2.gz ITJUMNIAWWOZLW-SFHVURJKSA-N 2 1 380.374 3.442 20 0 GGADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)ncc1Br ZINC000623488056 567714003 /nfs/dbraw/zinc/71/40/03/567714003.db2.gz GIWNPNCXPRBFSR-SFHVURJKSA-N 2 1 390.325 3.009 20 0 GGADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)ncc1Br ZINC000623488056 567714011 /nfs/dbraw/zinc/71/40/11/567714011.db2.gz GIWNPNCXPRBFSR-SFHVURJKSA-N 2 1 390.325 3.009 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@@H]2CCc3c2cc(Br)cc3F)CC1(C)C ZINC000442871140 567714559 /nfs/dbraw/zinc/71/45/59/567714559.db2.gz HFEZKNLHIITNMQ-QGZVFWFLSA-N 2 1 384.337 3.191 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@@H]2CCCc3c(Br)cccc32)CC1(C)C ZINC000442872538 567714673 /nfs/dbraw/zinc/71/46/73/567714673.db2.gz JRZNMYMEUDFZFG-GOSISDBHSA-N 2 1 380.374 3.442 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@@H]2CCCc3ccc(Br)cc32)CC1(C)C ZINC000442866625 567714748 /nfs/dbraw/zinc/71/47/48/567714748.db2.gz ITJUMNIAWWOZLW-GOSISDBHSA-N 2 1 380.374 3.442 20 0 GGADMP [NH3+]CC[C@@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000442925340 567717428 /nfs/dbraw/zinc/71/74/28/567717428.db2.gz VABDUGKASGAYET-AWEZNQCLSA-N 2 1 388.293 3.121 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000573906596 567743505 /nfs/dbraw/zinc/74/35/05/567743505.db2.gz FUYZYNRZULFGTC-SJORKVTESA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000573906596 567743510 /nfs/dbraw/zinc/74/35/10/567743510.db2.gz FUYZYNRZULFGTC-SJORKVTESA-N 2 1 380.330 3.384 20 0 GGADMP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000624121224 567760553 /nfs/dbraw/zinc/76/05/53/567760553.db2.gz QFPJQJPQYNMWFY-GJZGRUSLSA-N 2 1 382.346 3.488 20 0 GGADMP CC(C)[N@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(Br)cc2)CC1 ZINC000533271327 567762054 /nfs/dbraw/zinc/76/20/54/567762054.db2.gz DACOUMRXGYRBGF-UHFFFAOYSA-N 2 1 382.346 3.440 20 0 GGADMP CC(C)[N@@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(Br)cc2)CC1 ZINC000533271327 567762057 /nfs/dbraw/zinc/76/20/57/567762057.db2.gz DACOUMRXGYRBGF-UHFFFAOYSA-N 2 1 382.346 3.440 20 0 GGADMP Cc1[nH+]c2ccc(Br)cc2c(N[C@@H](C)C[NH+]2CCOCC2)c1C ZINC000462085930 567768809 /nfs/dbraw/zinc/76/88/09/567768809.db2.gz CTKWHKRTFNLEDH-LBPRGKRZSA-N 2 1 378.314 3.169 20 0 GGADMP C[NH+](C)CCOc1cnccc1C[NH2+]Cc1ccc(Br)c(F)c1 ZINC000574313399 567771078 /nfs/dbraw/zinc/77/10/78/567771078.db2.gz RLJRSRFOFYFBEZ-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(Br)c1O ZINC000647542929 567790551 /nfs/dbraw/zinc/79/05/51/567790551.db2.gz DVAKNXYJTWAICI-KBPBESRZSA-N 2 1 383.330 3.375 20 0 GGADMP Clc1ccc(-n2cc(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)nn2)cc1Cl ZINC000647542076 567790869 /nfs/dbraw/zinc/79/08/69/567790869.db2.gz SDUQINOCFPENAR-AWEZNQCLSA-N 2 1 380.323 3.396 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@@H]1C[C@@]12CC[NH2+]C2 ZINC000444187035 567796401 /nfs/dbraw/zinc/79/64/01/567796401.db2.gz SFSMDOLTQWYENZ-HNAYVOBHSA-N 2 1 382.335 3.074 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)c(I)c1 ZINC000574845291 567800435 /nfs/dbraw/zinc/80/04/35/567800435.db2.gz SOJUCKMPAFYHEB-NEPJUHHUSA-N 2 1 376.257 3.423 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@@H+](C)CCCC1CC[NH2+]CC1 ZINC000647872244 567804165 /nfs/dbraw/zinc/80/41/65/567804165.db2.gz LUQIDKGDELCWCA-UHFFFAOYSA-N 2 1 382.346 3.408 20 0 GGADMP CC[C@@H]1C[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC[C@@H]1[NH3+] ZINC000647934987 567808115 /nfs/dbraw/zinc/80/81/15/567808115.db2.gz WJDNACZYFFYIQG-DYVFJYSZSA-N 2 1 375.314 3.465 20 0 GGADMP CC[C@@H]1C[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC[C@@H]1[NH3+] ZINC000647934987 567808121 /nfs/dbraw/zinc/80/81/21/567808121.db2.gz WJDNACZYFFYIQG-DYVFJYSZSA-N 2 1 375.314 3.465 20 0 GGADMP CC[C@H]1C[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC[C@H]1[NH3+] ZINC000647934989 567808292 /nfs/dbraw/zinc/80/82/92/567808292.db2.gz WJDNACZYFFYIQG-SUMWQHHRSA-N 2 1 375.314 3.465 20 0 GGADMP CC[C@H]1C[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC[C@H]1[NH3+] ZINC000647934989 567808296 /nfs/dbraw/zinc/80/82/96/567808296.db2.gz WJDNACZYFFYIQG-SUMWQHHRSA-N 2 1 375.314 3.465 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000647977053 567808914 /nfs/dbraw/zinc/80/89/14/567808914.db2.gz XKZQEXUXKJUDGC-HZPDHXFCSA-N 2 1 394.357 3.489 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000647977052 567809058 /nfs/dbraw/zinc/80/90/58/567809058.db2.gz XKZQEXUXKJUDGC-HOTGVXAUSA-N 2 1 394.357 3.489 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647975756 567809074 /nfs/dbraw/zinc/80/90/74/567809074.db2.gz FOPWBBSQPRAVPY-JKSUJKDBSA-N 2 1 394.357 3.408 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)C2(c3ccccc3)CC[NH2+]CC2)C1 ZINC000237517914 570374612 /nfs/dbraw/zinc/37/46/12/570374612.db2.gz ILVBVSUANKHZRT-SFTDATJTSA-N 2 1 383.580 3.421 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)C2(c3ccccc3)CC[NH2+]CC2)C1 ZINC000237683513 570390423 /nfs/dbraw/zinc/39/04/23/570390423.db2.gz ILVBVSUANKHZRT-RTWAWAEBSA-N 2 1 383.580 3.421 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)CCc1nc2ccccc2s1 ZINC000058223736 570721434 /nfs/dbraw/zinc/72/14/34/570721434.db2.gz ZVZDMWIYLJOOKM-KRWDZBQOSA-N 2 1 388.581 3.103 20 0 GGADMP Cc1cccc(-c2noc(C[NH+]3CCC(C[NH+]4C[C@@H](C)O[C@H](C)C4)CC3)n2)c1 ZINC000058268655 570724161 /nfs/dbraw/zinc/72/41/61/570724161.db2.gz WCNFVGAPYHJWSC-QZTJIDSGSA-N 2 1 384.524 3.366 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)C2(c3ccccc3)CC[NH2+]CC2)C1 ZINC000299738916 570823562 /nfs/dbraw/zinc/82/35/62/570823562.db2.gz ILVBVSUANKHZRT-LEWJYISDSA-N 2 1 383.580 3.421 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@@H](C(C)C)[NH+]1CCCCCC1 ZINC000054606372 570982889 /nfs/dbraw/zinc/98/28/89/570982889.db2.gz VVFCEAMQWGMHBI-FQEVSTJZSA-N 2 1 398.555 3.276 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc(-c3nn[nH]n3)ccc2F)CC1 ZINC000736827447 598509871 /nfs/dbraw/zinc/50/98/71/598509871.db2.gz DFNLDJIDKWRNKI-UHFFFAOYSA-N 2 1 394.498 3.350 20 0 GGADMP C[NH+](C)CC(C)(C)C[NH2+]Cc1cccc(OCc2ccccc2-c2nn[nH]n2)c1 ZINC000736764373 598559967 /nfs/dbraw/zinc/55/99/67/598559967.db2.gz PZGKFKMYGCYDQR-UHFFFAOYSA-N 2 1 394.523 3.123 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[nH+]1 ZINC000737244348 598677430 /nfs/dbraw/zinc/67/74/30/598677430.db2.gz FQFBSFUDMBPFTI-YQQQUEKLSA-N 2 1 389.507 3.486 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[nH+]1 ZINC000737244348 598677431 /nfs/dbraw/zinc/67/74/31/598677431.db2.gz FQFBSFUDMBPFTI-YQQQUEKLSA-N 2 1 389.507 3.486 20 0 GGADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc1-c1nn[nH]n1 ZINC000821809942 599448232 /nfs/dbraw/zinc/44/82/32/599448232.db2.gz UJQXEQTUVRIMSQ-DNVCBOLYSA-N 2 1 398.536 3.110 20 0 GGADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc1-c1nn[nH]n1 ZINC000821809942 599448234 /nfs/dbraw/zinc/44/82/34/599448234.db2.gz UJQXEQTUVRIMSQ-DNVCBOLYSA-N 2 1 398.536 3.110 20 0 GGADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccccc2-c2nn[nH]n2)CC[N@@H+]1Cc1ccccc1 ZINC000736232612 599589222 /nfs/dbraw/zinc/58/92/22/599589222.db2.gz ZUHPMPUKPKZZLA-PXNSSMCTSA-N 2 1 376.508 3.352 20 0 GGADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccccc2-c2nn[nH]n2)CC[N@H+]1Cc1ccccc1 ZINC000736232612 599589223 /nfs/dbraw/zinc/58/92/23/599589223.db2.gz ZUHPMPUKPKZZLA-PXNSSMCTSA-N 2 1 376.508 3.352 20 0 GGADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccccc2-c2nn[nH]n2)CC[NH+]1Cc1ccccc1 ZINC000736232612 599589225 /nfs/dbraw/zinc/58/92/25/599589225.db2.gz ZUHPMPUKPKZZLA-PXNSSMCTSA-N 2 1 376.508 3.352 20 0 GGADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2-c2nn[nH]n2)CC[NH+]1Cc1ccccc1 ZINC000736232612 599589229 /nfs/dbraw/zinc/58/92/29/599589229.db2.gz ZUHPMPUKPKZZLA-PXNSSMCTSA-N 2 1 376.508 3.352 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1 ZINC000821160020 599643748 /nfs/dbraw/zinc/64/37/48/599643748.db2.gz FYBFNVHLXCQNPI-SFHVURJKSA-N 2 1 376.508 3.307 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1 ZINC000821160020 599643749 /nfs/dbraw/zinc/64/37/49/599643749.db2.gz FYBFNVHLXCQNPI-SFHVURJKSA-N 2 1 376.508 3.307 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1 ZINC000821160020 599643750 /nfs/dbraw/zinc/64/37/50/599643750.db2.gz FYBFNVHLXCQNPI-SFHVURJKSA-N 2 1 376.508 3.307 20 0 GGADMP C[N@H+]1CCC[C@H](CNCc2ccc(-c3nn[nH]n3)cc2F)[C@@H]1c1cccs1 ZINC000821623803 607483327 /nfs/dbraw/zinc/48/33/27/607483327.db2.gz SVYJIFVIJJUBAB-CRAIPNDOSA-N 2 1 386.500 3.240 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C2CC[NH+](CCCC(=O)[O-])CC2)C1 ZINC000833614399 605219096 /nfs/dbraw/zinc/21/90/96/605219096.db2.gz LZAODAYSCDQJME-LJQANCHMSA-N 2 1 387.568 3.337 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C1CC[NH+](CCCC(=O)[O-])CC1 ZINC000833614335 605219826 /nfs/dbraw/zinc/21/98/26/605219826.db2.gz GHKIILOAAFWDEK-LJQANCHMSA-N 2 1 387.568 3.480 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(-c3nn[nH]n3)cs2)C1 ZINC000820709311 606211509 /nfs/dbraw/zinc/21/15/09/606211509.db2.gz HEAWMVUWHJJGEA-OAHLLOKOSA-N 2 1 382.537 3.450 20 0 GGADMP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(-c3nn[nH]n3)s2)C[N@H+]1Cc1ccccc1 ZINC000824884308 607812359 /nfs/dbraw/zinc/81/23/59/607812359.db2.gz NFGBXCHMEJPFIX-RDJZCZTQSA-N 2 1 382.537 3.319 20 0 GGADMP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(-c3nn[nH]n3)cc2)C[N@H+]1Cc1ccccc1 ZINC000824882897 607812561 /nfs/dbraw/zinc/81/25/61/607812561.db2.gz DFQBDKJKLAEPIT-PXNSSMCTSA-N 2 1 376.508 3.257 20 0 GGADMP C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(-c3nn[nH]n3)cc2)C[N@H+]1Cc1ccccc1 ZINC000824882896 607812570 /nfs/dbraw/zinc/81/25/70/607812570.db2.gz DFQBDKJKLAEPIT-FXAWDEMLSA-N 2 1 376.508 3.257 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccc(-c3nn[nH]n3)c2F)CC1 ZINC000824936744 608400847 /nfs/dbraw/zinc/40/08/47/608400847.db2.gz LTAZPQGIRPBKKA-INIZCTEOSA-N 2 1 386.519 3.482 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cccc(-c2nn[nH]n2)c1F ZINC000825918453 608420388 /nfs/dbraw/zinc/42/03/88/608420388.db2.gz FKNXSMICKRGMJJ-UHFFFAOYSA-N 2 1 395.486 3.139 20 0 GGADMP c1cc2cc[nH+]cc2c(NC2CC[NH+](Cc3ccc(-c4nn[nH]n4)cc3)CC2)c1 ZINC000826517013 609280728 /nfs/dbraw/zinc/28/07/28/609280728.db2.gz LZLJHDPPPXQFPG-UHFFFAOYSA-N 2 1 385.475 3.491 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NCC[N@H+](C)Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000054265490 1406672284 /nfs/dbraw/zinc/67/22/84/1406672284.db2.gz AMTKGDGQEZOUIL-PMACEKPBSA-N 2 1 395.547 3.158 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NCC[N@@H+](C)Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000054265490 1406672293 /nfs/dbraw/zinc/67/22/93/1406672293.db2.gz AMTKGDGQEZOUIL-PMACEKPBSA-N 2 1 395.547 3.158 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2ccccc2N2CC[NH+](C)CC2)C1 ZINC000054385508 1406711101 /nfs/dbraw/zinc/71/11/01/1406711101.db2.gz CLIPTLKWWSOWDN-GOSISDBHSA-N 2 1 387.572 3.070 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509944 1406756344 /nfs/dbraw/zinc/75/63/44/1406756344.db2.gz YUJKMRRDCJTYIZ-GOSISDBHSA-N 2 1 392.975 3.336 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000054509497 1406756228 /nfs/dbraw/zinc/75/62/28/1406756228.db2.gz GKEMVIVKCDMEDV-QFIPXVFZSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000054509496 1406756474 /nfs/dbraw/zinc/75/64/74/1406756474.db2.gz GKEMVIVKCDMEDV-JOCHJYFZSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000054511627 1406757950 /nfs/dbraw/zinc/75/79/50/1406757950.db2.gz FDVKPBHNBSJPIA-HXUWFJFHSA-N 2 1 386.584 3.450 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000054609165 1406782564 /nfs/dbraw/zinc/78/25/64/1406782564.db2.gz DFTJCABGUVHRBH-KRWDZBQOSA-N 2 1 384.528 3.030 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000054609165 1406782571 /nfs/dbraw/zinc/78/25/71/1406782571.db2.gz DFTJCABGUVHRBH-KRWDZBQOSA-N 2 1 384.528 3.030 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)cc1 ZINC000054626238 1406789856 /nfs/dbraw/zinc/78/98/56/1406789856.db2.gz RUUFWFASPSFDHP-UHFFFAOYSA-N 2 1 377.492 3.348 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)cn1 ZINC000054725351 1406814390 /nfs/dbraw/zinc/81/43/90/1406814390.db2.gz OQWMJHNXVUGPID-CALCHBBNSA-N 2 1 398.555 3.131 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)cn1 ZINC000054725351 1406814396 /nfs/dbraw/zinc/81/43/96/1406814396.db2.gz OQWMJHNXVUGPID-CALCHBBNSA-N 2 1 398.555 3.131 20 0 GGADMP C[NH+](C)CCN(Cc1ccccc1F)C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000054761336 1406820042 /nfs/dbraw/zinc/82/00/42/1406820042.db2.gz YIKWKSGQBPMMKJ-UHFFFAOYSA-N 2 1 386.515 3.031 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000055407364 1406951174 /nfs/dbraw/zinc/95/11/74/1406951174.db2.gz HVEVFLSKMMKHDR-WTGUMLROSA-N 2 1 387.568 3.146 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000055407364 1406951181 /nfs/dbraw/zinc/95/11/81/1406951181.db2.gz HVEVFLSKMMKHDR-WTGUMLROSA-N 2 1 387.568 3.146 20 0 GGADMP C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000055407364 1406951152 /nfs/dbraw/zinc/95/11/52/1406951152.db2.gz HVEVFLSKMMKHDR-WTGUMLROSA-N 2 1 387.568 3.146 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000055407364 1406951162 /nfs/dbraw/zinc/95/11/62/1406951162.db2.gz HVEVFLSKMMKHDR-WTGUMLROSA-N 2 1 387.568 3.146 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@H+](C)Cc3ccc(C)cc3)cc2)CC1 ZINC000006995930 1398583290 /nfs/dbraw/zinc/58/32/90/1398583290.db2.gz XVQMXDABTWWVMX-UHFFFAOYSA-N 2 1 380.536 3.207 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](C)Cc3ccc(C)cc3)cc2)CC1 ZINC000006995930 1398583299 /nfs/dbraw/zinc/58/32/99/1398583299.db2.gz XVQMXDABTWWVMX-UHFFFAOYSA-N 2 1 380.536 3.207 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+]2CCC[C@H](c3nc4ccccc4s3)C2)CC1 ZINC000007582350 1398709556 /nfs/dbraw/zinc/70/95/56/1398709556.db2.gz GMPNDHUERXHJBZ-INIZCTEOSA-N 2 1 386.565 3.076 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@H](c3nc4ccccc4s3)C2)CC1 ZINC000007582350 1398709565 /nfs/dbraw/zinc/70/95/65/1398709565.db2.gz GMPNDHUERXHJBZ-INIZCTEOSA-N 2 1 386.565 3.076 20 0 GGADMP CC[N@@H+](CC(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1)Cc1ccccc1 ZINC000015402963 1399161557 /nfs/dbraw/zinc/16/15/57/1399161557.db2.gz FNYPCFLLIVIKAK-UHFFFAOYSA-N 2 1 380.536 3.289 20 0 GGADMP CC(C)[C@H]([NH2+]CC(=O)NCC1([NH+]2CCOCC2)CCCCC1)c1ccccc1 ZINC000029189532 1400257011 /nfs/dbraw/zinc/25/70/11/1400257011.db2.gz SRBFFCKVNDVDII-QFIPXVFZSA-N 2 1 387.568 3.125 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC1 ZINC000043137734 1403714834 /nfs/dbraw/zinc/71/48/34/1403714834.db2.gz WXQYCYBTSJLILF-FQEVSTJZSA-N 2 1 384.524 3.155 20 0 GGADMP CC[N@H+]1CCC[C@H]1CNC(=S)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000043564693 1403785049 /nfs/dbraw/zinc/78/50/49/1403785049.db2.gz FQKKTEVXUXGHLL-IBGZPJMESA-N 2 1 395.016 3.253 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=S)NC[C@H]2CCC[N@H+]2CC)cc1 ZINC000044104749 1403876333 /nfs/dbraw/zinc/87/63/33/1403876333.db2.gz RPPMNTXHGKRNAW-GOSISDBHSA-N 2 1 378.586 3.178 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=S)NC[C@@H]2CCC[N@H+]2CC)cc1 ZINC000044104752 1403876417 /nfs/dbraw/zinc/87/64/17/1403876417.db2.gz RPPMNTXHGKRNAW-SFHVURJKSA-N 2 1 378.586 3.178 20 0 GGADMP COc1ccc(C[N@H+]2CCCN(C(=O)Nc3cccc(C[NH+](C)C)c3)CC2)cc1 ZINC000044277284 1403911521 /nfs/dbraw/zinc/91/15/21/1403911521.db2.gz LPUHJFRJPOOINP-UHFFFAOYSA-N 2 1 396.535 3.497 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)[N@H+](C)CC1CCCCC1 ZINC000044715277 1403989213 /nfs/dbraw/zinc/98/92/13/1403989213.db2.gz LOYWJUJOVXZVLI-LJQANCHMSA-N 2 1 387.568 3.036 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)[N@@H+](C)CC1CCCCC1 ZINC000044715277 1403989223 /nfs/dbraw/zinc/98/92/23/1403989223.db2.gz LOYWJUJOVXZVLI-LJQANCHMSA-N 2 1 387.568 3.036 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)CC1 ZINC000045006513 1404036681 /nfs/dbraw/zinc/03/66/81/1404036681.db2.gz XDGYWGXDYHAYDE-UHFFFAOYSA-N 2 1 383.458 3.270 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)CC1 ZINC000045006513 1404036691 /nfs/dbraw/zinc/03/66/91/1404036691.db2.gz XDGYWGXDYHAYDE-UHFFFAOYSA-N 2 1 383.458 3.270 20 0 GGADMP C[N@@H+]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)[C@@H](c2ccccc2)C1 ZINC000045191571 1404071641 /nfs/dbraw/zinc/07/16/41/1404071641.db2.gz ZVSLTYOTYYPLRA-HSZRJFAPSA-N 2 1 392.547 3.481 20 0 GGADMP C[N@H+]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)[C@@H](c2ccccc2)C1 ZINC000045191571 1404071653 /nfs/dbraw/zinc/07/16/53/1404071653.db2.gz ZVSLTYOTYYPLRA-HSZRJFAPSA-N 2 1 392.547 3.481 20 0 GGADMP COc1cc2[nH+]c(NC3CC[NH+](Cc4ccccc4)CC3)nc(N)c2cc1OC ZINC000045226860 1404077971 /nfs/dbraw/zinc/07/79/71/1404077971.db2.gz STGZGKIBXUBPFQ-UHFFFAOYSA-N 2 1 393.491 3.306 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)NCc2cccc(C[NH+](C)C)c2)CC1 ZINC000045640183 1404168043 /nfs/dbraw/zinc/16/80/43/1404168043.db2.gz BJJRSLKXUKTVTK-UHFFFAOYSA-N 2 1 380.536 3.084 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)CC1 ZINC000045776860 1404201486 /nfs/dbraw/zinc/20/14/86/1404201486.db2.gz CGUIRKIBSXERNE-FCHUYYIVSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NCC3([NH+](C)C)CCCCC3)cc2)C[C@H](C)O1 ZINC000046430473 1404410750 /nfs/dbraw/zinc/41/07/50/1404410750.db2.gz QZGZOKKYMFEPGT-OALUTQOASA-N 2 1 387.568 3.290 20 0 GGADMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047777402 1404938776 /nfs/dbraw/zinc/93/87/76/1404938776.db2.gz IHOFJVZONURYCP-SFTDATJTSA-N 2 1 396.535 3.380 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(NC(C)=O)cc2)CC1 ZINC000047776695 1404938903 /nfs/dbraw/zinc/93/89/03/1404938903.db2.gz JACAMMOHKQRCOH-UHFFFAOYSA-N 2 1 380.536 3.072 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000047871728 1404979204 /nfs/dbraw/zinc/97/92/04/1404979204.db2.gz CFGVSPKELVLMHZ-NRFANRHFSA-N 2 1 396.535 3.164 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000047882914 1404982521 /nfs/dbraw/zinc/98/25/21/1404982521.db2.gz AROLMOBYAYORHM-NQIIRXRSSA-N 2 1 396.535 3.163 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NC3CC[NH+](C4CC4)CC3)cc2)C1 ZINC000048394995 1405177198 /nfs/dbraw/zinc/17/71/98/1405177198.db2.gz IRAFVQIHSOVHCA-GOSISDBHSA-N 2 1 384.568 3.345 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)cn2)cc1 ZINC000048711584 1405265219 /nfs/dbraw/zinc/26/52/19/1405265219.db2.gz QILCLKRFRBHLIL-CQSZACIVSA-N 2 1 375.314 3.209 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)cn2)cc1 ZINC000048711584 1405265230 /nfs/dbraw/zinc/26/52/30/1405265230.db2.gz QILCLKRFRBHLIL-CQSZACIVSA-N 2 1 375.314 3.209 20 0 GGADMP Cc1cccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)c1C ZINC000048778077 1405288805 /nfs/dbraw/zinc/28/88/05/1405288805.db2.gz VAKPFCFCXPUEPF-UHFFFAOYSA-N 2 1 381.520 3.254 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)NCC[NH+]1CCc2ccccc2C1 ZINC000048828832 1405301817 /nfs/dbraw/zinc/30/18/17/1405301817.db2.gz FWEMRPCBAPIIHZ-UHFFFAOYSA-N 2 1 394.563 3.384 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC000048828832 1405301827 /nfs/dbraw/zinc/30/18/27/1405301827.db2.gz FWEMRPCBAPIIHZ-UHFFFAOYSA-N 2 1 394.563 3.384 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000048828832 1405301833 /nfs/dbraw/zinc/30/18/33/1405301833.db2.gz FWEMRPCBAPIIHZ-UHFFFAOYSA-N 2 1 394.563 3.384 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000049795164 1405418288 /nfs/dbraw/zinc/41/82/88/1405418288.db2.gz OJLWYWCGYXBTNI-HSZRJFAPSA-N 2 1 394.563 3.077 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000049795163 1405418451 /nfs/dbraw/zinc/41/84/51/1405418451.db2.gz OJLWYWCGYXBTNI-QHCPKHFHSA-N 2 1 394.563 3.077 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000050024284 1405453889 /nfs/dbraw/zinc/45/38/89/1405453889.db2.gz GSLSJLUYQDTTDM-IFMALSPDSA-N 2 1 395.547 3.326 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000050024284 1405453897 /nfs/dbraw/zinc/45/38/97/1405453897.db2.gz GSLSJLUYQDTTDM-IFMALSPDSA-N 2 1 395.547 3.326 20 0 GGADMP O=C(NCC1([NH+]2CCOCC2)CCCCC1)c1cccc(C[NH+]2CCCC2)c1 ZINC000050024271 1405454469 /nfs/dbraw/zinc/45/44/69/1405454469.db2.gz AMNZEUQEAABXOQ-UHFFFAOYSA-N 2 1 385.552 3.047 20 0 GGADMP O[C@H](C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1)C[NH+]1CCCC1 ZINC000051187991 1405741003 /nfs/dbraw/zinc/74/10/03/1405741003.db2.gz CZSVQKGDIOOFIP-HXUWFJFHSA-N 2 1 396.560 3.206 20 0 GGADMP Cc1c(Cl)cccc1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959758 1405889678 /nfs/dbraw/zinc/88/96/78/1405889678.db2.gz QUHMJDBUTAEDRQ-INIZCTEOSA-N 2 1 379.932 3.020 20 0 GGADMP C[C@H](C(=O)Nc1cccc(C(F)(F)F)c1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959049 1405889782 /nfs/dbraw/zinc/88/97/82/1405889782.db2.gz QGJKUZCVNAJNHL-OAHLLOKOSA-N 2 1 399.457 3.077 20 0 GGADMP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051958870 1405889894 /nfs/dbraw/zinc/88/98/94/1405889894.db2.gz WJQQZZFEGQNUHE-LJQANCHMSA-N 2 1 387.568 3.490 20 0 GGADMP C[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959724 1405889964 /nfs/dbraw/zinc/88/99/64/1405889964.db2.gz TYSQSISZUBZDDC-OAHLLOKOSA-N 2 1 399.457 3.077 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000052288952 1406008143 /nfs/dbraw/zinc/00/81/43/1406008143.db2.gz QBZDZLJIFRRKIN-UHFFFAOYSA-N 2 1 391.519 3.420 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000052290385 1406008628 /nfs/dbraw/zinc/00/86/28/1406008628.db2.gz RPEMRVXQBWDKRC-HDICACEKSA-N 2 1 383.540 3.169 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000052290385 1406008635 /nfs/dbraw/zinc/00/86/35/1406008635.db2.gz RPEMRVXQBWDKRC-HDICACEKSA-N 2 1 383.540 3.169 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)N[C@@H]1CCOc2ccccc21 ZINC000052713741 1406134708 /nfs/dbraw/zinc/13/47/08/1406134708.db2.gz YYLQFLYSWUADJD-OAQYLSRUSA-N 2 1 385.552 3.214 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@H+](C)Cc3ccccc3)c(C)c2)CC1 ZINC000052857807 1406200667 /nfs/dbraw/zinc/20/06/67/1406200667.db2.gz BLKFKIUTIXXLBW-UHFFFAOYSA-N 2 1 380.536 3.207 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](C)Cc3ccccc3)c(C)c2)CC1 ZINC000052857807 1406200689 /nfs/dbraw/zinc/20/06/89/1406200689.db2.gz BLKFKIUTIXXLBW-UHFFFAOYSA-N 2 1 380.536 3.207 20 0 GGADMP C[NH+](C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000056796626 1407435562 /nfs/dbraw/zinc/43/55/62/1407435562.db2.gz LKECMLMQBJMVBP-JOCHJYFZSA-N 2 1 398.526 3.173 20 0 GGADMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000057123972 1407527975 /nfs/dbraw/zinc/52/79/75/1407527975.db2.gz LREGFCSPOAFMCE-RTWAWAEBSA-N 2 1 381.520 3.445 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000057138945 1407534361 /nfs/dbraw/zinc/53/43/61/1407534361.db2.gz STYWVELYGBGJEE-QHCPKHFHSA-N 2 1 377.532 3.432 20 0 GGADMP C[N@@H+]1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)[C@@H](c2ccccc2)C1 ZINC000057140594 1407534719 /nfs/dbraw/zinc/53/47/19/1407534719.db2.gz NFRJCIIWLWDNLR-HSZRJFAPSA-N 2 1 377.532 3.414 20 0 GGADMP C[N@H+]1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)[C@@H](c2ccccc2)C1 ZINC000057140594 1407534724 /nfs/dbraw/zinc/53/47/24/1407534724.db2.gz NFRJCIIWLWDNLR-HSZRJFAPSA-N 2 1 377.532 3.414 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000057155250 1407538283 /nfs/dbraw/zinc/53/82/83/1407538283.db2.gz WDSUXUTXRDDXKP-UHFFFAOYSA-N 2 1 377.532 3.073 20 0 GGADMP C[C@@H](CNC(=O)C1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000057168956 1407542177 /nfs/dbraw/zinc/54/21/77/1407542177.db2.gz XYJACDUIWWXIPG-FQEVSTJZSA-N 2 1 391.559 3.462 20 0 GGADMP C[NH+](C)CCOc1ccc(CNC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000057174564 1407546072 /nfs/dbraw/zinc/54/60/72/1407546072.db2.gz KFIJHXNOYOFZSB-JOCHJYFZSA-N 2 1 395.547 3.155 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[N@@H+](C(C)(C)C)CC2)cc1F ZINC000057619247 1407668986 /nfs/dbraw/zinc/66/89/86/1407668986.db2.gz RQVDWSACEKYOFQ-UHFFFAOYSA-N 2 1 387.503 3.336 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[N@H+](C(C)(C)C)CC2)cc1F ZINC000057619247 1407668990 /nfs/dbraw/zinc/66/89/90/1407668990.db2.gz RQVDWSACEKYOFQ-UHFFFAOYSA-N 2 1 387.503 3.336 20 0 GGADMP C[C@@H](CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)[NH+](C)C1CC1 ZINC000057705817 1407694842 /nfs/dbraw/zinc/69/48/42/1407694842.db2.gz BYLCPESWLKLWGG-KXBFYZLASA-N 2 1 383.458 3.040 20 0 GGADMP C[C@@H](CNC(=O)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)[N@H+](C)C1CC1 ZINC000057705817 1407694854 /nfs/dbraw/zinc/69/48/54/1407694854.db2.gz BYLCPESWLKLWGG-KXBFYZLASA-N 2 1 383.458 3.040 20 0 GGADMP C[C@@H](CNC(=O)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)[N@@H+](C)C1CC1 ZINC000057705817 1407694865 /nfs/dbraw/zinc/69/48/65/1407694865.db2.gz BYLCPESWLKLWGG-KXBFYZLASA-N 2 1 383.458 3.040 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)N2CCc3sccc3C2)CC1 ZINC000057844088 1407736416 /nfs/dbraw/zinc/73/64/16/1407736416.db2.gz OFASGSUIYKDQRB-UHFFFAOYSA-N 2 1 397.588 3.477 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CCC([NH+]4CCCCC4)CC3)cc2)C[C@H](C)O1 ZINC000058263608 1407803952 /nfs/dbraw/zinc/80/39/52/1407803952.db2.gz OVVZVXWFKMDJQJ-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CCC([NH+]4CCCCC4)CC3)cc2)C[C@H](C)O1 ZINC000058263608 1407803955 /nfs/dbraw/zinc/80/39/55/1407803955.db2.gz OVVZVXWFKMDJQJ-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP Cc1cc(NC(=O)N2CCC[N@H+](C(C)(C)C)CC2)ccc1N1CC[NH+](C)CC1 ZINC000058418765 1407825408 /nfs/dbraw/zinc/82/54/08/1407825408.db2.gz GICQEHYYVHJBJT-UHFFFAOYSA-N 2 1 387.572 3.085 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000060368467 1407962849 /nfs/dbraw/zinc/96/28/49/1407962849.db2.gz PADZMROQCXMFMS-ZACQAIPSSA-N 2 1 393.959 3.488 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)[N@H+]1CCc2ccccc2C1 ZINC000060955157 1408056450 /nfs/dbraw/zinc/05/64/50/1408056450.db2.gz JDMSBDPBGSMIJY-GCJKJVERSA-N 2 1 380.536 3.035 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+]Cc2cc(OC)cc(OC)c2)CC1 ZINC000061070271 1408074109 /nfs/dbraw/zinc/07/41/09/1408074109.db2.gz SCXHKYCLCSFNIN-UHFFFAOYSA-N 2 1 383.536 3.131 20 0 GGADMP CC1CC[NH+](CCCNC(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000061789926 1408175930 /nfs/dbraw/zinc/17/59/30/1408175930.db2.gz UKQKBMFRHMSDLD-UHFFFAOYSA-N 2 1 390.597 3.479 20 0 GGADMP C[N@H+](CCNC(=O)Nc1ccccc1C[NH+]1CCSCC1)Cc1ccccc1 ZINC000061788347 1408176518 /nfs/dbraw/zinc/17/65/18/1408176518.db2.gz GGVVOFDFERSPPU-UHFFFAOYSA-N 2 1 398.576 3.489 20 0 GGADMP C[N@@H+](CCNC(=O)Nc1ccccc1C[NH+]1CCSCC1)Cc1ccccc1 ZINC000061788347 1408176530 /nfs/dbraw/zinc/17/65/30/1408176530.db2.gz GGVVOFDFERSPPU-UHFFFAOYSA-N 2 1 398.576 3.489 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)c1 ZINC000061795588 1408178912 /nfs/dbraw/zinc/17/89/12/1408178912.db2.gz WFOCWNKPDNXAKF-NRFANRHFSA-N 2 1 386.515 3.380 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H](c2cccc(OC)c2)[NH+](C)C)c1 ZINC000061795633 1408178990 /nfs/dbraw/zinc/17/89/90/1408178990.db2.gz YLZXYQKZBHRICW-QFIPXVFZSA-N 2 1 398.551 3.249 20 0 GGADMP C[C@@H](CNC(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH+]1CCc2ccccc2C1 ZINC000061960069 1408192856 /nfs/dbraw/zinc/19/28/56/1408192856.db2.gz OUKUIVOJLAKVTM-ZCNNSNEGSA-N 2 1 386.584 3.100 20 0 GGADMP C[C@@H](CNC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[N@@H+]1CCc2ccccc2C1 ZINC000061960069 1408192873 /nfs/dbraw/zinc/19/28/73/1408192873.db2.gz OUKUIVOJLAKVTM-ZCNNSNEGSA-N 2 1 386.584 3.100 20 0 GGADMP C[C@@H](CNC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[N@H+]1CCc2ccccc2C1 ZINC000061960069 1408192882 /nfs/dbraw/zinc/19/28/82/1408192882.db2.gz OUKUIVOJLAKVTM-ZCNNSNEGSA-N 2 1 386.584 3.100 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000062009155 1408202366 /nfs/dbraw/zinc/20/23/66/1408202366.db2.gz HUWSYMKMYSXKPZ-QFIPXVFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000062473189 1408262858 /nfs/dbraw/zinc/26/28/58/1408262858.db2.gz UXKYWXADXYKBIZ-FQEVSTJZSA-N 2 1 384.524 3.368 20 0 GGADMP O=C(COc1ccccc1C[NH2+]C1CC[NH+](CC2CCCC2)CC1)N1CCCC1 ZINC000063319881 1408336340 /nfs/dbraw/zinc/33/63/40/1408336340.db2.gz SHUFHSDXXWQIAA-UHFFFAOYSA-N 2 1 399.579 3.432 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000063332521 1408338847 /nfs/dbraw/zinc/33/88/47/1408338847.db2.gz YWYWENZKNDEQHC-UHFFFAOYSA-N 2 1 398.595 3.389 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC(C)(C)[NH+]1CCc2ccccc2C1 ZINC000176415142 1428311290 /nfs/dbraw/zinc/31/12/90/1428311290.db2.gz PXCYVAQFCSWHSC-RTWAWAEBSA-N 2 1 384.568 3.092 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1 ZINC000176415142 1428311299 /nfs/dbraw/zinc/31/12/99/1428311299.db2.gz PXCYVAQFCSWHSC-RTWAWAEBSA-N 2 1 384.568 3.092 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000176415142 1428311305 /nfs/dbraw/zinc/31/13/05/1428311305.db2.gz PXCYVAQFCSWHSC-RTWAWAEBSA-N 2 1 384.568 3.092 20 0 GGADMP CC1CC[NH+](CCCNC(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000063464579 1408358966 /nfs/dbraw/zinc/35/89/66/1408358966.db2.gz ZKLVWWWCNGDMDU-QFIPXVFZSA-N 2 1 386.584 3.320 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2ccc(-n3cncn3)c(F)c2)cc1F ZINC000063548989 1408370728 /nfs/dbraw/zinc/37/07/28/1408370728.db2.gz LSUJTMMPEUZQCG-UHFFFAOYSA-N 2 1 380.402 3.329 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC1 ZINC000063727547 1408397723 /nfs/dbraw/zinc/39/77/23/1408397723.db2.gz DEKAPLITTMRABB-LJQANCHMSA-N 2 1 375.532 3.371 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)CC1 ZINC000063727547 1408397730 /nfs/dbraw/zinc/39/77/30/1408397730.db2.gz DEKAPLITTMRABB-LJQANCHMSA-N 2 1 375.532 3.371 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000063727547 1408397735 /nfs/dbraw/zinc/39/77/35/1408397735.db2.gz DEKAPLITTMRABB-LJQANCHMSA-N 2 1 375.532 3.371 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)c1 ZINC000064225201 1408514452 /nfs/dbraw/zinc/51/44/52/1408514452.db2.gz LIYZMNLWDIQAFA-NRFANRHFSA-N 2 1 386.515 3.380 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NCC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000064244615 1408520651 /nfs/dbraw/zinc/52/06/51/1408520651.db2.gz CGPKCVVNPCRRRM-UHFFFAOYSA-N 2 1 392.613 3.476 20 0 GGADMP COc1ccc([C@H](CNC(=O)C[N@H+](C)Cc2ccccc2)[NH+]2CCCC2)cc1 ZINC000064457957 1408559101 /nfs/dbraw/zinc/55/91/01/1408559101.db2.gz PFHVMGQFZGJNGP-QFIPXVFZSA-N 2 1 381.520 3.080 20 0 GGADMP COc1ccc([C@H](CNC(=O)C[N@@H+](C)Cc2ccccc2)[NH+]2CCCC2)cc1 ZINC000064457957 1408559105 /nfs/dbraw/zinc/55/91/05/1408559105.db2.gz PFHVMGQFZGJNGP-QFIPXVFZSA-N 2 1 381.520 3.080 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000064754530 1408608391 /nfs/dbraw/zinc/60/83/91/1408608391.db2.gz QDMRZPHMYJAPCX-OALUTQOASA-N 2 1 390.597 3.230 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+](C)C1CCCC1 ZINC000176478493 1428333809 /nfs/dbraw/zinc/33/38/09/1428333809.db2.gz JZFQNKHQIKXZGS-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@H+](C)C1CCCC1 ZINC000176478493 1428333818 /nfs/dbraw/zinc/33/38/18/1428333818.db2.gz JZFQNKHQIKXZGS-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@@H+](C)C1CCCC1 ZINC000176478493 1428333825 /nfs/dbraw/zinc/33/38/25/1428333825.db2.gz JZFQNKHQIKXZGS-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[NH+](CCc2ccccc2)CC1)c1ccco1 ZINC000065481110 1408676372 /nfs/dbraw/zinc/67/63/72/1408676372.db2.gz WYJZYZYUECSYEK-OAQYLSRUSA-N 2 1 398.551 3.232 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[NH+](Cc2ccccc2C)CC1)c1ccco1 ZINC000065482644 1408676420 /nfs/dbraw/zinc/67/64/20/1408676420.db2.gz HUKUUVTVTXPNQE-OAQYLSRUSA-N 2 1 398.551 3.498 20 0 GGADMP C[N@@H+](CCNC(=O)N1CCC(C[NH+]2CCCCCC2)CC1)Cc1ccccc1 ZINC000065542210 1408686434 /nfs/dbraw/zinc/68/64/34/1408686434.db2.gz POCZAJWKKGFQKR-UHFFFAOYSA-N 2 1 386.584 3.416 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000176508501 1428344140 /nfs/dbraw/zinc/34/41/40/1428344140.db2.gz GTQSJXFAHBCPHG-QFIPXVFZSA-N 2 1 386.584 3.176 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000066192029 1408789488 /nfs/dbraw/zinc/78/94/88/1408789488.db2.gz FCNWGHFHRVVFMY-SFHVURJKSA-N 2 1 392.613 3.476 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@@H](c2cccc(OC)c2)[NH+]2CCCC2)cc1 ZINC000066242377 1408794653 /nfs/dbraw/zinc/79/46/53/1408794653.db2.gz VNGFKFFUFPAGTF-QFIPXVFZSA-N 2 1 396.535 3.197 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000066394907 1408829648 /nfs/dbraw/zinc/82/96/48/1408829648.db2.gz DVHMHGSHPXPGGZ-IBGZPJMESA-N 2 1 375.532 3.371 20 0 GGADMP CCc1ccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)s1 ZINC000066593663 1408862852 /nfs/dbraw/zinc/86/28/52/1408862852.db2.gz CPHQTXFLDKLQIN-UHFFFAOYSA-N 2 1 387.549 3.261 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)Nc1ccc(N2CC[NH+](C)CC2)c(C)c1)c1ccccc1 ZINC000066622330 1408871018 /nfs/dbraw/zinc/87/10/18/1408871018.db2.gz AXRWIQRVDDLDHR-JOCHJYFZSA-N 2 1 380.536 3.378 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc3c(c2)OCCO3)CC1 ZINC000066960901 1408963835 /nfs/dbraw/zinc/96/38/35/1408963835.db2.gz QUBLUQSYATVKPN-KRWDZBQOSA-N 2 1 389.540 3.229 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)NC2CC[NH+](C3CC3)CC2)CC1 ZINC000067041836 1408990338 /nfs/dbraw/zinc/99/03/38/1408990338.db2.gz YCAAMUYDOXZPLM-UHFFFAOYSA-N 2 1 384.568 3.167 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@H]1CCC[N@@H+]1CC1CCCCC1 ZINC000176581156 1428370132 /nfs/dbraw/zinc/37/01/32/1428370132.db2.gz SZNGIAFKOWOUNU-HXUWFJFHSA-N 2 1 375.561 3.316 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@H]1CCC[N@H+]1CC1CCCCC1 ZINC000176581156 1428370137 /nfs/dbraw/zinc/37/01/37/1428370137.db2.gz SZNGIAFKOWOUNU-HXUWFJFHSA-N 2 1 375.561 3.316 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000067062757 1408996837 /nfs/dbraw/zinc/99/68/37/1408996837.db2.gz JBEQINTZBUOQON-UHFFFAOYSA-N 2 1 383.540 3.135 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000067062757 1408996838 /nfs/dbraw/zinc/99/68/38/1408996838.db2.gz JBEQINTZBUOQON-UHFFFAOYSA-N 2 1 383.540 3.135 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(OCC(N)=O)cc2)C1 ZINC000067120844 1409013151 /nfs/dbraw/zinc/01/31/51/1409013151.db2.gz MUQWBHJHKNUXQU-SFHVURJKSA-N 2 1 381.520 3.072 20 0 GGADMP CC1CC[NH+](C[C@H](O)C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1 ZINC000067122402 1409013486 /nfs/dbraw/zinc/01/34/86/1409013486.db2.gz FIHAXZWLPHYTQN-GOSISDBHSA-N 2 1 396.457 3.074 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(OCC(N)=O)cc3)cc2)C1 ZINC000067120733 1409013529 /nfs/dbraw/zinc/01/35/29/1409013529.db2.gz UJPNIILPVQASEK-SFHVURJKSA-N 2 1 381.520 3.072 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@@H]1CCC[N@@H+]1CC1CCCCC1 ZINC000176581139 1428369926 /nfs/dbraw/zinc/36/99/26/1428369926.db2.gz SZNGIAFKOWOUNU-FQEVSTJZSA-N 2 1 375.561 3.316 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC000176581139 1428369935 /nfs/dbraw/zinc/36/99/35/1428369935.db2.gz SZNGIAFKOWOUNU-FQEVSTJZSA-N 2 1 375.561 3.316 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)CC1 ZINC000067265076 1409058288 /nfs/dbraw/zinc/05/82/88/1409058288.db2.gz QXXNVXLOJFAKIT-RTBURBONSA-N 2 1 387.568 3.146 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CCC(C[NH+](C)Cc3ccccc3)CC2)C1 ZINC000067280785 1409063086 /nfs/dbraw/zinc/06/30/86/1409063086.db2.gz CYDIJFPZWVRDCI-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1 ZINC000067280785 1409063090 /nfs/dbraw/zinc/06/30/90/1409063090.db2.gz CYDIJFPZWVRDCI-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C1 ZINC000067280785 1409063093 /nfs/dbraw/zinc/06/30/93/1409063093.db2.gz CYDIJFPZWVRDCI-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1)c1ccco1 ZINC000067381684 1409094447 /nfs/dbraw/zinc/09/44/47/1409094447.db2.gz IVLUACVAASPJKI-OAQYLSRUSA-N 2 1 398.551 3.436 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1)c1ccco1 ZINC000067381684 1409094453 /nfs/dbraw/zinc/09/44/53/1409094453.db2.gz IVLUACVAASPJKI-OAQYLSRUSA-N 2 1 398.551 3.436 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)N[C@H]2CC[NH+]3CCCC[C@H]23)CC1 ZINC000067391757 1409098764 /nfs/dbraw/zinc/09/87/64/1409098764.db2.gz NXDAKQCSBNQPOI-FCHUYYIVSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)N[C@H]2CC[N@@H+]3CCCC[C@H]23)CC1 ZINC000067391757 1409098771 /nfs/dbraw/zinc/09/87/71/1409098771.db2.gz NXDAKQCSBNQPOI-FCHUYYIVSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)CC1 ZINC000067391757 1409098775 /nfs/dbraw/zinc/09/87/75/1409098775.db2.gz NXDAKQCSBNQPOI-FCHUYYIVSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000067449297 1409122070 /nfs/dbraw/zinc/12/20/70/1409122070.db2.gz QFHLZFWAZMBSPY-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000067449297 1409122082 /nfs/dbraw/zinc/12/20/82/1409122082.db2.gz QFHLZFWAZMBSPY-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000067570093 1409169261 /nfs/dbraw/zinc/16/92/61/1409169261.db2.gz XRUDRHKJFCACGN-NRFANRHFSA-N 2 1 386.584 3.318 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC(C)(C)[NH+]2CCCCC2)cc1F ZINC000067646291 1409196168 /nfs/dbraw/zinc/19/61/68/1409196168.db2.gz KSUYOTDSSIUNBF-UHFFFAOYSA-N 2 1 387.503 3.384 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C)[N@@H+]2CCC[C@H](C)C2)cc1F ZINC000067646553 1409196674 /nfs/dbraw/zinc/19/66/74/1409196674.db2.gz DZRUTGZRFHMXCE-HOTGVXAUSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1F ZINC000067646553 1409196680 /nfs/dbraw/zinc/19/66/80/1409196680.db2.gz DZRUTGZRFHMXCE-HOTGVXAUSA-N 2 1 387.503 3.239 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NC[C@@H](c2ccccc2)[NH+]2CCC(C)CC2)C1 ZINC000067684858 1409206948 /nfs/dbraw/zinc/20/69/48/1409206948.db2.gz LRYLRDQEMQMVLP-UNMCSNQZSA-N 2 1 386.584 3.489 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc(-n4cccn4)cc3)c2)CCO1 ZINC000067976551 1409267592 /nfs/dbraw/zinc/26/75/92/1409267592.db2.gz UXCLQZTXOMKJJQ-LJQANCHMSA-N 2 1 376.504 3.383 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(-n4cccn4)cc3)c2)CCO1 ZINC000067976551 1409267602 /nfs/dbraw/zinc/26/76/02/1409267602.db2.gz UXCLQZTXOMKJJQ-LJQANCHMSA-N 2 1 376.504 3.383 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000176658600 1428394666 /nfs/dbraw/zinc/39/46/66/1428394666.db2.gz RBZHXRRRLMQNIW-URVUXULASA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000176658600 1428394676 /nfs/dbraw/zinc/39/46/76/1428394676.db2.gz RBZHXRRRLMQNIW-URVUXULASA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000176658600 1428394682 /nfs/dbraw/zinc/39/46/82/1428394682.db2.gz RBZHXRRRLMQNIW-URVUXULASA-N 2 1 386.584 3.270 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H](C)[N@@H+]3CCCC[C@@H]3C)CC2)cs1 ZINC000068278120 1409350488 /nfs/dbraw/zinc/35/04/88/1409350488.db2.gz FCQSJWXAYKKSKJ-JKSUJKDBSA-N 2 1 378.586 3.043 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H](C)[N@H+]3CCCC[C@@H]3C)CC2)cs1 ZINC000068278120 1409350497 /nfs/dbraw/zinc/35/04/97/1409350497.db2.gz FCQSJWXAYKKSKJ-JKSUJKDBSA-N 2 1 378.586 3.043 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@]3([NH+](C)C)CCC[C@H](C)C3)CC2)cs1 ZINC000068304372 1409358170 /nfs/dbraw/zinc/35/81/70/1409358170.db2.gz DGZUCEKLXKOKIJ-HRAATJIYSA-N 2 1 392.613 3.290 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)CC1 ZINC000068442986 1409404619 /nfs/dbraw/zinc/40/46/19/1409404619.db2.gz JCFQJBBGBMXXMA-RTBURBONSA-N 2 1 387.568 3.290 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C1 ZINC000068546748 1409434783 /nfs/dbraw/zinc/43/47/83/1409434783.db2.gz SDXDFQAMSWYSMP-SFHVURJKSA-N 2 1 380.964 3.145 20 0 GGADMP C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000068584946 1409445516 /nfs/dbraw/zinc/44/55/16/1409445516.db2.gz ZSLYOZZIYCUYAE-RTBURBONSA-N 2 1 378.948 3.040 20 0 GGADMP CC[NH+](CC)Cc1cccc(CNC(=O)NCC[NH+]2Cc3ccccc3C2)c1 ZINC000068638325 1409452915 /nfs/dbraw/zinc/45/29/15/1409452915.db2.gz HUBDZDJRQIGTCO-UHFFFAOYSA-N 2 1 380.536 3.343 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000068843797 1409506651 /nfs/dbraw/zinc/50/66/51/1409506651.db2.gz XSQBZRURORCWQA-QFIPXVFZSA-N 2 1 384.568 3.215 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000068843798 1409506738 /nfs/dbraw/zinc/50/67/38/1409506738.db2.gz XSQBZRURORCWQA-JOCHJYFZSA-N 2 1 384.568 3.215 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)CCc1ccccc1F ZINC000068861195 1409509734 /nfs/dbraw/zinc/50/97/34/1409509734.db2.gz KRAIMTBQGHDZPH-LJQANCHMSA-N 2 1 397.538 3.469 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NC2CC[NH+](CC3CCCC3)CC2)C1 ZINC000068887039 1409516197 /nfs/dbraw/zinc/51/61/97/1409516197.db2.gz MACOVGHGUOPLJG-IBGZPJMESA-N 2 1 378.605 3.452 20 0 GGADMP C[C@@H](NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1)c1cc2ccccc2o1 ZINC000069028976 1409547031 /nfs/dbraw/zinc/54/70/31/1409547031.db2.gz NCQWAGCNSOGEFK-QZTJIDSGSA-N 2 1 399.535 3.043 20 0 GGADMP O=C(Nc1ccccc1)[C@H](c1ccccc1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069029397 1409547452 /nfs/dbraw/zinc/54/74/52/1409547452.db2.gz AOZBFJMKEYLNGZ-QHCPKHFHSA-N 2 1 393.531 3.411 20 0 GGADMP C[C@@H](C(=O)Nc1cccc2ccccc21)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069030172 1409547491 /nfs/dbraw/zinc/54/74/91/1409547491.db2.gz DSWYVHCEEIXIIF-SFHVURJKSA-N 2 1 381.520 3.211 20 0 GGADMP C[C@H](C(=O)Nc1ccc2ccccc2c1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069030309 1409547628 /nfs/dbraw/zinc/54/76/28/1409547628.db2.gz SBRXFQPYLVVEND-GOSISDBHSA-N 2 1 381.520 3.211 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CCC[C@@H](C[NH+]3CCOCC3)C2)cc1)C(C)C ZINC000069743623 1409687213 /nfs/dbraw/zinc/68/72/13/1409687213.db2.gz SJPNLXHYCYLKJZ-NRFANRHFSA-N 2 1 387.568 3.101 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)CC1 ZINC000069822447 1409708803 /nfs/dbraw/zinc/70/88/03/1409708803.db2.gz UTUPRXYHSCBDLJ-SFHVURJKSA-N 2 1 378.586 3.086 20 0 GGADMP CC(C)[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000069822447 1409708811 /nfs/dbraw/zinc/70/88/11/1409708811.db2.gz UTUPRXYHSCBDLJ-SFHVURJKSA-N 2 1 378.586 3.086 20 0 GGADMP CC(C)[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000069822447 1409708820 /nfs/dbraw/zinc/70/88/20/1409708820.db2.gz UTUPRXYHSCBDLJ-SFHVURJKSA-N 2 1 378.586 3.086 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000070448687 1409746429 /nfs/dbraw/zinc/74/64/29/1409746429.db2.gz UMQHQJFVINWOBY-HXUWFJFHSA-N 2 1 383.561 3.135 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000070448687 1409746436 /nfs/dbraw/zinc/74/64/36/1409746436.db2.gz UMQHQJFVINWOBY-HXUWFJFHSA-N 2 1 383.561 3.135 20 0 GGADMP O=C(NCC[NH+]1CCc2sccc2C1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000070448687 1409746443 /nfs/dbraw/zinc/74/64/43/1409746443.db2.gz UMQHQJFVINWOBY-HXUWFJFHSA-N 2 1 383.561 3.135 20 0 GGADMP O=C(NCC[NH+]1CCc2sccc2C1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000070448687 1409746450 /nfs/dbraw/zinc/74/64/50/1409746450.db2.gz UMQHQJFVINWOBY-HXUWFJFHSA-N 2 1 383.561 3.135 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)C1 ZINC000071935858 1409831641 /nfs/dbraw/zinc/83/16/41/1409831641.db2.gz XUPFXQPNAVFHTK-KCZVDYSFSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)C1 ZINC000071935858 1409831644 /nfs/dbraw/zinc/83/16/44/1409831644.db2.gz XUPFXQPNAVFHTK-KCZVDYSFSA-N 2 1 386.584 3.443 20 0 GGADMP C[NH+](C)CCn1cc(NC(=O)c2cccc(C[N@@H+](C)Cc3ccccc3)c2)cn1 ZINC000072064496 1409843783 /nfs/dbraw/zinc/84/37/83/1409843783.db2.gz GSZGDVDBWJESHE-UHFFFAOYSA-N 2 1 391.519 3.329 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@H](C(C)C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000072092402 1409848316 /nfs/dbraw/zinc/84/83/16/1409848316.db2.gz DTGZOVCXPKKNMC-KNKQGSTJSA-N 2 1 389.584 3.231 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](CC(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000072694696 1409852705 /nfs/dbraw/zinc/85/27/05/1409852705.db2.gz CNRWMCMGDKDNOC-UHFFFAOYSA-N 2 1 375.557 3.373 20 0 GGADMP c1ccc(CN2CCO[C@@H](C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)C2)cc1 ZINC000072725916 1409852920 /nfs/dbraw/zinc/85/29/20/1409852920.db2.gz KBBZDZOOONJOEJ-DEOSSOPVSA-N 2 1 379.548 3.142 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000073308031 1409860174 /nfs/dbraw/zinc/86/01/74/1409860174.db2.gz IEZOZQMKJKCWHR-JOCHJYFZSA-N 2 1 380.536 3.156 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000073308031 1409860175 /nfs/dbraw/zinc/86/01/75/1409860175.db2.gz IEZOZQMKJKCWHR-JOCHJYFZSA-N 2 1 380.536 3.156 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000073442811 1409861091 /nfs/dbraw/zinc/86/10/91/1409861091.db2.gz MRWSXPFZJGPUJI-MOPGFXCFSA-N 2 1 376.545 3.322 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000073495261 1409861350 /nfs/dbraw/zinc/86/13/50/1409861350.db2.gz DPLCQEHPWSOWGI-QGZVFWFLSA-N 2 1 375.542 3.170 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@@H](CC)[NH+]2CCc3ccccc3C2)C1 ZINC000073657210 1409863750 /nfs/dbraw/zinc/86/37/50/1409863750.db2.gz VJBHQWUIMVESCW-DENIHFKCSA-N 2 1 386.584 3.197 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NC[C@@H](CC)[N@@H+]2CCc3ccccc3C2)C1 ZINC000073657210 1409863752 /nfs/dbraw/zinc/86/37/52/1409863752.db2.gz VJBHQWUIMVESCW-DENIHFKCSA-N 2 1 386.584 3.197 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NC[C@@H](CC)[N@H+]2CCc3ccccc3C2)C1 ZINC000073657210 1409863755 /nfs/dbraw/zinc/86/37/55/1409863755.db2.gz VJBHQWUIMVESCW-DENIHFKCSA-N 2 1 386.584 3.197 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)N2CC[C@H]([NH+](C)Cc3ccccc3)C2)C1 ZINC000073677224 1409864022 /nfs/dbraw/zinc/86/40/22/1409864022.db2.gz PKBKRSOMYIZXOM-IRLDBZIGSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@H]([N@H+](C)Cc3ccccc3)C2)C1 ZINC000073677224 1409864024 /nfs/dbraw/zinc/86/40/24/1409864024.db2.gz PKBKRSOMYIZXOM-IRLDBZIGSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)C1 ZINC000073677224 1409864028 /nfs/dbraw/zinc/86/40/28/1409864028.db2.gz PKBKRSOMYIZXOM-IRLDBZIGSA-N 2 1 386.584 3.414 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCC(C)(C)[NH+]2CCc3ccccc3C2)C1 ZINC000073722100 1409864833 /nfs/dbraw/zinc/86/48/33/1409864833.db2.gz IFLDEXKAFDSPLK-IBGZPJMESA-N 2 1 386.584 3.197 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NCC(C)(C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000073722100 1409864834 /nfs/dbraw/zinc/86/48/34/1409864834.db2.gz IFLDEXKAFDSPLK-IBGZPJMESA-N 2 1 386.584 3.197 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)C1 ZINC000073722100 1409864836 /nfs/dbraw/zinc/86/48/36/1409864836.db2.gz IFLDEXKAFDSPLK-IBGZPJMESA-N 2 1 386.584 3.197 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@H+](C)C2CC[NH+](C(C)C)CC2)c(OC)c1 ZINC000073895205 1409866815 /nfs/dbraw/zinc/86/68/15/1409866815.db2.gz VSIREMJOPCXSJD-ROUKRRSUSA-N 2 1 376.541 3.273 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c(OC)c1 ZINC000073895205 1409866818 /nfs/dbraw/zinc/86/68/18/1409866818.db2.gz VSIREMJOPCXSJD-ROUKRRSUSA-N 2 1 376.541 3.273 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)[NH+]2CCCC2)o1 ZINC000073981033 1409868051 /nfs/dbraw/zinc/86/80/51/1409868051.db2.gz DVPYZLUPUNHYJL-RBUKOAKNSA-N 2 1 376.545 3.241 20 0 GGADMP CC(C)C[C@H](CNC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+](C)C ZINC000074137048 1409869481 /nfs/dbraw/zinc/86/94/81/1409869481.db2.gz AHFUYKSITHKVIJ-LVCYWYKZSA-N 2 1 375.557 3.002 20 0 GGADMP CC(C)C[C@H](CNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+](C)C ZINC000074137048 1409869482 /nfs/dbraw/zinc/86/94/82/1409869482.db2.gz AHFUYKSITHKVIJ-LVCYWYKZSA-N 2 1 375.557 3.002 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2cc(OC)cc(OC)c2)CC1 ZINC000074319617 1409871737 /nfs/dbraw/zinc/87/17/37/1409871737.db2.gz WKFUGQCFOKBBQC-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2cc(OC)cc(OC)c2)CC1 ZINC000074319617 1409871738 /nfs/dbraw/zinc/87/17/38/1409871738.db2.gz WKFUGQCFOKBBQC-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000074847149 1409877139 /nfs/dbraw/zinc/87/71/39/1409877139.db2.gz DAAQYQYPDPWZJE-QFIPXVFZSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1)c1ccccc1 ZINC000074891287 1409878735 /nfs/dbraw/zinc/87/87/35/1409878735.db2.gz JEPAYFNYGPWJCX-ICSRJNTNSA-N 2 1 386.584 3.489 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](CC(=O)Nc2cccc(Cl)c2C)CC1 ZINC000075007388 1409880059 /nfs/dbraw/zinc/88/00/59/1409880059.db2.gz WZJGBVXIARVKBL-UHFFFAOYSA-N 2 1 381.948 3.410 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2cc(F)ccc2C)CC1 ZINC000075007490 1409880115 /nfs/dbraw/zinc/88/01/15/1409880115.db2.gz ZFURTMSDZYSJKG-KRWDZBQOSA-N 2 1 379.520 3.284 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](CC(=O)Nc2sc(C)c(C)c2C)CC1 ZINC000075007462 1409880190 /nfs/dbraw/zinc/88/01/90/1409880190.db2.gz DUUULXHAIWGZDB-UHFFFAOYSA-N 2 1 381.586 3.435 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2cc(F)ccc2C)CC1 ZINC000075007491 1409880224 /nfs/dbraw/zinc/88/02/24/1409880224.db2.gz ZFURTMSDZYSJKG-QGZVFWFLSA-N 2 1 379.520 3.284 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000076019887 1409884355 /nfs/dbraw/zinc/88/43/55/1409884355.db2.gz PSPDBBHEQYCKTN-UHFFFAOYSA-N 2 1 377.532 3.461 20 0 GGADMP CC(C)[N@@H+]1CCCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000076036987 1409884429 /nfs/dbraw/zinc/88/44/29/1409884429.db2.gz PVHRFUMNVBEZKW-UHFFFAOYSA-N 2 1 376.570 3.183 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000076036987 1409884432 /nfs/dbraw/zinc/88/44/32/1409884432.db2.gz PVHRFUMNVBEZKW-UHFFFAOYSA-N 2 1 376.570 3.183 20 0 GGADMP CCCc1nc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)cs1 ZINC000076324805 1409887249 /nfs/dbraw/zinc/88/72/49/1409887249.db2.gz FPFURTYYRQEBAO-UHFFFAOYSA-N 2 1 380.602 3.012 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N[C@H](C)c2ccccc2OC)CC1 ZINC000076776446 1409891392 /nfs/dbraw/zinc/89/13/92/1409891392.db2.gz JZAAJULZJFGHMD-GOSISDBHSA-N 2 1 375.557 3.316 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1OC(C)C ZINC000077201849 1409894455 /nfs/dbraw/zinc/89/44/55/1409894455.db2.gz PZPABRJMSZDVFU-SFHVURJKSA-N 2 1 376.545 3.354 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1OC(C)C ZINC000077201848 1409894559 /nfs/dbraw/zinc/89/45/59/1409894559.db2.gz PZPABRJMSZDVFU-GOSISDBHSA-N 2 1 376.545 3.354 20 0 GGADMP CCOc1cc(C)ccc1NC(=O)N(CC[NH+](C)C)C[C@@H]1CCC[N@H+]1CC ZINC000077202169 1409894677 /nfs/dbraw/zinc/89/46/77/1409894677.db2.gz LEBQFWLSNSJJLB-SFHVURJKSA-N 2 1 376.545 3.274 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000077201979 1409894744 /nfs/dbraw/zinc/89/47/44/1409894744.db2.gz AAYIGTREDTWOSV-IBGZPJMESA-N 2 1 376.545 3.354 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N3CCC[N@H+]4CCC[C@H]4C3)cc2)CC1 ZINC000077763930 1409899879 /nfs/dbraw/zinc/89/98/79/1409899879.db2.gz ZSAZQKXPCPYVFB-QFIPXVFZSA-N 2 1 384.568 3.298 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000077827841 1409903055 /nfs/dbraw/zinc/90/30/55/1409903055.db2.gz GZDMFWJAHPZMKR-QFIPXVFZSA-N 2 1 384.568 3.442 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc(C)cc2OCC[NH+](C)C)C1 ZINC000078611481 1409929941 /nfs/dbraw/zinc/92/99/41/1409929941.db2.gz FCODQFQJESUMSZ-GOSISDBHSA-N 2 1 376.545 3.131 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@H+]1CCCC[C@@H]1C ZINC000078668233 1409932135 /nfs/dbraw/zinc/93/21/35/1409932135.db2.gz MWVWRDDXABDLKU-PMACEKPBSA-N 2 1 386.584 3.256 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC1 ZINC000079168969 1409961394 /nfs/dbraw/zinc/96/13/94/1409961394.db2.gz PTLQFRRAPKZUFZ-IBGZPJMESA-N 2 1 384.568 3.202 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000079204569 1409962593 /nfs/dbraw/zinc/96/25/93/1409962593.db2.gz JUSCBGLZEUGMNO-OALUTQOASA-N 2 1 376.545 3.370 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000079224304 1409963524 /nfs/dbraw/zinc/96/35/24/1409963524.db2.gz RDDGTIOGSQJXHD-ROUUACIJSA-N 2 1 378.586 3.449 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000079256948 1409963746 /nfs/dbraw/zinc/96/37/46/1409963746.db2.gz PAAHGOOYIYTLNS-VXKWHMMOSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000079653472 1409985809 /nfs/dbraw/zinc/98/58/09/1409985809.db2.gz ACWSIEGMYOSOAJ-PXNSSMCTSA-N 2 1 378.536 3.240 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NCC3CC[NH+](CCC(C)C)CC3)CC2)[nH+]c1 ZINC000079995792 1409997137 /nfs/dbraw/zinc/99/71/37/1409997137.db2.gz NNMUOMIEKNTMJZ-UHFFFAOYSA-N 2 1 386.584 3.481 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CCC([NH+]2CCCCC2)CC1 ZINC000080057102 1409999811 /nfs/dbraw/zinc/99/98/11/1409999811.db2.gz FQRYZYBTJVEZAW-ATKRNPRHSA-N 2 1 384.568 3.357 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@@H]2CC[NH+](C3CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000080146311 1410001231 /nfs/dbraw/zinc/00/12/31/1410001231.db2.gz NFKMYZMIYGFJQG-HMXCVIKNSA-N 2 1 384.568 3.356 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC000080146311 1410001238 /nfs/dbraw/zinc/00/12/38/1410001238.db2.gz NFKMYZMIYGFJQG-HMXCVIKNSA-N 2 1 384.568 3.356 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC000080146311 1410001245 /nfs/dbraw/zinc/00/12/45/1410001245.db2.gz NFKMYZMIYGFJQG-HMXCVIKNSA-N 2 1 384.568 3.356 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000080164733 1410001674 /nfs/dbraw/zinc/00/16/74/1410001674.db2.gz JUFRSZWTPYNDDX-UGKGYDQZSA-N 2 1 386.584 3.413 20 0 GGADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]Cc1ccc(N2CCOCC2)nc1 ZINC000080190206 1410002654 /nfs/dbraw/zinc/00/26/54/1410002654.db2.gz MNOWYHSPGBQQDN-UHFFFAOYSA-N 2 1 382.552 3.166 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]Cc1ccc(N2CCOCC2)nc1 ZINC000080190206 1410002661 /nfs/dbraw/zinc/00/26/61/1410002661.db2.gz MNOWYHSPGBQQDN-UHFFFAOYSA-N 2 1 382.552 3.166 20 0 GGADMP C[N@@H+](CCNC(=O)C1CC[NH+](CCc2ccccc2)CC1)Cc1ccccc1 ZINC000081156140 1410015356 /nfs/dbraw/zinc/01/53/56/1410015356.db2.gz HNFVPMDUKFGLLM-UHFFFAOYSA-N 2 1 379.548 3.189 20 0 GGADMP CC(C)[NH+]1CCC(C(=O)Nc2ccc(N3CC[NH+](C)CC3)c(Cl)c2)CC1 ZINC000081311358 1410017241 /nfs/dbraw/zinc/01/72/41/1410017241.db2.gz BBDIKUKJLVVPFH-UHFFFAOYSA-N 2 1 378.948 3.151 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000081333733 1410017975 /nfs/dbraw/zinc/01/79/75/1410017975.db2.gz AHSHVLMUEYJLDV-VQTJNVASSA-N 2 1 375.532 3.228 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(N3CC[NH+](C(C)C)CC3)cc2)C1 ZINC000081361706 1410018238 /nfs/dbraw/zinc/01/82/38/1410018238.db2.gz URGGJSWYLZYNIF-HXUWFJFHSA-N 2 1 386.584 3.021 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N1CCC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000081444251 1410019705 /nfs/dbraw/zinc/01/97/05/1410019705.db2.gz ARATVGKYVHIBIH-LJQANCHMSA-N 2 1 377.598 3.184 20 0 GGADMP C[C@@H]1CCC[N@H+](CCCCNC(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000081552295 1410020900 /nfs/dbraw/zinc/02/09/00/1410020900.db2.gz BOGMBHDUBCLNEO-NQIIRXRSSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000081552295 1410020908 /nfs/dbraw/zinc/02/09/08/1410020908.db2.gz BOGMBHDUBCLNEO-NQIIRXRSSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000081552295 1410020918 /nfs/dbraw/zinc/02/09/18/1410020918.db2.gz BOGMBHDUBCLNEO-NQIIRXRSSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000081552295 1410020927 /nfs/dbraw/zinc/02/09/27/1410020927.db2.gz BOGMBHDUBCLNEO-NQIIRXRSSA-N 2 1 375.532 3.418 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000081725350 1410024262 /nfs/dbraw/zinc/02/42/62/1410024262.db2.gz FQCUTEMVUXFMNR-OAQYLSRUSA-N 2 1 375.532 3.371 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000081725350 1410024269 /nfs/dbraw/zinc/02/42/69/1410024269.db2.gz FQCUTEMVUXFMNR-OAQYLSRUSA-N 2 1 375.532 3.371 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000081957147 1410025313 /nfs/dbraw/zinc/02/53/13/1410025313.db2.gz AOLALLJXCCIKOM-FPOVZHCZSA-N 2 1 375.532 3.371 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000081957147 1410025318 /nfs/dbraw/zinc/02/53/18/1410025318.db2.gz AOLALLJXCCIKOM-FPOVZHCZSA-N 2 1 375.532 3.371 20 0 GGADMP C[C@@H](NC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)C(C)(C)C[NH+](C)C ZINC000085365912 1410040534 /nfs/dbraw/zinc/04/05/34/1410040534.db2.gz AHHDCQUGIGUYFG-QGZVFWFLSA-N 2 1 378.536 3.019 20 0 GGADMP C[C@@H](NC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)C(C)(C)C[NH+](C)C ZINC000085365912 1410040540 /nfs/dbraw/zinc/04/05/40/1410040540.db2.gz AHHDCQUGIGUYFG-QGZVFWFLSA-N 2 1 378.536 3.019 20 0 GGADMP C[C@H](NC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)C(C)(C)C[NH+](C)C ZINC000085365910 1410040689 /nfs/dbraw/zinc/04/06/89/1410040689.db2.gz AHHDCQUGIGUYFG-KRWDZBQOSA-N 2 1 378.536 3.019 20 0 GGADMP C[C@H](NC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)C(C)(C)C[NH+](C)C ZINC000085365910 1410040701 /nfs/dbraw/zinc/04/07/01/1410040701.db2.gz AHHDCQUGIGUYFG-KRWDZBQOSA-N 2 1 378.536 3.019 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)CC1 ZINC000085389934 1410040938 /nfs/dbraw/zinc/04/09/38/1410040938.db2.gz ZTVFPEXFNHJMDL-SIKLNZKXSA-N 2 1 386.584 3.400 20 0 GGADMP Cc1ccc(CN(C(=O)C[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)C2CC2)cc1 ZINC000090004297 1410059818 /nfs/dbraw/zinc/05/98/18/1410059818.db2.gz UMVRPBGIVNKZJY-HXUWFJFHSA-N 2 1 380.536 3.174 20 0 GGADMP Cc1ccc(CN(C(=O)C[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)C2CC2)cc1 ZINC000090004297 1410059825 /nfs/dbraw/zinc/05/98/25/1410059825.db2.gz UMVRPBGIVNKZJY-HXUWFJFHSA-N 2 1 380.536 3.174 20 0 GGADMP CN(C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)[C@@H]1CCCc2ccccc21 ZINC000090004013 1410059893 /nfs/dbraw/zinc/05/98/93/1410059893.db2.gz KQUHVZMWHXLDOA-WIYYLYMNSA-N 2 1 380.536 3.211 20 0 GGADMP CN(C(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)[C@@H]1CCCc2ccccc21 ZINC000090004013 1410059902 /nfs/dbraw/zinc/05/99/02/1410059902.db2.gz KQUHVZMWHXLDOA-WIYYLYMNSA-N 2 1 380.536 3.211 20 0 GGADMP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+][C@@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000090234074 1410063755 /nfs/dbraw/zinc/06/37/55/1410063755.db2.gz LWLNBCJXNNEANW-LVCYWYKZSA-N 2 1 375.557 3.363 20 0 GGADMP C[C@@H]([NH2+]CCN1CC[NH+](Cc2ccccc2)CC1)c1nc2ccccc2n1C ZINC000091265349 1410071789 /nfs/dbraw/zinc/07/17/89/1410071789.db2.gz LIUQHEICURIEFS-LJQANCHMSA-N 2 1 377.536 3.042 20 0 GGADMP C[NH+]1CCC[C@@H](CNc2nc(NC[C@@H]3CCC[N@H+](C)C3)nc3ccccc32)C1 ZINC000091482888 1410074356 /nfs/dbraw/zinc/07/43/56/1410074356.db2.gz ZJPSHKASOFWFHJ-ROUUACIJSA-N 2 1 382.556 3.137 20 0 GGADMP C[NH+]1CCC[C@@H](CNc2nc3ccccc3c(NC[C@@H]3CCC[N@H+](C)C3)n2)C1 ZINC000091482888 1410074358 /nfs/dbraw/zinc/07/43/58/1410074358.db2.gz ZJPSHKASOFWFHJ-ROUUACIJSA-N 2 1 382.556 3.137 20 0 GGADMP C[NH+]1CCC[C@@H](CNc2nc3ccccc3c(NC[C@@H]3CCC[N@@H+](C)C3)n2)C1 ZINC000091482888 1410074363 /nfs/dbraw/zinc/07/43/63/1410074363.db2.gz ZJPSHKASOFWFHJ-ROUUACIJSA-N 2 1 382.556 3.137 20 0 GGADMP CC[C@H](c1ccncc1)[N@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000092225242 1410125127 /nfs/dbraw/zinc/12/51/27/1410125127.db2.gz KQXJKHLFVCJBHB-JOCHJYFZSA-N 2 1 380.536 3.377 20 0 GGADMP CC[C@H](c1ccncc1)[N@@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000092225242 1410125132 /nfs/dbraw/zinc/12/51/32/1410125132.db2.gz KQXJKHLFVCJBHB-JOCHJYFZSA-N 2 1 380.536 3.377 20 0 GGADMP CC[N@@H+](CCNC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)C(C)C ZINC000092488870 1410162547 /nfs/dbraw/zinc/16/25/47/1410162547.db2.gz DAFDASSHYXMSQA-UHFFFAOYSA-N 2 1 375.561 3.060 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3OCC(=O)N(C)C)C2)CC1 ZINC000092587751 1410176247 /nfs/dbraw/zinc/17/62/47/1410176247.db2.gz NJSFNBNTVHZBHD-FQEVSTJZSA-N 2 1 387.568 3.098 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3OCC(=O)N(C)C)C2)CC1 ZINC000092587751 1410176262 /nfs/dbraw/zinc/17/62/62/1410176262.db2.gz NJSFNBNTVHZBHD-FQEVSTJZSA-N 2 1 387.568 3.098 20 0 GGADMP COc1cc(OC)c(C[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c(OC)c1 ZINC000092587392 1410176489 /nfs/dbraw/zinc/17/64/89/1410176489.db2.gz SWJNWDKVWKEQBN-IRXDYDNUSA-N 2 1 392.540 3.034 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cnn(-c4ccc(F)cc4)c3)CC2)C[C@H](C)O1 ZINC000092587577 1410176708 /nfs/dbraw/zinc/17/67/08/1410176708.db2.gz PAHHBNJSLBLVBT-HDICACEKSA-N 2 1 386.515 3.333 20 0 GGADMP COc1ccc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(OC)c1OC ZINC000092587135 1410176983 /nfs/dbraw/zinc/17/69/83/1410176983.db2.gz PKSYCKCNXPPZTF-CALCHBBNSA-N 2 1 392.540 3.034 20 0 GGADMP COc1ccc(-c2n[nH]cc2C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000092587565 1410177187 /nfs/dbraw/zinc/17/71/87/1410177187.db2.gz PDGCIOQZTQECJA-HDICACEKSA-N 2 1 398.551 3.407 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@@H+](C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000092645160 1410181919 /nfs/dbraw/zinc/18/19/19/1410181919.db2.gz XDWMNNGHTPFKDJ-UHFFFAOYSA-N 2 1 396.579 3.161 20 0 GGADMP Cc1cccc(-c2n[nH]cc2C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1 ZINC000092665289 1410185016 /nfs/dbraw/zinc/18/50/16/1410185016.db2.gz CYZRWMLQJATUDP-WOJBJXKFSA-N 2 1 381.568 3.376 20 0 GGADMP COCCCOc1cccc(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1 ZINC000092666343 1410186079 /nfs/dbraw/zinc/18/60/79/1410186079.db2.gz CSEVFIMYCINWAJ-SFTDATJTSA-N 2 1 389.584 3.092 20 0 GGADMP COc1ccc(-c2n[nH]cc2C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)cc1 ZINC000092666269 1410186479 /nfs/dbraw/zinc/18/64/79/1410186479.db2.gz CZIYZIISLUTAHJ-RTBURBONSA-N 2 1 397.567 3.076 20 0 GGADMP CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000092708037 1410191340 /nfs/dbraw/zinc/19/13/40/1410191340.db2.gz LFJRYGWAYNMIQC-OAQYLSRUSA-N 2 1 387.568 3.290 20 0 GGADMP CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000092730421 1410193932 /nfs/dbraw/zinc/19/39/32/1410193932.db2.gz GGASRRNYCJHPCS-ICSRJNTNSA-N 2 1 375.557 3.144 20 0 GGADMP CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000092730419 1410193957 /nfs/dbraw/zinc/19/39/57/1410193957.db2.gz GGASRRNYCJHPCS-QUCCMNQESA-N 2 1 375.557 3.144 20 0 GGADMP CN(C)C(=O)[C@H](c1ccccc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092820876 1410203405 /nfs/dbraw/zinc/20/34/05/1410203405.db2.gz VTVFJLMLRLKOTJ-QFIPXVFZSA-N 2 1 380.536 3.449 20 0 GGADMP Cc1cccc(CNC(=O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000092821368 1410204050 /nfs/dbraw/zinc/20/40/50/1410204050.db2.gz ZHQBNKKOIFGGSX-UHFFFAOYSA-N 2 1 380.536 3.245 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(Oc4cccnc4)c(C)c3)C2)CC1 ZINC000093133107 1410224045 /nfs/dbraw/zinc/22/40/45/1410224045.db2.gz FDWYTKLUZCJUDR-NRFANRHFSA-N 2 1 380.536 3.394 20 0 GGADMP CCCCOc1cc(C[N@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)ccc1OC ZINC000093132967 1410224109 /nfs/dbraw/zinc/22/41/09/1410224109.db2.gz DUMIUOFLTIWBRS-HXUWFJFHSA-N 2 1 375.557 3.086 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cc4cc(OC)ccc4o3)CC2)CC1 ZINC000093142061 1410226379 /nfs/dbraw/zinc/22/63/79/1410226379.db2.gz OWKPRSPLVSTFNS-UHFFFAOYSA-N 2 1 399.535 3.208 20 0 GGADMP C[N@@H+](Cc1ccccc1N1CCOCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093336968 1410235656 /nfs/dbraw/zinc/23/56/56/1410235656.db2.gz WGXSNJLPTNAZMJ-QFIPXVFZSA-N 2 1 379.548 3.477 20 0 GGADMP C[N@H+](Cc1ccccc1N1CCOCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093336968 1410235663 /nfs/dbraw/zinc/23/56/63/1410235663.db2.gz WGXSNJLPTNAZMJ-QFIPXVFZSA-N 2 1 379.548 3.477 20 0 GGADMP C[NH+](Cc1ccccc1N1CCOCC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000093336968 1410235668 /nfs/dbraw/zinc/23/56/68/1410235668.db2.gz WGXSNJLPTNAZMJ-QFIPXVFZSA-N 2 1 379.548 3.477 20 0 GGADMP C[NH+](Cc1ccccc1N1CCOCC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000093336968 1410235677 /nfs/dbraw/zinc/23/56/77/1410235677.db2.gz WGXSNJLPTNAZMJ-QFIPXVFZSA-N 2 1 379.548 3.477 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000093564155 1410253818 /nfs/dbraw/zinc/25/38/18/1410253818.db2.gz MYYYUMUTWYZWNK-IBGZPJMESA-N 2 1 382.508 3.298 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000093564155 1410253822 /nfs/dbraw/zinc/25/38/22/1410253822.db2.gz MYYYUMUTWYZWNK-IBGZPJMESA-N 2 1 382.508 3.298 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000093683859 1410259142 /nfs/dbraw/zinc/25/91/42/1410259142.db2.gz MCQPNKOTXFWXLT-KRWDZBQOSA-N 2 1 382.508 3.156 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000093683859 1410259147 /nfs/dbraw/zinc/25/91/47/1410259147.db2.gz MCQPNKOTXFWXLT-KRWDZBQOSA-N 2 1 382.508 3.156 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093692721 1410259993 /nfs/dbraw/zinc/25/99/93/1410259993.db2.gz XEDVKDDTEKVOGF-SFHVURJKSA-N 2 1 398.551 3.412 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093692721 1410260000 /nfs/dbraw/zinc/26/00/00/1410260000.db2.gz XEDVKDDTEKVOGF-SFHVURJKSA-N 2 1 398.551 3.412 20 0 GGADMP COc1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(Cl)c1OC ZINC000093735196 1410261685 /nfs/dbraw/zinc/26/16/85/1410261685.db2.gz AROUBNXCDVECEM-UHFFFAOYSA-N 2 1 382.932 3.434 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093741897 1410262828 /nfs/dbraw/zinc/26/28/28/1410262828.db2.gz NQGVVNBSTHWVIA-SFHVURJKSA-N 2 1 398.551 3.412 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093741897 1410262833 /nfs/dbraw/zinc/26/28/33/1410262833.db2.gz NQGVVNBSTHWVIA-SFHVURJKSA-N 2 1 398.551 3.412 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093741897 1410262836 /nfs/dbraw/zinc/26/28/36/1410262836.db2.gz NQGVVNBSTHWVIA-SFHVURJKSA-N 2 1 398.551 3.412 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093741897 1410262842 /nfs/dbraw/zinc/26/28/42/1410262842.db2.gz NQGVVNBSTHWVIA-SFHVURJKSA-N 2 1 398.551 3.412 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cn(C)nc2-c2cccnc2)CC1 ZINC000093769422 1410265480 /nfs/dbraw/zinc/26/54/80/1410265480.db2.gz KPNWPDBJPRXLOD-UHFFFAOYSA-N 2 1 385.556 3.053 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1N(C)C ZINC000093944915 1410288940 /nfs/dbraw/zinc/28/89/40/1410288940.db2.gz IUSGZDIQJOFJTQ-NQIIRXRSSA-N 2 1 394.563 3.301 20 0 GGADMP O=C([C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000096626723 1410334975 /nfs/dbraw/zinc/33/49/75/1410334975.db2.gz XQABQDDTFHBCMT-QFIPXVFZSA-N 2 1 395.522 3.382 20 0 GGADMP O=C([C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000096626723 1410334980 /nfs/dbraw/zinc/33/49/80/1410334980.db2.gz XQABQDDTFHBCMT-QFIPXVFZSA-N 2 1 395.522 3.382 20 0 GGADMP C[NH+]1CCN(c2ccc(NC(=O)[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)cc2)CC1 ZINC000096627909 1410335129 /nfs/dbraw/zinc/33/51/29/1410335129.db2.gz KPLQFZSDJZBFLF-OAQYLSRUSA-N 2 1 392.547 3.289 20 0 GGADMP CC1(C)CC(NC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC(C)(C)[NH2+]1 ZINC000096626718 1410335254 /nfs/dbraw/zinc/33/52/54/1410335254.db2.gz AILCVMKVUDUFOE-QGZVFWFLSA-N 2 1 375.532 3.463 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000098030333 1410397802 /nfs/dbraw/zinc/39/78/02/1410397802.db2.gz CTBOBKKOLOMHEL-QZTJIDSGSA-N 2 1 376.545 3.006 20 0 GGADMP COc1ccc(C[NH+]2CCC(CNC(=O)[C@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000101661380 1410487637 /nfs/dbraw/zinc/48/76/37/1410487637.db2.gz IWRQDYHMZQEHMP-OTWHNJEPSA-N 2 1 387.568 3.285 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)Nc1cccc(NC(=O)C[NH+]2CCCCCC2)c1 ZINC000101670985 1410488703 /nfs/dbraw/zinc/48/87/03/1410488703.db2.gz KQYZULWVFXXRRU-UHFFFAOYSA-N 2 1 397.523 3.425 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CCC[NH+](CCCc3ccccc3)CC2)C1 ZINC000101749207 1410498589 /nfs/dbraw/zinc/49/85/89/1410498589.db2.gz KDJMICAOQHGAOK-JOCHJYFZSA-N 2 1 386.584 3.068 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC[N@H+](CCCc3ccccc3)CC2)C1 ZINC000101749207 1410498596 /nfs/dbraw/zinc/49/85/96/1410498596.db2.gz KDJMICAOQHGAOK-JOCHJYFZSA-N 2 1 386.584 3.068 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)C1 ZINC000101749207 1410498599 /nfs/dbraw/zinc/49/85/99/1410498599.db2.gz KDJMICAOQHGAOK-JOCHJYFZSA-N 2 1 386.584 3.068 20 0 GGADMP CC[N@@H+](CCNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)C1CC1 ZINC000101977032 1410534814 /nfs/dbraw/zinc/53/48/14/1410534814.db2.gz BFWVNURIUXEMSL-UHFFFAOYSA-N 2 1 378.948 3.088 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NCC[N@@H+]1CCc2sccc2C1)c1ccco1 ZINC000101990159 1410537761 /nfs/dbraw/zinc/53/77/61/1410537761.db2.gz KHBDVWDWEKFCFP-QGZVFWFLSA-N 2 1 390.553 3.082 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NCC[N@H+]1CCc2sccc2C1)c1ccco1 ZINC000101990159 1410537764 /nfs/dbraw/zinc/53/77/64/1410537764.db2.gz KHBDVWDWEKFCFP-QGZVFWFLSA-N 2 1 390.553 3.082 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C)[NH+]2CCC(C)CC2)cc1F ZINC000101999386 1410540779 /nfs/dbraw/zinc/54/07/79/1410540779.db2.gz OSEKGULIECJLNX-INIZCTEOSA-N 2 1 387.503 3.239 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)NCCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000176848616 1428499542 /nfs/dbraw/zinc/49/95/42/1428499542.db2.gz NQQUOHDYKFKVIF-JOCHJYFZSA-N 2 1 387.568 3.048 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)NCc2ccc(F)cc2)CC1 ZINC000103143178 1410831516 /nfs/dbraw/zinc/83/15/16/1410831516.db2.gz YKOWOATVZYCHEL-UHFFFAOYSA-N 2 1 383.511 3.286 20 0 GGADMP COc1cc(OC)c(OC)cc1C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000103173957 1410834805 /nfs/dbraw/zinc/83/48/05/1410834805.db2.gz CHXMFNZOOUKXCD-IBGZPJMESA-N 2 1 384.520 3.367 20 0 GGADMP COc1cc(OC)c(OC)cc1C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000103173957 1410834806 /nfs/dbraw/zinc/83/48/06/1410834806.db2.gz CHXMFNZOOUKXCD-IBGZPJMESA-N 2 1 384.520 3.367 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)Nc2ccc(CC[NH+]3CCSCC3)cc2)C1 ZINC000103291048 1410842926 /nfs/dbraw/zinc/84/29/26/1410842926.db2.gz DVXKLQSLDRZQDD-LJQANCHMSA-N 2 1 390.597 3.131 20 0 GGADMP C[NH+]1CCC(CCNC(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000103291046 1410842988 /nfs/dbraw/zinc/84/29/88/1410842988.db2.gz QNXYAYAYSQMQET-UHFFFAOYSA-N 2 1 376.570 3.089 20 0 GGADMP CC(C)(CNC(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCCCC1 ZINC000103298454 1410843856 /nfs/dbraw/zinc/84/38/56/1410843856.db2.gz GAUAQTMSXURMML-OAQYLSRUSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NCCC3CC[NH+](C)CC3)cc2)C1 ZINC000103303353 1410844738 /nfs/dbraw/zinc/84/47/38/1410844738.db2.gz BTIDFWBSHDPNCK-IBGZPJMESA-N 2 1 386.584 3.450 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000103312831 1410846195 /nfs/dbraw/zinc/84/61/95/1410846195.db2.gz ACUMWFCIWCCOOZ-OAQYLSRUSA-N 2 1 386.584 3.115 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000176938821 1428526229 /nfs/dbraw/zinc/52/62/29/1428526229.db2.gz NJJPZJMRUGSJSW-GOSISDBHSA-N 2 1 390.597 3.431 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000176938821 1428526234 /nfs/dbraw/zinc/52/62/34/1428526234.db2.gz NJJPZJMRUGSJSW-GOSISDBHSA-N 2 1 390.597 3.431 20 0 GGADMP C[N@H+](CCNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)C1CCCC1 ZINC000104785317 1410961810 /nfs/dbraw/zinc/96/18/10/1410961810.db2.gz AXAUUPANGOBMKV-UHFFFAOYSA-N 2 1 394.510 3.103 20 0 GGADMP C[N@@H+](CCNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)C1CCCC1 ZINC000104785317 1410961833 /nfs/dbraw/zinc/96/18/33/1410961833.db2.gz AXAUUPANGOBMKV-UHFFFAOYSA-N 2 1 394.510 3.103 20 0 GGADMP COCCN(CC[NH+](C)C)C(=O)Nc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000104978675 1411007506 /nfs/dbraw/zinc/00/75/06/1411007506.db2.gz MVMKGXZUUJDVSL-UHFFFAOYSA-N 2 1 390.572 3.493 20 0 GGADMP C[C@@H](NC(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1)c1cccc(OC(F)F)c1 ZINC000105131628 1411032475 /nfs/dbraw/zinc/03/24/75/1411032475.db2.gz BWOQFEUDCGEUSS-OAHLLOKOSA-N 2 1 398.498 3.016 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)C1 ZINC000105135211 1411033366 /nfs/dbraw/zinc/03/33/66/1411033366.db2.gz VARPKKFCXRSMPM-QHAWAJNXSA-N 2 1 378.605 3.404 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NC[C@H](C)[N@@H+](C)C1CC1)[NH+]1CCCCC1 ZINC000105165730 1411037978 /nfs/dbraw/zinc/03/79/78/1411037978.db2.gz PGPDXNQSVYDVJJ-PXNSSMCTSA-N 2 1 388.556 3.004 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)[NH+]2CCCC2)o1 ZINC000105222169 1411043802 /nfs/dbraw/zinc/04/38/02/1411043802.db2.gz INGFAFUYOPSFIR-RBUKOAKNSA-N 2 1 376.545 3.145 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)C1 ZINC000105273543 1411048757 /nfs/dbraw/zinc/04/87/57/1411048757.db2.gz RKEZGPVOZBSJII-SFHVURJKSA-N 2 1 396.526 3.158 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(Cc2ccco2)C2CC[NH+](C)CC2)C1 ZINC000105275683 1411049417 /nfs/dbraw/zinc/04/94/17/1411049417.db2.gz AYHNTBISZODVRZ-GOSISDBHSA-N 2 1 376.545 3.006 20 0 GGADMP CCOc1cc2[nH+]ccc(NC[C@H](C)[NH+]3CCN(CC)CC3)c2cc1OCC ZINC000105340572 1411056109 /nfs/dbraw/zinc/05/61/09/1411056109.db2.gz ZFAMAXRZMYHEDS-KRWDZBQOSA-N 2 1 386.540 3.470 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000105457282 1411068117 /nfs/dbraw/zinc/06/81/17/1411068117.db2.gz CQIUUHUUZHSSND-SFHVURJKSA-N 2 1 398.551 3.458 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000105457279 1411068403 /nfs/dbraw/zinc/06/84/03/1411068403.db2.gz CQIUUHUUZHSSND-GOSISDBHSA-N 2 1 398.551 3.458 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1 ZINC000105476538 1411070700 /nfs/dbraw/zinc/07/07/00/1411070700.db2.gz ZITUPOOXXOUMCY-UHFFFAOYSA-N 2 1 395.473 3.008 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)CC1 ZINC000105476747 1411070929 /nfs/dbraw/zinc/07/09/29/1411070929.db2.gz MTFGNYUGTHVHCB-UHFFFAOYSA-N 2 1 377.536 3.143 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]CCN3CCC([NH+](C)C)CC3)cs2)cc1 ZINC000176988809 1428542715 /nfs/dbraw/zinc/54/27/15/1428542715.db2.gz IFMSBEFVOWPMLQ-UHFFFAOYSA-N 2 1 388.581 3.146 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCC[N@H+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1 ZINC000106213937 1411180807 /nfs/dbraw/zinc/18/08/07/1411180807.db2.gz ISXGMFDMMPMOPE-QGZVFWFLSA-N 2 1 391.519 3.149 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCC[N@@H+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1 ZINC000106213937 1411180821 /nfs/dbraw/zinc/18/08/21/1411180821.db2.gz ISXGMFDMMPMOPE-QGZVFWFLSA-N 2 1 391.519 3.149 20 0 GGADMP Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C[NH2+][C@H](C)CN1CC[NH+](C)CC1 ZINC000106486056 1411224396 /nfs/dbraw/zinc/22/43/96/1411224396.db2.gz LYYKJHCYYDYNKB-CQSZACIVSA-N 2 1 396.366 3.213 20 0 GGADMP C[C@@H](CN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2cccc(Br)c2)o1 ZINC000106485515 1411224587 /nfs/dbraw/zinc/22/45/87/1411224587.db2.gz LQVNDPBPOKCBQJ-HNNXBMFYSA-N 2 1 392.341 3.435 20 0 GGADMP Cc1nn(-c2cc(C)ccc2C)c(Cl)c1C[NH2+][C@@H](C)CN1CC[NH+](C)CC1 ZINC000106484058 1411224851 /nfs/dbraw/zinc/22/48/51/1411224851.db2.gz YHIRWNNIFRPIAZ-KRWDZBQOSA-N 2 1 389.975 3.176 20 0 GGADMP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106518948 1411229503 /nfs/dbraw/zinc/22/95/03/1411229503.db2.gz NHRPCOJZAOJGLB-AEFFLSMTSA-N 2 1 376.570 3.201 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)CC1 ZINC000106526881 1411233691 /nfs/dbraw/zinc/23/36/91/1411233691.db2.gz ZADCXGQHDDVRBX-NRFANRHFSA-N 2 1 384.568 3.276 20 0 GGADMP CCC[NH+]1CCC(NC(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)CC1 ZINC000107327489 1411360565 /nfs/dbraw/zinc/36/05/65/1411360565.db2.gz SNWCWILZPDXEKG-UHFFFAOYSA-N 2 1 394.510 3.103 20 0 GGADMP C[NH+](C)CCCOc1ccc(NC(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000107385193 1411369358 /nfs/dbraw/zinc/36/93/58/1411369358.db2.gz ZKCISTVVYDWOGU-UHFFFAOYSA-N 2 1 396.535 3.367 20 0 GGADMP COc1cc(C[NH+](C)CC(C)C[N@@H+](C)Cc2ccc(O)c(OC)c2)ccc1O ZINC000177049940 1428568226 /nfs/dbraw/zinc/56/82/26/1428568226.db2.gz PGLJFTDZSKSPDF-UHFFFAOYSA-N 2 1 388.508 3.315 20 0 GGADMP COc1cc(C[NH+](C)CC(C)C[N@H+](C)Cc2ccc(O)c(OC)c2)ccc1O ZINC000177049940 1428568228 /nfs/dbraw/zinc/56/82/28/1428568228.db2.gz PGLJFTDZSKSPDF-UHFFFAOYSA-N 2 1 388.508 3.315 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)CC1 ZINC000108412509 1411494609 /nfs/dbraw/zinc/49/46/09/1411494609.db2.gz GVVCCONSDIDFIE-UHFFFAOYSA-N 2 1 378.605 3.404 20 0 GGADMP CCCOc1cccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000108420691 1411495737 /nfs/dbraw/zinc/49/57/37/1411495737.db2.gz OHVXMUTZMFGNPY-JOCHJYFZSA-N 2 1 395.547 3.463 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cccc4cccnc43)c2)C1 ZINC000108420956 1411495809 /nfs/dbraw/zinc/49/58/09/1411495809.db2.gz PPNZRYVODLVIKN-QFIPXVFZSA-N 2 1 388.515 3.222 20 0 GGADMP CCOc1cccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000108421047 1411497257 /nfs/dbraw/zinc/49/72/57/1411497257.db2.gz OJVFOOVUPWQKGS-NRFANRHFSA-N 2 1 381.520 3.072 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](C)C1)c1ccccc1Cl ZINC000108541072 1411533472 /nfs/dbraw/zinc/53/34/72/1411533472.db2.gz FOTUHLZTWYQUPG-VQIMIIECSA-N 2 1 380.964 3.364 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccccc1)[NH+](C)C ZINC000108711709 1411581743 /nfs/dbraw/zinc/58/17/43/1411581743.db2.gz CMQYHKBQQUMLHL-RTWAWAEBSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)[C@H]1CCC[N@H+]1Cc1ccccc1)[NH+](C)C ZINC000108711709 1411581759 /nfs/dbraw/zinc/58/17/59/1411581759.db2.gz CMQYHKBQQUMLHL-RTWAWAEBSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccc1)[NH+](C)C ZINC000108711707 1411581835 /nfs/dbraw/zinc/58/18/35/1411581835.db2.gz CMQYHKBQQUMLHL-LEWJYISDSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccccc1)[NH+](C)C ZINC000108711707 1411581849 /nfs/dbraw/zinc/58/18/49/1411581849.db2.gz CMQYHKBQQUMLHL-LEWJYISDSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccc1)[NH+](C)C ZINC000108711705 1411582357 /nfs/dbraw/zinc/58/23/57/1411582357.db2.gz CMQYHKBQQUMLHL-SFTDATJTSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccccc1)[NH+](C)C ZINC000108711705 1411582369 /nfs/dbraw/zinc/58/23/69/1411582369.db2.gz CMQYHKBQQUMLHL-SFTDATJTSA-N 2 1 381.520 3.079 20 0 GGADMP CCC[N@H+]1CCC[C@H]1C(=O)Nc1cccc(NC(=O)CC[NH+]2CCCCC2)c1 ZINC000108996158 1411657521 /nfs/dbraw/zinc/65/75/21/1411657521.db2.gz MCCHYGSQIDMQNW-FQEVSTJZSA-N 2 1 386.540 3.314 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1C(=O)NC[C@@H](c1cccc(OC)c1)[NH+](CC)CC ZINC000109444046 1411765129 /nfs/dbraw/zinc/76/51/29/1411765129.db2.gz XTEZLAOGMPMVBA-SFTDATJTSA-N 2 1 375.557 3.459 20 0 GGADMP CC(C)[NH+]1CCN(c2ccc(C(=O)NCC[N@@H+](C)Cc3ccccc3)cc2)CC1 ZINC000109900219 1411817247 /nfs/dbraw/zinc/81/72/47/1411817247.db2.gz JZELJPSKTFBSNX-UHFFFAOYSA-N 2 1 394.563 3.079 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)[C@@H]2CCCC[NH+]2Cc2cccnc2)C1 ZINC000109950996 1411820657 /nfs/dbraw/zinc/82/06/57/1411820657.db2.gz LCWWWXJRTQNCPU-VWPQPMDRSA-N 2 1 386.584 3.310 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)[C@@H]2CCCC[NH+]2Cc2cccnc2)C1 ZINC000109950996 1411820658 /nfs/dbraw/zinc/82/06/58/1411820658.db2.gz LCWWWXJRTQNCPU-VWPQPMDRSA-N 2 1 386.584 3.310 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)[C@@H]2CCCC[N@@H+]2Cc2cccnc2)C1 ZINC000109950996 1411820659 /nfs/dbraw/zinc/82/06/59/1411820659.db2.gz LCWWWXJRTQNCPU-VWPQPMDRSA-N 2 1 386.584 3.310 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)[C@@H]2CCCC[N@H+]2Cc2cccnc2)C1 ZINC000109950996 1411820660 /nfs/dbraw/zinc/82/06/60/1411820660.db2.gz LCWWWXJRTQNCPU-VWPQPMDRSA-N 2 1 386.584 3.310 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)cc1)C(C)C ZINC000110171742 1411835534 /nfs/dbraw/zinc/83/55/34/1411835534.db2.gz GDXFWHRLKKJFPY-QFIPXVFZSA-N 2 1 389.584 3.394 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)cc1)C(C)C ZINC000110171742 1411835536 /nfs/dbraw/zinc/83/55/36/1411835536.db2.gz GDXFWHRLKKJFPY-QFIPXVFZSA-N 2 1 389.584 3.394 20 0 GGADMP CCc1cccc(C)c1NC(=O)C[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110432606 1411850631 /nfs/dbraw/zinc/85/06/31/1411850631.db2.gz CGXCOSUWFDQUIL-KDURUIRLSA-N 2 1 387.568 3.317 20 0 GGADMP CCc1cccc(C)c1NC(=O)C[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110432606 1411850633 /nfs/dbraw/zinc/85/06/33/1411850633.db2.gz CGXCOSUWFDQUIL-KDURUIRLSA-N 2 1 387.568 3.317 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)[C@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000110639379 1411861971 /nfs/dbraw/zinc/86/19/71/1411861971.db2.gz UWIZANULHBRBFC-OALUTQOASA-N 2 1 382.552 3.287 20 0 GGADMP Cc1ccccc1CNC(=O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000110909017 1411876477 /nfs/dbraw/zinc/87/64/77/1411876477.db2.gz KHCYRZMLCCTTMT-UHFFFAOYSA-N 2 1 379.548 3.455 20 0 GGADMP CC[NH+](CC)[C@@H](C(=O)NC[C@H](c1ccccc1OC)[NH+](C)C)c1ccccc1 ZINC000111034651 1411883365 /nfs/dbraw/zinc/88/33/65/1411883365.db2.gz PHFCWWSUPNLWRN-IFMALSPDSA-N 2 1 383.536 3.497 20 0 GGADMP O=C(NCCC[NH+]1CCCCCC1)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000111067398 1411885648 /nfs/dbraw/zinc/88/56/48/1411885648.db2.gz RMBCPAHBAJZFBP-FQEVSTJZSA-N 2 1 375.532 3.420 20 0 GGADMP Cc1nc(C[NH+]2CCC(CNC(=O)[C@H](C(C)C)[NH+]3CCCCC3)CC2)oc1C ZINC000111155223 1411891968 /nfs/dbraw/zinc/89/19/68/1411891968.db2.gz JKJRGRKUULMZOT-NRFANRHFSA-N 2 1 390.572 3.130 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000111386839 1411937217 /nfs/dbraw/zinc/93/72/17/1411937217.db2.gz LPETXIZZVHSGQJ-SFHVURJKSA-N 2 1 396.457 3.218 20 0 GGADMP Cc1nn(-c2ccc(F)cc2)c(Cl)c1C[NH2+]CCCC[N@H+]1CCC[C@@H]1CO ZINC000111386805 1411938311 /nfs/dbraw/zinc/93/83/11/1411938311.db2.gz KVJNUIQAGFEODU-GOSISDBHSA-N 2 1 394.922 3.300 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc(OC)c(O)c3)CC2)cs1 ZINC000111397545 1411940664 /nfs/dbraw/zinc/94/06/64/1411940664.db2.gz QJNMCMMPXINNBA-UHFFFAOYSA-N 2 1 375.538 3.422 20 0 GGADMP Cc1nc(C[NH+]2CCC(CNC(=O)Nc3cccc(C[NH+](C)C)c3)CC2)oc1C ZINC000111431346 1411952909 /nfs/dbraw/zinc/95/29/09/1411952909.db2.gz SISYLDJZILNALZ-UHFFFAOYSA-N 2 1 399.539 3.387 20 0 GGADMP CC[N@@H+]1CCCC[C@H]1CNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000111460809 1411965923 /nfs/dbraw/zinc/96/59/23/1411965923.db2.gz BFTPTUDDCHKPJU-SFHVURJKSA-N 2 1 394.510 3.103 20 0 GGADMP CC[N@H+]1CCCC[C@H]1CNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000111460809 1411965932 /nfs/dbraw/zinc/96/59/32/1411965932.db2.gz BFTPTUDDCHKPJU-SFHVURJKSA-N 2 1 394.510 3.103 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCCC[NH+]2CCCCC2)cn1 ZINC000111466289 1411968654 /nfs/dbraw/zinc/96/86/54/1411968654.db2.gz LDYYLNHUDQQWAH-UHFFFAOYSA-N 2 1 384.528 3.031 20 0 GGADMP O=C(NCCCCC[NH+]1CCCCC1)NCC[N@@H+]1CCc2sccc2C1 ZINC000111475477 1411974750 /nfs/dbraw/zinc/97/47/50/1411974750.db2.gz PFPKITOTFNCPRQ-UHFFFAOYSA-N 2 1 378.586 3.062 20 0 GGADMP O=C(NCCCCC[NH+]1CCCCC1)NCC[N@H+]1CCc2sccc2C1 ZINC000111475477 1411974764 /nfs/dbraw/zinc/97/47/64/1411974764.db2.gz PFPKITOTFNCPRQ-UHFFFAOYSA-N 2 1 378.586 3.062 20 0 GGADMP C[C@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[N@@H+]1CCc2ccccc2C1 ZINC000111562574 1411991991 /nfs/dbraw/zinc/99/19/91/1411991991.db2.gz VLUPWTJBZXWXOK-LJQANCHMSA-N 2 1 377.532 3.345 20 0 GGADMP C[C@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[N@H+]1CCc2ccccc2C1 ZINC000111562574 1411992000 /nfs/dbraw/zinc/99/20/00/1411992000.db2.gz VLUPWTJBZXWXOK-LJQANCHMSA-N 2 1 377.532 3.345 20 0 GGADMP CC(C)[NH2+]C1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000111846016 1412037348 /nfs/dbraw/zinc/03/73/48/1412037348.db2.gz QTSXGNRGFPVAQG-KRWDZBQOSA-N 2 1 378.586 3.132 20 0 GGADMP C[C@@H](CNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)[N@@H+](C)Cc1ccccc1 ZINC000111875336 1412041601 /nfs/dbraw/zinc/04/16/01/1412041601.db2.gz LBCKIIBYOZDJQG-IBGZPJMESA-N 2 1 398.551 3.406 20 0 GGADMP C[C@H](CNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)[N@@H+](C)Cc1ccccc1 ZINC000111875338 1412041654 /nfs/dbraw/zinc/04/16/54/1412041654.db2.gz LBCKIIBYOZDJQG-LJQANCHMSA-N 2 1 398.551 3.406 20 0 GGADMP O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)NC1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000111881846 1412043142 /nfs/dbraw/zinc/04/31/42/1412043142.db2.gz ONWAVPVXZWPLPR-IWTWPRECSA-N 2 1 396.579 3.498 20 0 GGADMP O=C(N[C@@H]1CC[NH+](C2CCCC2)C1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000111881846 1412043147 /nfs/dbraw/zinc/04/31/47/1412043147.db2.gz ONWAVPVXZWPLPR-IWTWPRECSA-N 2 1 396.579 3.498 20 0 GGADMP O=C(N[C@@H]1CC[NH+](C2CCCC2)C1)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000111881846 1412043152 /nfs/dbraw/zinc/04/31/52/1412043152.db2.gz ONWAVPVXZWPLPR-IWTWPRECSA-N 2 1 396.579 3.498 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1ccc(F)cc1 ZINC000112532799 1412164049 /nfs/dbraw/zinc/16/40/49/1412164049.db2.gz VIOYTQXRXFQISS-QGZVFWFLSA-N 2 1 385.483 3.337 20 0 GGADMP C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000112979624 1412250044 /nfs/dbraw/zinc/25/00/44/1412250044.db2.gz XYUBDAGQKXYSAS-BBWFWOEESA-N 2 1 385.512 3.014 20 0 GGADMP C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000112979624 1412250048 /nfs/dbraw/zinc/25/00/48/1412250048.db2.gz XYUBDAGQKXYSAS-BBWFWOEESA-N 2 1 385.512 3.014 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177220605 1428638163 /nfs/dbraw/zinc/63/81/63/1428638163.db2.gz QFRRFQLFUUEDHE-ROUUACIJSA-N 2 1 381.586 3.100 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1C(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CCOCC1 ZINC000113234737 1412279389 /nfs/dbraw/zinc/27/93/89/1412279389.db2.gz CJWLPPUXFXYUNM-FPOVZHCZSA-N 2 1 387.568 3.267 20 0 GGADMP C[C@@H]([NH2+]C1(CNC(=O)[C@@H](c2ccccc2)[NH+](C)C)CCOCC1)c1ccccc1 ZINC000113236229 1412280324 /nfs/dbraw/zinc/28/03/24/1412280324.db2.gz CPBXMWXIWMQHTN-DENIHFKCSA-N 2 1 395.547 3.306 20 0 GGADMP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2csc(COc3ccc(C)cc3)n2)CC1 ZINC000113321833 1412292493 /nfs/dbraw/zinc/29/24/93/1412292493.db2.gz KJLQCLQKPGJTNA-SFHVURJKSA-N 2 1 388.581 3.146 20 0 GGADMP COc1cccc([C@@H](C)[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)c1 ZINC000177231894 1428642768 /nfs/dbraw/zinc/64/27/68/1428642768.db2.gz QHEGADCQGCDGLM-GOSISDBHSA-N 2 1 397.519 3.207 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000113934490 1412355218 /nfs/dbraw/zinc/35/52/18/1412355218.db2.gz BFLDKNWQXIRDIL-RTBURBONSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000113934490 1412355221 /nfs/dbraw/zinc/35/52/21/1412355221.db2.gz BFLDKNWQXIRDIL-RTBURBONSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000113934490 1412355223 /nfs/dbraw/zinc/35/52/23/1412355223.db2.gz BFLDKNWQXIRDIL-RTBURBONSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000113934490 1412355228 /nfs/dbraw/zinc/35/52/28/1412355228.db2.gz BFLDKNWQXIRDIL-RTBURBONSA-N 2 1 383.536 3.259 20 0 GGADMP COc1cccc([C@@H](CNC(=O)CCn2cc[nH+]c2C(C)C)[NH+]2CCCC2)c1 ZINC000114161283 1412384946 /nfs/dbraw/zinc/38/49/46/1412384946.db2.gz STGQOPFAOHDWCG-HXUWFJFHSA-N 2 1 384.524 3.359 20 0 GGADMP COc1cccc([C@H](CNC(=O)CCn2cc[nH+]c2C(C)C)[NH+]2CCCC2)c1 ZINC000114161281 1412385418 /nfs/dbraw/zinc/38/54/18/1412385418.db2.gz STGQOPFAOHDWCG-FQEVSTJZSA-N 2 1 384.524 3.359 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2cc(C(=O)OC)ccc2C)CC1 ZINC000114197142 1412393156 /nfs/dbraw/zinc/39/31/56/1412393156.db2.gz VRGOHVHQJYCIPY-UHFFFAOYSA-N 2 1 389.540 3.164 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2cc(C(=O)OC)ccc2C)CC1 ZINC000114197142 1412393160 /nfs/dbraw/zinc/39/31/60/1412393160.db2.gz VRGOHVHQJYCIPY-UHFFFAOYSA-N 2 1 389.540 3.164 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+](C)CCCOc2ccc(Cl)cc2)CC1 ZINC000114455484 1412436256 /nfs/dbraw/zinc/43/62/56/1412436256.db2.gz ZGJBONNTDHDLLT-UHFFFAOYSA-N 2 1 381.948 3.030 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)NC(=O)Nc2ccccc2F)CC1 ZINC000114475570 1412441394 /nfs/dbraw/zinc/44/13/94/1412441394.db2.gz DZCXSPCVEPFPAC-INIZCTEOSA-N 2 1 392.519 3.306 20 0 GGADMP OCC[NH+]1CCN(CCCC[NH2+]Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000114506458 1412447992 /nfs/dbraw/zinc/44/79/92/1412447992.db2.gz RWTZMZSRRQVEBX-UHFFFAOYSA-N 2 1 391.943 3.080 20 0 GGADMP C[NH+](C)[C@H]1CCCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)C1 ZINC000114604127 1412473277 /nfs/dbraw/zinc/47/32/77/1412473277.db2.gz WPLNQHBZOHTOFG-MSOLQXFVSA-N 2 1 398.473 3.015 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000114781905 1412522786 /nfs/dbraw/zinc/52/27/86/1412522786.db2.gz PTZPUIREIMEVLH-QFIPXVFZSA-N 2 1 380.536 3.212 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(Cl)c3c(c2)OCCO3)[C@H](C)C1 ZINC000115628217 1412738741 /nfs/dbraw/zinc/73/87/41/1412738741.db2.gz VDTKGJZWSVSCRN-CRAIPNDOSA-N 2 1 382.932 3.338 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(Cl)c3c(c2)OCCO3)[C@H](C)C1 ZINC000115628217 1412738748 /nfs/dbraw/zinc/73/87/48/1412738748.db2.gz VDTKGJZWSVSCRN-CRAIPNDOSA-N 2 1 382.932 3.338 20 0 GGADMP CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000115789733 1412789796 /nfs/dbraw/zinc/78/97/96/1412789796.db2.gz MPCSFYSVEUNJAH-SFHVURJKSA-N 2 1 392.975 3.288 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1)c1cccc(OC)c1 ZINC000115790473 1412789968 /nfs/dbraw/zinc/78/99/68/1412789968.db2.gz KJAJVPCMJUDMAU-WIYYLYMNSA-N 2 1 390.572 3.061 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)N(C)C[C@@H]3CCC[N@@H+](C)C3)c2)CC1 ZINC000115819928 1412797907 /nfs/dbraw/zinc/79/79/07/1412797907.db2.gz NKAQROOPDOQBLW-JOCHJYFZSA-N 2 1 386.584 3.402 20 0 GGADMP O=C(COc1ccccc1C[NH2+]C1CC[NH+](CC2CCCC2)CC1)NCC1CC1 ZINC000116337141 1412851212 /nfs/dbraw/zinc/85/12/12/1412851212.db2.gz AWRYNESFMQIKST-UHFFFAOYSA-N 2 1 399.579 3.336 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000177313077 1428683142 /nfs/dbraw/zinc/68/31/42/1428683142.db2.gz WLPSHMXALNDAMV-LPHOPBHVSA-N 2 1 380.964 3.220 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000177313077 1428683148 /nfs/dbraw/zinc/68/31/48/1428683148.db2.gz WLPSHMXALNDAMV-LPHOPBHVSA-N 2 1 380.964 3.220 20 0 GGADMP C[N@@H+](CCNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)Cc1ccccc1 ZINC000116575893 1412880493 /nfs/dbraw/zinc/88/04/93/1412880493.db2.gz KDHGCDLGLDJERG-UHFFFAOYSA-N 2 1 383.561 3.097 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[NH+](C3CCCC3)CC2)cc1)[NH+]1CCOCC1 ZINC000118030924 1413099379 /nfs/dbraw/zinc/09/93/79/1413099379.db2.gz YCGUXZVFKGEERV-SFHVURJKSA-N 2 1 386.540 3.172 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCC(C)(C)[NH+]2CCCCC2)cc1)[NH+]1CCOCC1 ZINC000118031391 1413099455 /nfs/dbraw/zinc/09/94/55/1413099455.db2.gz SRLBHKHOPNPKJQ-GOSISDBHSA-N 2 1 388.556 3.466 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)CC1 ZINC000118031256 1413099916 /nfs/dbraw/zinc/09/99/16/1413099916.db2.gz WEFRDOODZAZMNI-GOSISDBHSA-N 2 1 388.556 3.418 20 0 GGADMP O=C1[C@H]([NH+]2CCC(OCC[NH+]3CCCC3)CC2)CCN1c1cccc(Cl)c1 ZINC000177362280 1428704689 /nfs/dbraw/zinc/70/46/89/1428704689.db2.gz DZBMDHZKIGWCJR-HXUWFJFHSA-N 2 1 391.943 3.022 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)CC1 ZINC000118421214 1413159812 /nfs/dbraw/zinc/15/98/12/1413159812.db2.gz ZCLJVDAEPCSJQS-LAUBAEHRSA-N 2 1 375.582 3.154 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)CC1 ZINC000118421214 1413159814 /nfs/dbraw/zinc/15/98/14/1413159814.db2.gz ZCLJVDAEPCSJQS-LAUBAEHRSA-N 2 1 375.582 3.154 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000118798829 1413222912 /nfs/dbraw/zinc/22/29/12/1413222912.db2.gz DGICAEGJGGALMS-SFHVURJKSA-N 2 1 376.545 3.213 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000118841299 1413242158 /nfs/dbraw/zinc/24/21/58/1413242158.db2.gz WVEDFAOCVIGKNZ-IBGZPJMESA-N 2 1 383.540 3.091 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000118841299 1413242167 /nfs/dbraw/zinc/24/21/67/1413242167.db2.gz WVEDFAOCVIGKNZ-IBGZPJMESA-N 2 1 383.540 3.091 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000118841299 1413242180 /nfs/dbraw/zinc/24/21/80/1413242180.db2.gz WVEDFAOCVIGKNZ-IBGZPJMESA-N 2 1 383.540 3.091 20 0 GGADMP Cc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cnn1-c1cc[nH+]cc1 ZINC000118942729 1413267831 /nfs/dbraw/zinc/26/78/31/1413267831.db2.gz QAZQSCCTIVEYKZ-HTAPYJJXSA-N 2 1 389.503 3.216 20 0 GGADMP Cc1c(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cnn1-c1cc[nH+]cc1 ZINC000118942729 1413267837 /nfs/dbraw/zinc/26/78/37/1413267837.db2.gz QAZQSCCTIVEYKZ-HTAPYJJXSA-N 2 1 389.503 3.216 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1)c1cccc(OC)c1 ZINC000119191148 1413371230 /nfs/dbraw/zinc/37/12/30/1413371230.db2.gz LQPLMDLISNSCBR-DJPFJPOOSA-N 2 1 388.556 3.003 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000119290622 1413400683 /nfs/dbraw/zinc/40/06/83/1413400683.db2.gz CGGQWZUJKJJIFU-VQTJNVASSA-N 2 1 375.532 3.132 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)C1 ZINC000119290622 1413400686 /nfs/dbraw/zinc/40/06/86/1413400686.db2.gz CGGQWZUJKJJIFU-VQTJNVASSA-N 2 1 375.532 3.132 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000119290622 1413400690 /nfs/dbraw/zinc/40/06/90/1413400690.db2.gz CGGQWZUJKJJIFU-VQTJNVASSA-N 2 1 375.532 3.132 20 0 GGADMP C[C@H](NC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)C(C)(C)C[NH+](C)C ZINC000119391560 1413432813 /nfs/dbraw/zinc/43/28/13/1413432813.db2.gz PQLWESCQTUKULM-HNNXBMFYSA-N 2 1 396.526 3.205 20 0 GGADMP C[C@@H](NC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)C(C)(C)C[NH+](C)C ZINC000119391692 1413432951 /nfs/dbraw/zinc/43/29/51/1413432951.db2.gz PQLWESCQTUKULM-OAHLLOKOSA-N 2 1 396.526 3.205 20 0 GGADMP C[C@@H](NC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C[NH+](C)C ZINC000119424272 1413443042 /nfs/dbraw/zinc/44/30/42/1413443042.db2.gz KJQIWPJSARIZHE-IAGOWNOFSA-N 2 1 380.602 3.236 20 0 GGADMP O=C(CCc1ccccc1)N1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000119462482 1413455238 /nfs/dbraw/zinc/45/52/38/1413455238.db2.gz VAJPBIRVTINZIP-DEOSSOPVSA-N 2 1 391.559 3.474 20 0 GGADMP C[C@]1(CNC(=O)N2CCC([NH+]3CCCC3)CC2)CCC[N@H+]1Cc1ccccc1 ZINC000119632729 1413509823 /nfs/dbraw/zinc/50/98/23/1413509823.db2.gz BYHVQVWJRFTNLZ-HSZRJFAPSA-N 2 1 384.568 3.311 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000119774521 1413564393 /nfs/dbraw/zinc/56/43/93/1413564393.db2.gz SRPWMYCJLJZRGB-CTNGQTDRSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000119774521 1413564398 /nfs/dbraw/zinc/56/43/98/1413564398.db2.gz SRPWMYCJLJZRGB-CTNGQTDRSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000119774521 1413564405 /nfs/dbraw/zinc/56/44/05/1413564405.db2.gz SRPWMYCJLJZRGB-CTNGQTDRSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000119774521 1413564412 /nfs/dbraw/zinc/56/44/12/1413564412.db2.gz SRPWMYCJLJZRGB-CTNGQTDRSA-N 2 1 375.532 3.274 20 0 GGADMP C[C@]1(C(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CCC[NH2+]C1 ZINC000119900020 1413609995 /nfs/dbraw/zinc/60/99/95/1413609995.db2.gz MZIGDHJLMYRUMS-IBGZPJMESA-N 2 1 383.458 3.129 20 0 GGADMP COc1cccc([C@H](CNC(=O)N(C)CCCn2cc[nH+]c2C)[NH+]2CCCC2)c1 ZINC000120107263 1413690117 /nfs/dbraw/zinc/69/01/17/1413690117.db2.gz GBNHHBVNDWRHPS-NRFANRHFSA-N 2 1 399.539 3.069 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)N[C@@H]2CCOc3ccccc32)CC1 ZINC000120240077 1413746917 /nfs/dbraw/zinc/74/69/17/1413746917.db2.gz MMHWELLBUMCRHV-GHTZIAJQSA-N 2 1 387.568 3.459 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000120248486 1413750324 /nfs/dbraw/zinc/75/03/24/1413750324.db2.gz FSQVVKZGVSFDRT-UHFFFAOYSA-N 2 1 383.540 3.409 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000120388059 1413807298 /nfs/dbraw/zinc/80/72/98/1413807298.db2.gz QDMRZPHMYJAPCX-MOPGFXCFSA-N 2 1 390.597 3.230 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000120530206 1413837149 /nfs/dbraw/zinc/83/71/49/1413837149.db2.gz GJZCLEOLAIEAKL-SFHVURJKSA-N 2 1 389.569 3.197 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000120530206 1413837151 /nfs/dbraw/zinc/83/71/51/1413837151.db2.gz GJZCLEOLAIEAKL-SFHVURJKSA-N 2 1 389.569 3.197 20 0 GGADMP CN(CC[C@H]1CCC[N@H+]1C)Cc1cccc(NS(=O)(=O)c2ccccc2)c1 ZINC000120565604 1413844310 /nfs/dbraw/zinc/84/43/10/1413844310.db2.gz UQKDRTRFEFOIBA-HXUWFJFHSA-N 2 1 387.549 3.404 20 0 GGADMP CCc1noc(C2CCC([NH2+]Cc3ccccc3C[N@H+]3CCC[C@@H]3CO)CC2)n1 ZINC000120639060 1413862701 /nfs/dbraw/zinc/86/27/01/1413862701.db2.gz LCMNLIKXIGFITI-FBPXKMNZSA-N 2 1 398.551 3.405 20 0 GGADMP CC[C@H](Cc1ccc(OC)c(OC)c1)[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000120648891 1413865697 /nfs/dbraw/zinc/86/56/97/1413865697.db2.gz OHVFHYPXGBZEHD-YADHBBJMSA-N 2 1 398.547 3.381 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000120685190 1413874427 /nfs/dbraw/zinc/87/44/27/1413874427.db2.gz IKSZTBPBSZICJI-GCJKJVERSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000120685190 1413874433 /nfs/dbraw/zinc/87/44/33/1413874433.db2.gz IKSZTBPBSZICJI-GCJKJVERSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@@H]1N(C)C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000120685190 1413874434 /nfs/dbraw/zinc/87/44/34/1413874434.db2.gz IKSZTBPBSZICJI-GCJKJVERSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@@H]1N(C)C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000120685190 1413874438 /nfs/dbraw/zinc/87/44/38/1413874438.db2.gz IKSZTBPBSZICJI-GCJKJVERSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000120718371 1413884256 /nfs/dbraw/zinc/88/42/56/1413884256.db2.gz ASNPTVUOCCGBBV-OAHLLOKOSA-N 2 1 390.915 3.495 20 0 GGADMP Cc1cc(-c2noc([C@H](C)[NH+]3CCC(C[NH+]4CCOCC4)CC3)n2)ccc1F ZINC000120721526 1413884613 /nfs/dbraw/zinc/88/46/13/1413884613.db2.gz XTHHLHPJZLMWKM-INIZCTEOSA-N 2 1 388.487 3.289 20 0 GGADMP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Br)c(OC(F)F)c(OC)c2)C1 ZINC000120809773 1413910397 /nfs/dbraw/zinc/91/03/97/1413910397.db2.gz MJFGZPCYLXVYAR-LLVKDONJSA-N 2 1 393.272 3.491 20 0 GGADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2cc(Br)c(OC(F)F)c(OC)c2)C1 ZINC000120809773 1413910399 /nfs/dbraw/zinc/91/03/99/1413910399.db2.gz MJFGZPCYLXVYAR-LLVKDONJSA-N 2 1 393.272 3.491 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](CC(=O)N(C3CC3)C3CCCC3)CC2)C[C@H](C)O1 ZINC000177491180 1428766885 /nfs/dbraw/zinc/76/68/85/1428766885.db2.gz LZLRXCRFPUYNDB-KDURUIRLSA-N 2 1 391.600 3.131 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1cccs1 ZINC000177497972 1428770202 /nfs/dbraw/zinc/77/02/02/1428770202.db2.gz LUCGJBZNCKTONF-KSZLIROESA-N 2 1 393.597 3.137 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1cccs1 ZINC000177497972 1428770206 /nfs/dbraw/zinc/77/02/06/1428770206.db2.gz LUCGJBZNCKTONF-KSZLIROESA-N 2 1 393.597 3.137 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](CCc3nc(-c4ccccc4)no3)CC2)C[C@H](C)O1 ZINC000177499343 1428770605 /nfs/dbraw/zinc/77/06/05/1428770605.db2.gz AAKCRAFNEABPKE-KDURUIRLSA-N 2 1 398.551 3.490 20 0 GGADMP COC(=O)c1oc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000177504994 1428773925 /nfs/dbraw/zinc/77/39/25/1428773925.db2.gz KBRJUARYWIIMDZ-CALCHBBNSA-N 2 1 378.513 3.086 20 0 GGADMP Cc1cccc(NC(=O)C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000177507220 1428774459 /nfs/dbraw/zinc/77/44/59/1428774459.db2.gz WTXWIHFTGFMMJH-KDURUIRLSA-N 2 1 387.568 3.453 20 0 GGADMP Cc1cccc(NC(=O)C[NH+]2CCC(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000177507220 1428774463 /nfs/dbraw/zinc/77/44/63/1428774463.db2.gz WTXWIHFTGFMMJH-KDURUIRLSA-N 2 1 387.568 3.453 20 0 GGADMP Cc1cccc(NC(=O)C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c1C ZINC000177507235 1428774621 /nfs/dbraw/zinc/77/46/21/1428774621.db2.gz WTXWIHFTGFMMJH-RTBURBONSA-N 2 1 387.568 3.453 20 0 GGADMP C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(CC[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000177509050 1428775188 /nfs/dbraw/zinc/77/51/88/1428775188.db2.gz KCCGNOJMNUCANL-BZSNNMDCSA-N 2 1 399.539 3.404 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N(CC[NH+](C)C)Cc3ccco3)cc2)C[C@H](C)O1 ZINC000121231756 1414052465 /nfs/dbraw/zinc/05/24/65/1414052465.db2.gz IUDYSOWVLYPHKO-OALUTQOASA-N 2 1 399.535 3.093 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000121490447 1414146971 /nfs/dbraw/zinc/14/69/71/1414146971.db2.gz UNXWURKLKFXLSZ-KGLIPLIRSA-N 2 1 378.904 3.497 20 0 GGADMP C[N@H+](CCC(=O)NC(=O)Nc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000121628921 1414205961 /nfs/dbraw/zinc/20/59/61/1414205961.db2.gz JBWCGGGCNAVPKD-UHFFFAOYSA-N 2 1 394.519 3.321 20 0 GGADMP C[N@@H+](CCC(=O)NC(=O)Nc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000121628921 1414205966 /nfs/dbraw/zinc/20/59/66/1414205966.db2.gz JBWCGGGCNAVPKD-UHFFFAOYSA-N 2 1 394.519 3.321 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000121641264 1414209499 /nfs/dbraw/zinc/20/94/99/1414209499.db2.gz XVFWOGVBAKNXJO-GOSISDBHSA-N 2 1 390.597 3.335 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000121641264 1414209502 /nfs/dbraw/zinc/20/95/02/1414209502.db2.gz XVFWOGVBAKNXJO-GOSISDBHSA-N 2 1 390.597 3.335 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000121641444 1414209599 /nfs/dbraw/zinc/20/95/99/1414209599.db2.gz XVFWOGVBAKNXJO-SFHVURJKSA-N 2 1 390.597 3.335 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000121641444 1414209605 /nfs/dbraw/zinc/20/96/05/1414209605.db2.gz XVFWOGVBAKNXJO-SFHVURJKSA-N 2 1 390.597 3.335 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)c1ccsc1 ZINC000121677105 1414220530 /nfs/dbraw/zinc/22/05/30/1414220530.db2.gz UEZMHZGEAFXJLN-LJQANCHMSA-N 2 1 383.521 3.450 20 0 GGADMP Cc1ccccc1O[C@@H]1CCCC[C@H]1[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000121685026 1414223143 /nfs/dbraw/zinc/22/31/43/1414223143.db2.gz GVSROCJABGQJCN-IFMALSPDSA-N 2 1 395.551 3.017 20 0 GGADMP C[C@@H](CC(=O)Nc1ccccc1)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000121690761 1414225108 /nfs/dbraw/zinc/22/51/08/1414225108.db2.gz SGPAIFBYCZYTAW-OALUTQOASA-N 2 1 381.520 3.414 20 0 GGADMP C[C@@H](CC(=O)Nc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000121690761 1414225118 /nfs/dbraw/zinc/22/51/18/1414225118.db2.gz SGPAIFBYCZYTAW-OALUTQOASA-N 2 1 381.520 3.414 20 0 GGADMP CC(=O)Nc1ccc(NC(=O)C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC000121799662 1414260830 /nfs/dbraw/zinc/26/08/30/1414260830.db2.gz HIHDSOGTDNKGIU-UHFFFAOYSA-N 2 1 386.540 3.172 20 0 GGADMP COc1ccc(NC(=O)C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(OC)c1 ZINC000121858716 1414281046 /nfs/dbraw/zinc/28/10/46/1414281046.db2.gz MDHPGHGZGHZQMN-UHFFFAOYSA-N 2 1 389.540 3.230 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)N2CCC(Cc3[nH+]ccn3C)CC2)cc1)C1CC1 ZINC000121890960 1414292788 /nfs/dbraw/zinc/29/27/88/1414292788.db2.gz OFAYTPQRXDLGIC-UHFFFAOYSA-N 2 1 380.536 3.499 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CCC(Cc3[nH+]ccn3C)CC2)cc1)C1CC1 ZINC000121890960 1414292795 /nfs/dbraw/zinc/29/27/95/1414292795.db2.gz OFAYTPQRXDLGIC-UHFFFAOYSA-N 2 1 380.536 3.499 20 0 GGADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)CC1 ZINC000121950132 1414319634 /nfs/dbraw/zinc/31/96/34/1414319634.db2.gz FPCFCFRYSKZXQE-QGZVFWFLSA-N 2 1 381.586 3.242 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2nc3ccccc3c(=O)[nH]2)CC1 ZINC000122054045 1414350940 /nfs/dbraw/zinc/35/09/40/1414350940.db2.gz QKKDYBNBCMXQSE-KRWDZBQOSA-N 2 1 386.540 3.055 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)c2nc3ccccc3c(=O)[nH]2)CC1 ZINC000122054045 1414350950 /nfs/dbraw/zinc/35/09/50/1414350950.db2.gz QKKDYBNBCMXQSE-KRWDZBQOSA-N 2 1 386.540 3.055 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)c2nc(-c3cccnc3)no2)CC1 ZINC000122071878 1414354706 /nfs/dbraw/zinc/35/47/06/1414354706.db2.gz OIQDUGKCINNBCR-QGZVFWFLSA-N 2 1 387.528 3.263 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)c2nc(-c3cccnc3)no2)CC1 ZINC000122071705 1414355128 /nfs/dbraw/zinc/35/51/28/1414355128.db2.gz OIQDUGKCINNBCR-KRWDZBQOSA-N 2 1 387.528 3.263 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](CC(=O)N2CCCc3ccccc32)CC1 ZINC000122159293 1414376222 /nfs/dbraw/zinc/37/62/22/1414376222.db2.gz YNAHOCJNOBRTTE-UHFFFAOYSA-N 2 1 387.568 3.036 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)N2[C@H](C)CCC[C@H]2C)CC1 ZINC000122163364 1414376944 /nfs/dbraw/zinc/37/69/44/1414376944.db2.gz VLKATONIOFRQSZ-VAMGGRTRSA-N 2 1 381.605 3.235 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2nc(C)c(C)s2)CC1 ZINC000122186680 1414382943 /nfs/dbraw/zinc/38/29/43/1414382943.db2.gz BBZFDCKZXAPWGX-INIZCTEOSA-N 2 1 396.601 3.157 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2nc(C)c(C)s2)CC1 ZINC000122186680 1414382952 /nfs/dbraw/zinc/38/29/52/1414382952.db2.gz BBZFDCKZXAPWGX-INIZCTEOSA-N 2 1 396.601 3.157 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](Cc2cnn(C)c2C(F)(F)F)CC1 ZINC000122205236 1414387639 /nfs/dbraw/zinc/38/76/39/1414387639.db2.gz OAPXPCYIXOTLRS-UHFFFAOYSA-N 2 1 376.467 3.009 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cnn(C)c2C(F)(F)F)CC1 ZINC000122205236 1414387650 /nfs/dbraw/zinc/38/76/50/1414387650.db2.gz OAPXPCYIXOTLRS-UHFFFAOYSA-N 2 1 376.467 3.009 20 0 GGADMP Cc1cc(N2CCC([NH2+]C3CCN(C(=O)OC(C)(C)C)CC3)CC2)nc(C)[nH+]1 ZINC000177604492 1428808547 /nfs/dbraw/zinc/80/85/47/1428808547.db2.gz IUZJPXLMFNEAET-UHFFFAOYSA-N 2 1 389.544 3.051 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1NC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000122422291 1414455042 /nfs/dbraw/zinc/45/50/42/1414455042.db2.gz UAZXYPKWYCEGHP-LJQANCHMSA-N 2 1 375.476 3.426 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000122422291 1414455048 /nfs/dbraw/zinc/45/50/48/1414455048.db2.gz UAZXYPKWYCEGHP-LJQANCHMSA-N 2 1 375.476 3.426 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccc3c(c2)OCCO3)[C@H](C)C1 ZINC000122876704 1414586986 /nfs/dbraw/zinc/58/69/86/1414586986.db2.gz CFWSCTJTOYKLOX-QUCCMNQESA-N 2 1 390.568 3.462 20 0 GGADMP C[C@H](CNC(=O)NCc1cccc(C[NH+](C)C)c1)[N@@H+]1CCc2sccc2C1 ZINC000123191188 1414664733 /nfs/dbraw/zinc/66/47/33/1414664733.db2.gz HVVSRUJQTLDFPY-MRXNPFEDSA-N 2 1 386.565 3.056 20 0 GGADMP C[C@H](CNC(=O)NCc1cccc(C[NH+](C)C)c1)[N@H+]1CCc2sccc2C1 ZINC000123191188 1414664739 /nfs/dbraw/zinc/66/47/39/1414664739.db2.gz HVVSRUJQTLDFPY-MRXNPFEDSA-N 2 1 386.565 3.056 20 0 GGADMP CC(C)[NH+]1CCN(c2cccc(NC(=O)[C@@H](c3ccccc3)[NH+](C)C)c2)CC1 ZINC000123244519 1414677344 /nfs/dbraw/zinc/67/73/44/1414677344.db2.gz VMFSLPSBGPAZJA-JOCHJYFZSA-N 2 1 380.536 3.458 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH+]2CCC(CCC[NH+](C)C)CC2)c1 ZINC000123321599 1414696436 /nfs/dbraw/zinc/69/64/36/1414696436.db2.gz MYZICRMWTSAQGR-INIZCTEOSA-N 2 1 377.529 3.085 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000177688831 1428833741 /nfs/dbraw/zinc/83/37/41/1428833741.db2.gz KOVDAJSHWGCINB-HXUWFJFHSA-N 2 1 385.552 3.154 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000177688831 1428833743 /nfs/dbraw/zinc/83/37/43/1428833743.db2.gz KOVDAJSHWGCINB-HXUWFJFHSA-N 2 1 385.552 3.154 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000177688848 1428833812 /nfs/dbraw/zinc/83/38/12/1428833812.db2.gz KOVDAJSHWGCINB-FQEVSTJZSA-N 2 1 385.552 3.154 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000177688848 1428833814 /nfs/dbraw/zinc/83/38/14/1428833814.db2.gz KOVDAJSHWGCINB-FQEVSTJZSA-N 2 1 385.552 3.154 20 0 GGADMP C[C@@H](NC(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)c1ccc2c(c1)CCCC2 ZINC000123529070 1414764153 /nfs/dbraw/zinc/76/41/53/1414764153.db2.gz URGTVMBFYKKORW-RTBURBONSA-N 2 1 394.563 3.431 20 0 GGADMP C[C@@H](NC(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)c1ccc2c(c1)CCCC2 ZINC000123529070 1414764165 /nfs/dbraw/zinc/76/41/65/1414764165.db2.gz URGTVMBFYKKORW-RTBURBONSA-N 2 1 394.563 3.431 20 0 GGADMP CC[C@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000123921751 1414849954 /nfs/dbraw/zinc/84/99/54/1414849954.db2.gz BJMRILBPXDCZQJ-GOTSBHOMSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000123921751 1414849960 /nfs/dbraw/zinc/84/99/60/1414849960.db2.gz BJMRILBPXDCZQJ-GOTSBHOMSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000123921984 1414850090 /nfs/dbraw/zinc/85/00/90/1414850090.db2.gz BJMRILBPXDCZQJ-PKTZIBPZSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000123921984 1414850091 /nfs/dbraw/zinc/85/00/91/1414850091.db2.gz BJMRILBPXDCZQJ-PKTZIBPZSA-N 2 1 395.547 3.158 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(NS(C)(=O)=O)cc2)c1 ZINC000123940602 1414853801 /nfs/dbraw/zinc/85/38/01/1414853801.db2.gz JJTKFJSRXOWWPR-INIZCTEOSA-N 2 1 375.538 3.361 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(S(C)(=O)=O)c(OC)c2)c1 ZINC000123941335 1414854165 /nfs/dbraw/zinc/85/41/65/1414854165.db2.gz FMNKWZRMHHLURJ-MRXNPFEDSA-N 2 1 390.549 3.401 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(S(C)(=O)=O)c(OC)c2)c1 ZINC000123941121 1414854315 /nfs/dbraw/zinc/85/43/15/1414854315.db2.gz FMNKWZRMHHLURJ-INIZCTEOSA-N 2 1 390.549 3.401 20 0 GGADMP CC(C)CN(CC[NH+](C)C)C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000124067604 1414879351 /nfs/dbraw/zinc/87/93/51/1414879351.db2.gz WEGKJOAMSCVDLY-UHFFFAOYSA-N 2 1 396.526 3.158 20 0 GGADMP C[NH+]1CCC2(CC1)NC(=O)N(C[N@@H+]1CCC[C@H]1c1ccc(C(C)(C)C)cc1)C2=O ZINC000124151948 1414896198 /nfs/dbraw/zinc/89/61/98/1414896198.db2.gz XJTYBHCCJLDBAA-IBGZPJMESA-N 2 1 398.551 3.095 20 0 GGADMP C[NH+]1CCC2(CC1)NC(=O)N(C[N@H+]1CCC[C@H]1c1ccc(C(C)(C)C)cc1)C2=O ZINC000124151948 1414896200 /nfs/dbraw/zinc/89/62/00/1414896200.db2.gz XJTYBHCCJLDBAA-IBGZPJMESA-N 2 1 398.551 3.095 20 0 GGADMP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CC1CCN(CC[NH+](C)C)CC1 ZINC000124465852 1414974970 /nfs/dbraw/zinc/97/49/70/1414974970.db2.gz UEWXCJKTNUXLEZ-MRXNPFEDSA-N 2 1 387.597 3.438 20 0 GGADMP Cc1ccc(NC(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)c(OCC[NH+](C)C)c1 ZINC000124484234 1414978950 /nfs/dbraw/zinc/97/89/50/1414978950.db2.gz AEZMNIAWQAIABI-GOSISDBHSA-N 2 1 376.545 3.035 20 0 GGADMP CCO[C@H](C)c1nc(CN2CC[NH+](CCCCn3cc[nH+]c3C)CC2)cs1 ZINC000124510462 1414984326 /nfs/dbraw/zinc/98/43/26/1414984326.db2.gz DIINVHJYWYEIDE-QGZVFWFLSA-N 2 1 391.585 3.344 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)NCc2ccn3ccnc3c2)CC1 ZINC000177769414 1428854167 /nfs/dbraw/zinc/85/41/67/1428854167.db2.gz RIGHSDBBRIGTDI-UHFFFAOYSA-N 2 1 391.519 3.388 20 0 GGADMP CCN(CC)C(=O)C[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000124643585 1415011839 /nfs/dbraw/zinc/01/18/39/1415011839.db2.gz OLUQCBHVTJUUDP-GBESFXJTSA-N 2 1 375.557 3.032 20 0 GGADMP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(NC(=O)CC[NH+]3CCOCC3)c1)CC2 ZINC000125038014 1415096973 /nfs/dbraw/zinc/09/69/73/1415096973.db2.gz KZNCXWUMXNDROI-QHCPKHFHSA-N 2 1 393.531 3.433 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)c1 ZINC000125042033 1415098043 /nfs/dbraw/zinc/09/80/43/1415098043.db2.gz SEJGGQXWTQVBSB-LEWJYISDSA-N 2 1 385.552 3.406 20 0 GGADMP COc1ccc(C[N@H+]2CCCN(C(=O)c3ccc(C[NH+](C)C)cc3)CC2)cc1 ZINC000125058146 1415101292 /nfs/dbraw/zinc/10/12/92/1415101292.db2.gz QMAAMBFUHSOYEN-UHFFFAOYSA-N 2 1 381.520 3.105 20 0 GGADMP OC[C@H]1c2ccccc2CC[NH+]1CCCCC[N@H+]1CCc2ccccc2[C@@H]1CO ZINC000177827361 1428866091 /nfs/dbraw/zinc/86/60/91/1428866091.db2.gz JRWCHDQKZBQBPI-DQEYMECFSA-N 2 1 394.559 3.340 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)N2CCC(Cc3[nH+]ccn3C)CC2)C1 ZINC000125277569 1415150378 /nfs/dbraw/zinc/15/03/78/1415150378.db2.gz FMOWBTRJGJWCPB-HDICACEKSA-N 2 1 389.588 3.141 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)N2CCC(Cc3[nH+]ccn3C)CC2)C1 ZINC000125277569 1415150385 /nfs/dbraw/zinc/15/03/85/1415150385.db2.gz FMOWBTRJGJWCPB-HDICACEKSA-N 2 1 389.588 3.141 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CCN(c3cc(C)[nH+]c4ccc(F)cc43)CC2)CC1 ZINC000125286752 1415152817 /nfs/dbraw/zinc/15/28/17/1415152817.db2.gz SNSSISITMLBDOV-UHFFFAOYSA-N 2 1 398.526 3.453 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000177849175 1428872147 /nfs/dbraw/zinc/87/21/47/1428872147.db2.gz NJXIMTSLKPHUBB-HXUWFJFHSA-N 2 1 386.584 3.402 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)C1 ZINC000177849327 1428872166 /nfs/dbraw/zinc/87/21/66/1428872166.db2.gz XRZDMVAXRDFOIE-VQTJNVASSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000177849327 1428872168 /nfs/dbraw/zinc/87/21/68/1428872168.db2.gz XRZDMVAXRDFOIE-VQTJNVASSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000177849327 1428872169 /nfs/dbraw/zinc/87/21/69/1428872169.db2.gz XRZDMVAXRDFOIE-VQTJNVASSA-N 2 1 386.584 3.402 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000177849121 1428872255 /nfs/dbraw/zinc/87/22/55/1428872255.db2.gz PXCKYPJOVIDHLP-QFIPXVFZSA-N 2 1 386.584 3.402 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000177851108 1428872551 /nfs/dbraw/zinc/87/25/51/1428872551.db2.gz REKAXZCUNUNWDA-XLIONFOSSA-N 2 1 392.975 3.460 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000177871272 1428878751 /nfs/dbraw/zinc/87/87/51/1428878751.db2.gz ZJAFRTJRZMJZHB-JOCHJYFZSA-N 2 1 386.584 3.402 20 0 GGADMP COCC[N@@H+](C)CCCC1CCN(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC1 ZINC000125648179 1415245701 /nfs/dbraw/zinc/24/57/01/1415245701.db2.gz XFEUFJLXPODGHY-UHFFFAOYSA-N 2 1 396.620 3.076 20 0 GGADMP CCOC(=O)N1CCC([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000125681818 1415253784 /nfs/dbraw/zinc/25/37/84/1415253784.db2.gz KPHOSPXHHXPQSF-UHFFFAOYSA-N 2 1 377.504 3.043 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000125692728 1415255852 /nfs/dbraw/zinc/25/58/52/1415255852.db2.gz RIFYUIJWDGEIBZ-QHCPKHFHSA-N 2 1 393.531 3.164 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000125692728 1415255857 /nfs/dbraw/zinc/25/58/57/1415255857.db2.gz RIFYUIJWDGEIBZ-QHCPKHFHSA-N 2 1 393.531 3.164 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2C[NH2+]C2CCN(CC(F)(F)F)CC2)C[C@H](C)O1 ZINC000177888918 1428884368 /nfs/dbraw/zinc/88/43/68/1428884368.db2.gz COSVPOYCSYQBMS-CALCHBBNSA-N 2 1 399.501 3.412 20 0 GGADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000125753617 1415270918 /nfs/dbraw/zinc/27/09/18/1415270918.db2.gz KLMBXHUBIFCSSX-GOEBONIOSA-N 2 1 381.446 3.412 20 0 GGADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000125753617 1415270922 /nfs/dbraw/zinc/27/09/22/1415270922.db2.gz KLMBXHUBIFCSSX-GOEBONIOSA-N 2 1 381.446 3.412 20 0 GGADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000125753617 1415270931 /nfs/dbraw/zinc/27/09/31/1415270931.db2.gz KLMBXHUBIFCSSX-GOEBONIOSA-N 2 1 381.446 3.412 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)cc2)C1 ZINC000125782547 1415279780 /nfs/dbraw/zinc/27/97/80/1415279780.db2.gz QRIPAIRCOJBWFG-KNKQGSTJSA-N 2 1 398.595 3.448 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125791303 1415281451 /nfs/dbraw/zinc/28/14/51/1415281451.db2.gz PNMOXHKRGRJNBY-MOPGFXCFSA-N 2 1 395.613 3.488 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125791916 1415282138 /nfs/dbraw/zinc/28/21/38/1415282138.db2.gz PNMOXHKRGRJNBY-RBUKOAKNSA-N 2 1 395.613 3.488 20 0 GGADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000125894378 1415307292 /nfs/dbraw/zinc/30/72/92/1415307292.db2.gz XDCWKAAAZRCOLQ-PMACEKPBSA-N 2 1 387.568 3.145 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)N[C@@H]2CC[NH+](CC3CC3)C2)CC1 ZINC000125923992 1415314163 /nfs/dbraw/zinc/31/41/63/1415314163.db2.gz AVTWQJBQXNQMQW-JOCHJYFZSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)N[C@@H]2CC[N@H+](CC3CC3)C2)CC1 ZINC000125923992 1415314168 /nfs/dbraw/zinc/31/41/68/1415314168.db2.gz AVTWQJBQXNQMQW-JOCHJYFZSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000125923992 1415314177 /nfs/dbraw/zinc/31/41/77/1415314177.db2.gz AVTWQJBQXNQMQW-JOCHJYFZSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C[N@@H+]1C1CC1 ZINC000126175524 1415377387 /nfs/dbraw/zinc/37/73/87/1415377387.db2.gz WWNPZMGHWNJJLO-FXAWDEMLSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C[N@H+]1C1CC1 ZINC000126175524 1415377391 /nfs/dbraw/zinc/37/73/91/1415377391.db2.gz WWNPZMGHWNJJLO-FXAWDEMLSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C[NH+]1C1CC1 ZINC000126175524 1415377394 /nfs/dbraw/zinc/37/73/94/1415377394.db2.gz WWNPZMGHWNJJLO-FXAWDEMLSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C[NH+]1C1CC1 ZINC000126175524 1415377401 /nfs/dbraw/zinc/37/74/01/1415377401.db2.gz WWNPZMGHWNJJLO-FXAWDEMLSA-N 2 1 396.535 3.336 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)CC(=O)Nc2cccnc2Cl)cn1 ZINC000126302221 1415411798 /nfs/dbraw/zinc/41/17/98/1415411798.db2.gz QBYZNRXPVHYLLB-ZDUSSCGKSA-N 2 1 384.871 3.131 20 0 GGADMP C[N@@H+](CC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)[C@H]1CCSC1 ZINC000126330423 1415419186 /nfs/dbraw/zinc/41/91/86/1415419186.db2.gz QISSRZXAPBQRSN-FQEVSTJZSA-N 2 1 375.582 3.116 20 0 GGADMP CCN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(-n4cccn4)cc3)cc2)CC1 ZINC000126353746 1415424954 /nfs/dbraw/zinc/42/49/54/1415424954.db2.gz SGNKKURIYAXBQM-UHFFFAOYSA-N 2 1 389.547 3.300 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+][C@@H](C)CC(=O)Nc2ccccc2)CC1 ZINC000126359694 1415426754 /nfs/dbraw/zinc/42/67/54/1415426754.db2.gz XZMQJDLWRJZUDO-FQEVSTJZSA-N 2 1 394.563 3.331 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc2c(c1)CCO2 ZINC000178006255 1428930025 /nfs/dbraw/zinc/93/00/25/1428930025.db2.gz NBYBKNZAFUFXNJ-JTSKRJEESA-N 2 1 393.531 3.170 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1)c1ccco1 ZINC000126399873 1415438923 /nfs/dbraw/zinc/43/89/23/1415438923.db2.gz MDUUWOVWOYGHJZ-LJQANCHMSA-N 2 1 384.524 3.018 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1)c1ccco1 ZINC000126399873 1415438928 /nfs/dbraw/zinc/43/89/28/1415438928.db2.gz MDUUWOVWOYGHJZ-LJQANCHMSA-N 2 1 384.524 3.018 20 0 GGADMP CCCC[N@@H+]1CCCC[C@H]1CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000126461936 1415459253 /nfs/dbraw/zinc/45/92/53/1415459253.db2.gz YDXDXRIHSYKRMN-IBGZPJMESA-N 2 1 375.561 3.039 20 0 GGADMP CCCC[N@H+]1CCCC[C@H]1CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000126461936 1415459261 /nfs/dbraw/zinc/45/92/61/1415459261.db2.gz YDXDXRIHSYKRMN-IBGZPJMESA-N 2 1 375.561 3.039 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCC3(CC2)C(=O)Nc2ccccc23)cn1 ZINC000126473562 1415463705 /nfs/dbraw/zinc/46/37/05/1415463705.db2.gz XIRZNYQWBINGKC-UHFFFAOYSA-N 2 1 387.487 3.498 20 0 GGADMP COCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1 ZINC000126678884 1415524508 /nfs/dbraw/zinc/52/45/08/1415524508.db2.gz OWHNETZZGJJUFK-FQEVSTJZSA-N 2 1 397.563 3.310 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)[NH+](C)Cc1ccccc1 ZINC000126685812 1415526483 /nfs/dbraw/zinc/52/64/83/1415526483.db2.gz JZILQKCZPBNQQW-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)[N@H+](C)Cc1ccccc1 ZINC000126685812 1415526490 /nfs/dbraw/zinc/52/64/90/1415526490.db2.gz JZILQKCZPBNQQW-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000126685812 1415526491 /nfs/dbraw/zinc/52/64/91/1415526491.db2.gz JZILQKCZPBNQQW-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc2c(c1)OCCCO2 ZINC000126692165 1415527920 /nfs/dbraw/zinc/52/79/20/1415527920.db2.gz GWPMCXITKHQIDI-LJQANCHMSA-N 2 1 395.547 3.446 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc(F)cc1N(C)C ZINC000126727543 1415541151 /nfs/dbraw/zinc/54/11/51/1415541151.db2.gz XIVNMNNVGPBXGZ-SFHVURJKSA-N 2 1 384.543 3.490 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(-n2cnnn2)c1 ZINC000126769105 1415554322 /nfs/dbraw/zinc/55/43/22/1415554322.db2.gz DOOGHDXMDQYUOZ-DLBZAZTESA-N 2 1 382.537 3.287 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(-n2cnnn2)c1 ZINC000126769105 1415554324 /nfs/dbraw/zinc/55/43/24/1415554324.db2.gz DOOGHDXMDQYUOZ-DLBZAZTESA-N 2 1 382.537 3.287 20 0 GGADMP CCc1ccccc1NC(=O)C[C@H](C)[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000178036990 1428949534 /nfs/dbraw/zinc/94/95/34/1428949534.db2.gz YDUPXLACUVUTEW-GBESFXJTSA-N 2 1 375.557 3.445 20 0 GGADMP O=C([C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000126848983 1415583819 /nfs/dbraw/zinc/58/38/19/1415583819.db2.gz JXSCVAJKBJFJQT-MQSCRBSSSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[NH+](Cc2ccccc2)C1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000126848983 1415583821 /nfs/dbraw/zinc/58/38/21/1415583821.db2.gz JXSCVAJKBJFJQT-MQSCRBSSSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[NH+](Cc2ccccc2)C1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126848983 1415583825 /nfs/dbraw/zinc/58/38/25/1415583825.db2.gz JXSCVAJKBJFJQT-MQSCRBSSSA-N 2 1 381.564 3.374 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)C1CCCCC1 ZINC000127161024 1415675672 /nfs/dbraw/zinc/67/56/72/1415675672.db2.gz WASXMARGVJVSSX-HMXCVIKNSA-N 2 1 376.589 3.155 20 0 GGADMP CCN1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)CC1 ZINC000127294726 1415723731 /nfs/dbraw/zinc/72/37/31/1415723731.db2.gz JAACZZAIXBEHBS-ZWKOTPCHSA-N 2 1 376.564 3.349 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C[N@@H+](C)Cc1ccc(OC(F)F)cc1)c1ccccc1 ZINC000178113072 1428987635 /nfs/dbraw/zinc/98/76/35/1428987635.db2.gz CFBJRTWUOZHBIA-LJQANCHMSA-N 2 1 391.462 3.139 20 0 GGADMP CCO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)NC2CC[NH+](C(C)C)CC2)C12CCCCC2 ZINC000127377764 1415758356 /nfs/dbraw/zinc/75/83/56/1415758356.db2.gz SHHDCWKZOZBBAO-WOJBJXKFSA-N 2 1 379.589 3.035 20 0 GGADMP O=C(NC1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000178121868 1428990420 /nfs/dbraw/zinc/99/04/20/1428990420.db2.gz BYJOKLXHUVTQCT-OAQYLSRUSA-N 2 1 383.580 3.464 20 0 GGADMP CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1 ZINC000127413596 1415770611 /nfs/dbraw/zinc/77/06/11/1415770611.db2.gz OYZJLYALJKUNLP-LJQANCHMSA-N 2 1 388.556 3.357 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C[N@H+]1C1CC1 ZINC000127650946 1415826298 /nfs/dbraw/zinc/82/62/98/1415826298.db2.gz ITYVRFJVFHCNJT-KXBFYZLASA-N 2 1 390.959 3.229 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N[C@H]3CC[N@H+](C4CCCC4)C3)CC2)CC1 ZINC000127654095 1415827034 /nfs/dbraw/zinc/82/70/34/1415827034.db2.gz LLKVSTKMEJZPSC-SCCNAQOGSA-N 2 1 376.589 3.346 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)CC1 ZINC000127679685 1415831480 /nfs/dbraw/zinc/83/14/80/1415831480.db2.gz MJPZSKMTQDVQLF-UHFFFAOYSA-N 2 1 398.555 3.229 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)CC1 ZINC000127679685 1415831481 /nfs/dbraw/zinc/83/14/81/1415831481.db2.gz MJPZSKMTQDVQLF-UHFFFAOYSA-N 2 1 398.555 3.229 20 0 GGADMP C[NH+](C)CCC(=O)Nc1ccc(NC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)cc1 ZINC000178162534 1429003670 /nfs/dbraw/zinc/00/36/70/1429003670.db2.gz XBDYTGQOYDVECR-KRWDZBQOSA-N 2 1 386.540 3.170 20 0 GGADMP COc1cc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)ccc1OCCO ZINC000127697927 1415835106 /nfs/dbraw/zinc/83/51/06/1415835106.db2.gz MXWFXWUNMCSCQN-MRXNPFEDSA-N 2 1 381.476 3.411 20 0 GGADMP COc1cc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)ccc1OCCO ZINC000127698175 1415835311 /nfs/dbraw/zinc/83/53/11/1415835311.db2.gz MXWFXWUNMCSCQN-INIZCTEOSA-N 2 1 381.476 3.411 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC(C[NH+](C)Cc3ccccc3)CC2)C[N@H+]1C1CC1 ZINC000127969064 1415885363 /nfs/dbraw/zinc/88/53/63/1415885363.db2.gz CDZYEZWESHVYKM-WIYYLYMNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C[NH+]1C1CC1 ZINC000127969064 1415885366 /nfs/dbraw/zinc/88/53/66/1415885366.db2.gz CDZYEZWESHVYKM-WIYYLYMNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C[NH+]1C1CC1 ZINC000127969064 1415885370 /nfs/dbraw/zinc/88/53/70/1415885370.db2.gz CDZYEZWESHVYKM-WIYYLYMNSA-N 2 1 384.568 3.165 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(NC(=O)NC(C)C)cc2)[C@H](C)C1 ZINC000128005426 1415891646 /nfs/dbraw/zinc/89/16/46/1415891646.db2.gz MFPBNNPFNIAUPN-NQIIRXRSSA-N 2 1 390.572 3.443 20 0 GGADMP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc2cc(OC)ccc2c1 ZINC000128044778 1415899815 /nfs/dbraw/zinc/89/98/15/1415899815.db2.gz CTLOYWLGTQGYNG-UNMCSNQZSA-N 2 1 383.536 3.477 20 0 GGADMP C[NH+](C)CCCOc1ccc(CNC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1 ZINC000178203035 1429017540 /nfs/dbraw/zinc/01/75/40/1429017540.db2.gz ZQOLETMTJQPWRX-HXUWFJFHSA-N 2 1 387.568 3.288 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+](C)Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000128079774 1415906999 /nfs/dbraw/zinc/90/69/99/1415906999.db2.gz VKUBHXSSQUVETM-UHFFFAOYSA-N 2 1 387.446 3.006 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+](C)Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000128079774 1415907003 /nfs/dbraw/zinc/90/70/03/1415907003.db2.gz VKUBHXSSQUVETM-UHFFFAOYSA-N 2 1 387.446 3.006 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)C(c1ccccc1)c1ccccc1 ZINC000128118208 1415916768 /nfs/dbraw/zinc/91/67/68/1415916768.db2.gz YDAOTJHWJYHDOK-UGKGYDQZSA-N 2 1 379.548 3.384 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](CCc2ccc(F)cc2)C2CCCC2)CC1 ZINC000128316191 1415961357 /nfs/dbraw/zinc/96/13/57/1415961357.db2.gz WPZOZPFAWTVVSC-UHFFFAOYSA-N 2 1 375.532 3.213 20 0 GGADMP O=C(CC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)NC1CCCCC1 ZINC000128695596 1416044996 /nfs/dbraw/zinc/04/49/96/1416044996.db2.gz CRXKFQQOSCTKSI-UHFFFAOYSA-N 2 1 375.532 3.261 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)[C@@H]3C[N@H+](Cc4ccccc4)CCO3)CC2)CC1 ZINC000128715383 1416049765 /nfs/dbraw/zinc/04/97/65/1416049765.db2.gz VJBUFRPFIRMUKO-VNXZQDSDSA-N 2 1 399.579 3.047 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)[C@@H]3C[N@@H+](Cc4ccccc4)CCO3)CC2)CC1 ZINC000128715383 1416049775 /nfs/dbraw/zinc/04/97/75/1416049775.db2.gz VJBUFRPFIRMUKO-VNXZQDSDSA-N 2 1 399.579 3.047 20 0 GGADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1 ZINC000178350443 1429058540 /nfs/dbraw/zinc/05/85/40/1429058540.db2.gz MQMOLUHICMQADU-UHFFFAOYSA-N 2 1 393.597 3.214 20 0 GGADMP C[N@@H+](CCNC(=O)C1CCN(C/C(Cl)=C/Cl)CC1)Cc1ccccc1 ZINC000128759829 1416060906 /nfs/dbraw/zinc/06/09/06/1416060906.db2.gz FUGMYCJDFFFOSN-AQTBWJFISA-N 2 1 384.351 3.266 20 0 GGADMP Cc1c(C(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)cnn1-c1cc[nH+]cc1 ZINC000128807019 1416073595 /nfs/dbraw/zinc/07/35/95/1416073595.db2.gz UXYNEOZPUNNHMB-UHFFFAOYSA-N 2 1 397.910 3.433 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(Cl)cc2)[C@H](C)C1 ZINC000178421529 1429074210 /nfs/dbraw/zinc/07/42/10/1429074210.db2.gz AWIKAMVOLANSEE-GJYPPUQNSA-N 2 1 381.948 3.394 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(Cl)cc2)[C@H](C)C1 ZINC000178421529 1429074216 /nfs/dbraw/zinc/07/42/16/1429074216.db2.gz AWIKAMVOLANSEE-GJYPPUQNSA-N 2 1 381.948 3.394 20 0 GGADMP C[NH+](C)C[C@H]1CCN(C(=O)N[C@H](C[N@H+]2CCc3ccccc3C2)C(C)(C)C)C1 ZINC000130011961 1416302154 /nfs/dbraw/zinc/30/21/54/1416302154.db2.gz SCNZYSJAXVXHRC-WIYYLYMNSA-N 2 1 386.584 3.053 20 0 GGADMP C[NH+](C)C[C@H]1CCN(C(=O)N[C@@H](C[N@H+]2CCc3ccccc3C2)C(C)(C)C)C1 ZINC000130012152 1416302390 /nfs/dbraw/zinc/30/23/90/1416302390.db2.gz SCNZYSJAXVXHRC-NQIIRXRSSA-N 2 1 386.584 3.053 20 0 GGADMP O=C1C[C@@H]([NH+]2CCC(CCC[NH+]3CCCC3)CC2)C(=O)N1c1ccc(F)cc1 ZINC000130059908 1416310240 /nfs/dbraw/zinc/31/02/40/1416310240.db2.gz JGULNDGISQLAAY-HXUWFJFHSA-N 2 1 387.499 3.046 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C[N@H+]1Cc1ccccc1 ZINC000130100124 1416317909 /nfs/dbraw/zinc/31/79/09/1416317909.db2.gz UAGPMPAUDJHMIR-WRHDZBKDSA-N 2 1 396.579 3.308 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C[NH+]1Cc1ccccc1 ZINC000130100124 1416317913 /nfs/dbraw/zinc/31/79/13/1416317913.db2.gz UAGPMPAUDJHMIR-WRHDZBKDSA-N 2 1 396.579 3.308 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C[NH+]1Cc1ccccc1 ZINC000130100124 1416317917 /nfs/dbraw/zinc/31/79/17/1416317917.db2.gz UAGPMPAUDJHMIR-WRHDZBKDSA-N 2 1 396.579 3.308 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)[C@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000130310906 1416355707 /nfs/dbraw/zinc/35/57/07/1416355707.db2.gz MUOCGMRQPSHHJZ-IBGZPJMESA-N 2 1 382.552 3.431 20 0 GGADMP CCOc1cc(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc(Cl)c1OC ZINC000130350062 1416362967 /nfs/dbraw/zinc/36/29/67/1416362967.db2.gz WCTPXDJXDUGVGD-HNNXBMFYSA-N 2 1 382.932 3.338 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O ZINC000130363243 1416365029 /nfs/dbraw/zinc/36/50/29/1416365029.db2.gz IGSNAYGWYSAZSJ-KRWDZBQOSA-N 2 1 380.414 3.338 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O ZINC000130363243 1416365035 /nfs/dbraw/zinc/36/50/35/1416365035.db2.gz IGSNAYGWYSAZSJ-KRWDZBQOSA-N 2 1 380.414 3.338 20 0 GGADMP CCCOc1ccc(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1OCC ZINC000130387294 1416369064 /nfs/dbraw/zinc/36/90/64/1416369064.db2.gz QUWRKROJSTWANJ-LJQANCHMSA-N 2 1 376.541 3.465 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(C(=O)OC(C)C)cc1 ZINC000130469929 1416383247 /nfs/dbraw/zinc/38/32/47/1416383247.db2.gz IPLPTRWJXWWIAL-INIZCTEOSA-N 2 1 386.496 3.106 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc(C(=O)OC(C)C)cc1 ZINC000130469929 1416383252 /nfs/dbraw/zinc/38/32/52/1416383252.db2.gz IPLPTRWJXWWIAL-INIZCTEOSA-N 2 1 386.496 3.106 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000130670875 1416422210 /nfs/dbraw/zinc/42/22/10/1416422210.db2.gz ZHTAVFZFSKKHPQ-MSOLQXFVSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[N@H+]1CCC[C@@H](C)C1 ZINC000130670875 1416422220 /nfs/dbraw/zinc/42/22/20/1416422220.db2.gz ZHTAVFZFSKKHPQ-MSOLQXFVSA-N 2 1 390.597 3.477 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000130696266 1416427571 /nfs/dbraw/zinc/42/75/71/1416427571.db2.gz YAJJXVCMXVYVHJ-AWEZNQCLSA-N 2 1 398.429 3.289 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000130696266 1416427579 /nfs/dbraw/zinc/42/75/79/1416427579.db2.gz YAJJXVCMXVYVHJ-AWEZNQCLSA-N 2 1 398.429 3.289 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N(Cc2ccco2)C2CC[NH+](C)CC2)C1 ZINC000130725582 1416435773 /nfs/dbraw/zinc/43/57/73/1416435773.db2.gz YQOXDZKQOQYNBD-IBGZPJMESA-N 2 1 390.572 3.253 20 0 GGADMP COc1ccc2cc(CN(C)C(=O)C[N@H+](C)CCCn3cc[nH+]c3C)ccc2c1 ZINC000130736630 1416438520 /nfs/dbraw/zinc/43/85/20/1416438520.db2.gz XCXWOPLNCWPQGV-UHFFFAOYSA-N 2 1 394.519 3.334 20 0 GGADMP COc1ccc2cc(CN(C)C(=O)C[N@@H+](C)CCCn3cc[nH+]c3C)ccc2c1 ZINC000130736630 1416438531 /nfs/dbraw/zinc/43/85/31/1416438531.db2.gz XCXWOPLNCWPQGV-UHFFFAOYSA-N 2 1 394.519 3.334 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H](c2cccc(OC)c2)[NH+](C)C)c1 ZINC000130745814 1416440821 /nfs/dbraw/zinc/44/08/21/1416440821.db2.gz YLZXYQKZBHRICW-JOCHJYFZSA-N 2 1 398.551 3.249 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2)C1 ZINC000130845789 1416466297 /nfs/dbraw/zinc/46/62/97/1416466297.db2.gz SBKIWTRLESAKFL-FQEVSTJZSA-N 2 1 392.563 3.267 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2)C1 ZINC000130845570 1416466393 /nfs/dbraw/zinc/46/63/93/1416466393.db2.gz SBKIWTRLESAKFL-HXUWFJFHSA-N 2 1 392.563 3.267 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000130849336 1416467350 /nfs/dbraw/zinc/46/73/50/1416467350.db2.gz JVAVTUYBWLLGJL-HNNXBMFYSA-N 2 1 385.537 3.170 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000130849336 1416467354 /nfs/dbraw/zinc/46/73/54/1416467354.db2.gz JVAVTUYBWLLGJL-HNNXBMFYSA-N 2 1 385.537 3.170 20 0 GGADMP CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)[N@H+](C)CCCn2cc[nH+]c2C)c1 ZINC000130884131 1416475442 /nfs/dbraw/zinc/47/54/42/1416475442.db2.gz PWBMVXOUEMWDHL-KRWDZBQOSA-N 2 1 399.539 3.023 20 0 GGADMP CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)[N@@H+](C)CCCn2cc[nH+]c2C)c1 ZINC000130884131 1416475444 /nfs/dbraw/zinc/47/54/44/1416475444.db2.gz PWBMVXOUEMWDHL-KRWDZBQOSA-N 2 1 399.539 3.023 20 0 GGADMP Cc1cc(C[NH+]2CCC(C(=O)NCC[N@H+](C)Cc3ccccc3)CC2)c(C)o1 ZINC000130906775 1416478976 /nfs/dbraw/zinc/47/89/76/1416478976.db2.gz ZDOAZCSSFSOWNF-UHFFFAOYSA-N 2 1 383.536 3.357 20 0 GGADMP CC[NH+](CC)Cc1ccccc1CNC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000130947479 1416485981 /nfs/dbraw/zinc/48/59/81/1416485981.db2.gz QCBZIOCRAQPSJJ-HSZRJFAPSA-N 2 1 395.547 3.046 20 0 GGADMP CC[NH+](CC)Cc1ccccc1CNC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000130947479 1416485987 /nfs/dbraw/zinc/48/59/87/1416485987.db2.gz QCBZIOCRAQPSJJ-HSZRJFAPSA-N 2 1 395.547 3.046 20 0 GGADMP CCC[C@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1CCOC ZINC000130979077 1416490800 /nfs/dbraw/zinc/49/08/00/1416490800.db2.gz MNMFKOXHORVHMQ-KRWDZBQOSA-N 2 1 387.524 3.067 20 0 GGADMP CCC[C@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@H+]1CCOC ZINC000130979077 1416490801 /nfs/dbraw/zinc/49/08/01/1416490801.db2.gz MNMFKOXHORVHMQ-KRWDZBQOSA-N 2 1 387.524 3.067 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)N3CC[C@H]4[C@@H](CCC[N@H+]4C)C3)c(C)c2)CC1 ZINC000178539264 1429101705 /nfs/dbraw/zinc/10/17/05/1429101705.db2.gz KPPXXVCEEKANDV-UGKGYDQZSA-N 2 1 399.583 3.085 20 0 GGADMP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131297877 1416536595 /nfs/dbraw/zinc/53/65/95/1416536595.db2.gz FCVUZCSVQYXOOB-KZNAEPCWSA-N 2 1 386.565 3.488 20 0 GGADMP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131297877 1416536596 /nfs/dbraw/zinc/53/65/96/1416536596.db2.gz FCVUZCSVQYXOOB-KZNAEPCWSA-N 2 1 386.565 3.488 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131398791 1416551144 /nfs/dbraw/zinc/55/11/44/1416551144.db2.gz KJUNIXNEFXXMOO-RBUKOAKNSA-N 2 1 395.551 3.302 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131398791 1416551151 /nfs/dbraw/zinc/55/11/51/1416551151.db2.gz KJUNIXNEFXXMOO-RBUKOAKNSA-N 2 1 395.551 3.302 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc(N4CCCC4)nc3)c2)CCO1 ZINC000131576857 1416578607 /nfs/dbraw/zinc/57/86/07/1416578607.db2.gz LFCLXYXBLKTEJE-LJQANCHMSA-N 2 1 380.536 3.192 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(N4CCCC4)nc3)c2)CCO1 ZINC000131576857 1416578611 /nfs/dbraw/zinc/57/86/11/1416578611.db2.gz LFCLXYXBLKTEJE-LJQANCHMSA-N 2 1 380.536 3.192 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000131583303 1416579578 /nfs/dbraw/zinc/57/95/78/1416579578.db2.gz NSYWGBKVLWCVNV-PMACEKPBSA-N 2 1 376.932 3.287 20 0 GGADMP CC[NH+](CC)Cc1cccc(CNC(=O)[C@H]2C[N@H+](Cc3ccccc3)CCO2)c1 ZINC000131667320 1416593676 /nfs/dbraw/zinc/59/36/76/1416593676.db2.gz GKIBEFQNOPMKBE-HSZRJFAPSA-N 2 1 395.547 3.046 20 0 GGADMP CC[NH+](CC)Cc1cccc(CNC(=O)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c1 ZINC000131667320 1416593689 /nfs/dbraw/zinc/59/36/89/1416593689.db2.gz GKIBEFQNOPMKBE-HSZRJFAPSA-N 2 1 395.547 3.046 20 0 GGADMP C[C@@H](C(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1)[NH+]1[C@H](C)CC[C@H]1C ZINC000131776350 1416618082 /nfs/dbraw/zinc/61/80/82/1416618082.db2.gz WYTLPIUNHHWHCT-QRVBRYPASA-N 2 1 398.551 3.173 20 0 GGADMP C[C@@H](C(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000131775995 1416618180 /nfs/dbraw/zinc/61/81/80/1416618180.db2.gz WYTLPIUNHHWHCT-OTWHNJEPSA-N 2 1 398.551 3.173 20 0 GGADMP C[C@@H](C(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000131775995 1416618187 /nfs/dbraw/zinc/61/81/87/1416618187.db2.gz WYTLPIUNHHWHCT-OTWHNJEPSA-N 2 1 398.551 3.173 20 0 GGADMP CNS(=O)(=O)Cc1ccc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000131903505 1416647019 /nfs/dbraw/zinc/64/70/19/1416647019.db2.gz YZOQZHKUKNTYJF-INIZCTEOSA-N 2 1 398.532 3.081 20 0 GGADMP CC[C@H](C(=O)N1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1)[NH+](C)C ZINC000178600729 1429118733 /nfs/dbraw/zinc/11/87/33/1429118733.db2.gz BUUCQPBDRCNMCE-GOSISDBHSA-N 2 1 385.474 3.468 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000178604114 1429119798 /nfs/dbraw/zinc/11/97/98/1429119798.db2.gz SKWLXUJTMAKPKK-GOTSBHOMSA-N 2 1 399.579 3.002 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000178604114 1429119802 /nfs/dbraw/zinc/11/98/02/1429119802.db2.gz SKWLXUJTMAKPKK-GOTSBHOMSA-N 2 1 399.579 3.002 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)[C@H](c2ccccc2)[NH+]2CCSCC2)CC1 ZINC000132335555 1416738947 /nfs/dbraw/zinc/73/89/47/1416738947.db2.gz DSGOBPLQROKSOT-NRFANRHFSA-N 2 1 389.609 3.357 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)oc1C ZINC000132518926 1416776736 /nfs/dbraw/zinc/77/67/36/1416776736.db2.gz WRQVSIURTNKNLO-GOSISDBHSA-N 2 1 392.544 3.102 20 0 GGADMP Cc1csc(C2([NH2+]CC(=O)NC[C@H](c3ccccc3)[NH+](C)C)CCCC2)n1 ZINC000132632284 1416797051 /nfs/dbraw/zinc/79/70/51/1416797051.db2.gz XSZWSGFDPXGBJX-GOSISDBHSA-N 2 1 386.565 3.230 20 0 GGADMP COc1cc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)ccc1OC(F)F ZINC000132852745 1416823233 /nfs/dbraw/zinc/82/32/33/1416823233.db2.gz FPAIVRDHHIYOHE-LSDHHAIUSA-N 2 1 384.467 3.448 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)ccc1OC(F)F ZINC000132852960 1416823379 /nfs/dbraw/zinc/82/33/79/1416823379.db2.gz FPAIVRDHHIYOHE-HUUCEWRRSA-N 2 1 384.467 3.448 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000132881540 1416826657 /nfs/dbraw/zinc/82/66/57/1416826657.db2.gz FZUDDQWBKFRRJG-GHTZIAJQSA-N 2 1 387.572 3.171 20 0 GGADMP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccccc1OCc1ccccc1 ZINC000178669253 1429134302 /nfs/dbraw/zinc/13/43/02/1429134302.db2.gz KUHLNRDXQLLXGJ-IBGZPJMESA-N 2 1 381.520 3.080 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1cc2ccccc2c(Cl)n1 ZINC000178666215 1429133622 /nfs/dbraw/zinc/13/36/22/1429133622.db2.gz YODSOSJLOPAVAQ-KRWDZBQOSA-N 2 1 388.943 3.376 20 0 GGADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCC(=O)N1CC[NH+](C)CC1 ZINC000178668665 1429133682 /nfs/dbraw/zinc/13/36/82/1429133682.db2.gz KGJRRXNPMRQQFR-AWEZNQCLSA-N 2 1 390.528 3.072 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)CC[N@H+]1C ZINC000133077232 1416849564 /nfs/dbraw/zinc/84/95/64/1416849564.db2.gz KTPOXKYPUBTGRO-SNRMKQJTSA-N 2 1 385.474 3.151 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1 ZINC000133101843 1416852391 /nfs/dbraw/zinc/85/23/91/1416852391.db2.gz OLYJOQIWZQBVFM-SMOSDQRPSA-N 2 1 399.501 3.397 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)[NH+]1CCSCC1 ZINC000133322325 1416878348 /nfs/dbraw/zinc/87/83/48/1416878348.db2.gz CGGBVSWXXHVVPU-GOSISDBHSA-N 2 1 375.582 3.116 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)[NH+]1CCSCC1 ZINC000133322146 1416878434 /nfs/dbraw/zinc/87/84/34/1416878434.db2.gz CGGBVSWXXHVVPU-SFHVURJKSA-N 2 1 375.582 3.116 20 0 GGADMP C[C@H](C(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)[NH+]1CCSCC1 ZINC000133335717 1416879806 /nfs/dbraw/zinc/87/98/06/1416879806.db2.gz UBFSDNJYBCNVRA-GOSISDBHSA-N 2 1 375.582 3.116 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000133422915 1416888262 /nfs/dbraw/zinc/88/82/62/1416888262.db2.gz ZFMQNMWOPPYGFW-XMSQKQJNSA-N 2 1 399.583 3.171 20 0 GGADMP CCN(CC)C(=O)[C@@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccccc1 ZINC000178695609 1429143666 /nfs/dbraw/zinc/14/36/66/1429143666.db2.gz WNVVAECCRLFGQP-QFIPXVFZSA-N 2 1 395.551 3.262 20 0 GGADMP O[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)COc1ccc(F)c(F)c1 ZINC000133680020 1416938606 /nfs/dbraw/zinc/93/86/06/1416938606.db2.gz JOPFGSVBLMGDBR-IBGZPJMESA-N 2 1 390.474 3.001 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1 ZINC000178698374 1429145060 /nfs/dbraw/zinc/14/50/60/1429145060.db2.gz GJCVEPHZTLWAMG-IAGOWNOFSA-N 2 1 392.569 3.209 20 0 GGADMP C[C@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000133753365 1416956663 /nfs/dbraw/zinc/95/66/63/1416956663.db2.gz JIVYGDNRNALPAN-AWEZNQCLSA-N 2 1 379.430 3.098 20 0 GGADMP C[C@@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000133753578 1416957050 /nfs/dbraw/zinc/95/70/50/1416957050.db2.gz JIVYGDNRNALPAN-CQSZACIVSA-N 2 1 379.430 3.098 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CC[C@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000133834618 1416972905 /nfs/dbraw/zinc/97/29/05/1416972905.db2.gz ZHBRPRWXHFPQSG-UNMCSNQZSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000133834618 1416972906 /nfs/dbraw/zinc/97/29/06/1416972906.db2.gz ZHBRPRWXHFPQSG-UNMCSNQZSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)C1 ZINC000133834618 1416972908 /nfs/dbraw/zinc/97/29/08/1416972908.db2.gz ZHBRPRWXHFPQSG-UNMCSNQZSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)C1 ZINC000133845684 1416976461 /nfs/dbraw/zinc/97/64/61/1416976461.db2.gz VWEVNNQDXIWBOM-XLIONFOSSA-N 2 1 393.597 3.070 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]Cc3cccc(Oc4ccccc4)c3)cn2)CC1 ZINC000133929778 1416997147 /nfs/dbraw/zinc/99/71/47/1416997147.db2.gz NJIMEASOPXTEDI-UHFFFAOYSA-N 2 1 389.503 3.311 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cccc(Cl)c3F)c2)C1 ZINC000134055477 1417015522 /nfs/dbraw/zinc/01/55/22/1417015522.db2.gz JQURUQXQEOCFCT-SFHVURJKSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cccc(Cl)c3F)c2)C1 ZINC000134055477 1417015529 /nfs/dbraw/zinc/01/55/29/1417015529.db2.gz JQURUQXQEOCFCT-SFHVURJKSA-N 2 1 389.902 3.466 20 0 GGADMP CCOc1cccc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c1OC(F)F ZINC000134079769 1417019211 /nfs/dbraw/zinc/01/92/11/1417019211.db2.gz YIAQWSINSURVCU-UHFFFAOYSA-N 2 1 384.467 3.231 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2CNC(=O)[C@@H]2CCCCCC[C@@H]2[NH3+])C[C@H](C)O1 ZINC000178719571 1429151151 /nfs/dbraw/zinc/15/11/51/1429151151.db2.gz QCISIILWRCMJMY-OSZJIOELSA-N 2 1 387.568 3.210 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2CNC(=O)[C@@H]2CCCCCC[C@@H]2[NH3+])C[C@H](C)O1 ZINC000178719571 1429151156 /nfs/dbraw/zinc/15/11/56/1429151156.db2.gz QCISIILWRCMJMY-OSZJIOELSA-N 2 1 387.568 3.210 20 0 GGADMP C[C@@H]1C[C@H]1[C@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(Cl)cc1 ZINC000134367812 1417061522 /nfs/dbraw/zinc/06/15/22/1417061522.db2.gz IJUIBCNRDSJFKM-CDHQVMDDSA-N 2 1 385.943 3.369 20 0 GGADMP Cn1ccnc1COc1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000134867592 1417136627 /nfs/dbraw/zinc/13/66/27/1417136627.db2.gz PPZBNFRBEUYFCP-DENIHFKCSA-N 2 1 380.536 3.448 20 0 GGADMP Cn1ccnc1COc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000134867592 1417136629 /nfs/dbraw/zinc/13/66/29/1417136629.db2.gz PPZBNFRBEUYFCP-DENIHFKCSA-N 2 1 380.536 3.448 20 0 GGADMP Cn1ccnc1COc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000134867592 1417136631 /nfs/dbraw/zinc/13/66/31/1417136631.db2.gz PPZBNFRBEUYFCP-DENIHFKCSA-N 2 1 380.536 3.448 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134883639 1417139339 /nfs/dbraw/zinc/13/93/39/1417139339.db2.gz HFLMDVDHIBWNOJ-UTKZUKDTSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134883639 1417139344 /nfs/dbraw/zinc/13/93/44/1417139344.db2.gz HFLMDVDHIBWNOJ-UTKZUKDTSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134883639 1417139348 /nfs/dbraw/zinc/13/93/48/1417139348.db2.gz HFLMDVDHIBWNOJ-UTKZUKDTSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134883639 1417139354 /nfs/dbraw/zinc/13/93/54/1417139354.db2.gz HFLMDVDHIBWNOJ-UTKZUKDTSA-N 2 1 381.520 3.012 20 0 GGADMP COc1ccccc1[C@H](C)N(C)C(=O)CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134904048 1417142379 /nfs/dbraw/zinc/14/23/79/1417142379.db2.gz SDANBPULHZFYJX-WAOWUJCRSA-N 2 1 385.552 3.163 20 0 GGADMP Cc1nc(CNC(=O)OC(C)(C)C)ccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000134914584 1417144170 /nfs/dbraw/zinc/14/41/70/1417144170.db2.gz ZJBJIUGEIKSXGV-NVXWUHKLSA-N 2 1 376.545 3.407 20 0 GGADMP c1ccc(-c2nnn(CCCCC[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)n2)cc1 ZINC000134946380 1417150398 /nfs/dbraw/zinc/15/03/98/1417150398.db2.gz DGAGIQABMHPXAM-IFMALSPDSA-N 2 1 394.567 3.459 20 0 GGADMP c1ccc(-c2nnn(CCCCC[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)n2)cc1 ZINC000134946380 1417150408 /nfs/dbraw/zinc/15/04/08/1417150408.db2.gz DGAGIQABMHPXAM-IFMALSPDSA-N 2 1 394.567 3.459 20 0 GGADMP c1ccc(-c2nnn(CCCCC[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)n2)cc1 ZINC000134946380 1417150416 /nfs/dbraw/zinc/15/04/16/1417150416.db2.gz DGAGIQABMHPXAM-IFMALSPDSA-N 2 1 394.567 3.459 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NCCC[N@@H+](C)C2CCCCC2)cc1F ZINC000134993324 1417157790 /nfs/dbraw/zinc/15/77/90/1417157790.db2.gz JVCNMYMVDHEQGJ-UHFFFAOYSA-N 2 1 378.536 3.341 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](CCC(=O)N(C)c3ccccc3)CC2)C[C@H](C)O1 ZINC000135131030 1417175993 /nfs/dbraw/zinc/17/59/93/1417175993.db2.gz UONBXVQKJSDTHF-BGYRXZFFSA-N 2 1 387.568 3.251 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C1 ZINC000135140709 1417176803 /nfs/dbraw/zinc/17/68/03/1417176803.db2.gz QOYHWAVDTAALHG-HDICACEKSA-N 2 1 392.563 3.445 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NCc1ccc(C[NH+](C)C)c(F)c1 ZINC000135139360 1417176831 /nfs/dbraw/zinc/17/68/31/1417176831.db2.gz LHENERPRMMBRRI-QGZVFWFLSA-N 2 1 378.536 3.341 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000135161480 1417179544 /nfs/dbraw/zinc/17/95/44/1417179544.db2.gz IWXCGYZLQJUQKT-OAQYLSRUSA-N 2 1 398.526 3.351 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C1 ZINC000135195969 1417185347 /nfs/dbraw/zinc/18/53/47/1417185347.db2.gz CHTCCSWZZZDARB-MRXNPFEDSA-N 2 1 378.536 3.197 20 0 GGADMP C[C@H](CNC(=O)NCc1ccc(C[NH+](C)C)c(F)c1)[N@@H+](C)Cc1ccccc1 ZINC000135385190 1417213489 /nfs/dbraw/zinc/21/34/89/1417213489.db2.gz MQVNSDCGLNFAHJ-QGZVFWFLSA-N 2 1 386.515 3.207 20 0 GGADMP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2cc(F)c(F)cc2F)cc1 ZINC000136172003 1417297443 /nfs/dbraw/zinc/29/74/43/1417297443.db2.gz YMUHLVXLSWMHHA-UHFFFAOYSA-N 2 1 391.437 3.219 20 0 GGADMP C[NH+](C)CCOc1cc(C[NH2+]Cc2ccc(Br)cc2F)ccn1 ZINC000136214205 1417301367 /nfs/dbraw/zinc/30/13/67/1417301367.db2.gz LQXWCOACAGZIGW-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP COc1ccc(Br)c(C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1 ZINC000136216744 1417302210 /nfs/dbraw/zinc/30/22/10/1417302210.db2.gz WKOBBRFBVWRAGI-UHFFFAOYSA-N 2 1 394.313 3.083 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1F ZINC000136242756 1417304616 /nfs/dbraw/zinc/30/46/16/1417304616.db2.gz ZXBOWWNMUICKFC-GHTZIAJQSA-N 2 1 388.531 3.046 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1OC(F)F ZINC000136576538 1417328158 /nfs/dbraw/zinc/32/81/58/1417328158.db2.gz JNKCQLDVYMFKTF-IRXDYDNUSA-N 2 1 384.467 3.154 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(C(=O)NCc3ccc(C[NH+]4CCCCC4)cc3)CC[C@@H]21 ZINC000136580523 1417328911 /nfs/dbraw/zinc/32/89/11/1417328911.db2.gz BJIDCKCODHBNPU-VXKWHMMOSA-N 2 1 384.568 3.298 20 0 GGADMP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000136595802 1417330880 /nfs/dbraw/zinc/33/08/80/1417330880.db2.gz KRPXNOHHXWTTBB-RPWUZVMVSA-N 2 1 396.579 3.406 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[NH+](C)C/C=C/C[N@H+](C)[C@@H]1CCCc2c1cnn2C ZINC000136824219 1417347769 /nfs/dbraw/zinc/34/77/69/1417347769.db2.gz WGQRGNZXPRNQHK-BGEOSOQGSA-N 2 1 382.556 3.028 20 0 GGADMP C[C@@H](CCCOc1ccccc1C(N)=O)[NH2+]C[C@@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000138178303 1417406854 /nfs/dbraw/zinc/40/68/54/1417406854.db2.gz YUCKROWRBBWCPC-KGVIQGDOSA-N 2 1 375.557 3.433 20 0 GGADMP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NC[C@H]2CCC[N@H+]2C)cc1 ZINC000139508894 1417462220 /nfs/dbraw/zinc/46/22/20/1417462220.db2.gz XVNZGRVCEYCARW-OAQYLSRUSA-N 2 1 380.536 3.309 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1)c1ccco1 ZINC000142218410 1417576577 /nfs/dbraw/zinc/57/65/77/1417576577.db2.gz WVFCPAANVICQLN-SFHVURJKSA-N 2 1 390.553 3.155 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000143602265 1417642766 /nfs/dbraw/zinc/64/27/66/1417642766.db2.gz ACIQNRCOWKIRRY-UHFFFAOYSA-N 2 1 383.561 3.135 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000143602265 1417642770 /nfs/dbraw/zinc/64/27/70/1417642770.db2.gz ACIQNRCOWKIRRY-UHFFFAOYSA-N 2 1 383.561 3.135 20 0 GGADMP C[C@@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCCC[C@H]1C ZINC000145588704 1417692604 /nfs/dbraw/zinc/69/26/04/1417692604.db2.gz MOZNFDIAPMOSDD-MOPGFXCFSA-N 2 1 388.625 3.378 20 0 GGADMP O=C(C[C@H]1CCC[NH2+]1)Nc1ccc(C[NH+]2CCN(Cc3ccccc3)CC2)cc1 ZINC000178875956 1429206919 /nfs/dbraw/zinc/20/69/19/1429206919.db2.gz FFRMPLNPAYGYON-HSZRJFAPSA-N 2 1 392.547 3.085 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000149004755 1417770719 /nfs/dbraw/zinc/77/07/19/1417770719.db2.gz IQBKTVPQDMVCER-KRWDZBQOSA-N 2 1 378.586 3.132 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000150756889 1417800651 /nfs/dbraw/zinc/80/06/51/1417800651.db2.gz AMCGHSIBOGLFTQ-OAQYLSRUSA-N 2 1 386.584 3.270 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCC2)CC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000178883023 1429210547 /nfs/dbraw/zinc/21/05/47/1429210547.db2.gz KQCUQLBSQJIHPO-UGKGYDQZSA-N 2 1 388.600 3.299 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000150804209 1417810005 /nfs/dbraw/zinc/81/00/05/1417810005.db2.gz SKZGOGKEBXABCG-FQEVSTJZSA-N 2 1 395.551 3.235 20 0 GGADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(OCCN3CCOCC3)c(Cl)c2)CC1 ZINC000151344396 1417931146 /nfs/dbraw/zinc/93/11/46/1417931146.db2.gz FKSPQTFROSBJNC-UHFFFAOYSA-N 2 1 395.975 3.013 20 0 GGADMP CCC[NH+]1CCC([NH2+]Cc2ccc(OCCN3CCOCC3)c(Cl)c2)CC1 ZINC000151345213 1417931609 /nfs/dbraw/zinc/93/16/09/1417931609.db2.gz XOMZIENRRHYNJB-UHFFFAOYSA-N 2 1 395.975 3.015 20 0 GGADMP COc1ccc(C[C@H]([NH2+]CCC[NH+]2CCC(O)CC2)c2ccc(OC)cc2)cc1 ZINC000151363730 1417937252 /nfs/dbraw/zinc/93/72/52/1417937252.db2.gz QOSDDELKVYBRQS-DEOSSOPVSA-N 2 1 398.547 3.424 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)[C@H](c1ccccc1)[NH+]1CCC(O)CC1)CC(C)C ZINC000151391750 1417946562 /nfs/dbraw/zinc/94/65/62/1417946562.db2.gz PFZYGJOXAQHZDQ-IRLDBZIGSA-N 2 1 389.584 3.057 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)[C@@H](c1ccccc1)[NH+]1CCC(O)CC1)CC(C)C ZINC000151391555 1417946699 /nfs/dbraw/zinc/94/66/99/1417946699.db2.gz PFZYGJOXAQHZDQ-RBBKRZOGSA-N 2 1 389.584 3.057 20 0 GGADMP CC[C@@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000151488505 1418000031 /nfs/dbraw/zinc/00/00/31/1418000031.db2.gz XEMONXXOOICZOS-PKTZIBPZSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000151488505 1418000041 /nfs/dbraw/zinc/00/00/41/1418000041.db2.gz XEMONXXOOICZOS-PKTZIBPZSA-N 2 1 395.547 3.158 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000151504432 1418006531 /nfs/dbraw/zinc/00/65/31/1418006531.db2.gz OWUPRJLWGSVILJ-FUDKSRODSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000151504432 1418006539 /nfs/dbraw/zinc/00/65/39/1418006539.db2.gz OWUPRJLWGSVILJ-FUDKSRODSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000151504432 1418006549 /nfs/dbraw/zinc/00/65/49/1418006549.db2.gz OWUPRJLWGSVILJ-FUDKSRODSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H](c1ccco1)N1CCCCC1)N1CC[C@H](Oc2ccncc2)C1 ZINC000151649503 1418050268 /nfs/dbraw/zinc/05/02/68/1418050268.db2.gz QBQRZHWACQYOAJ-OALUTQOASA-N 2 1 384.480 3.065 20 0 GGADMP COc1cc([C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)ccc1OCCO ZINC000151657757 1418053045 /nfs/dbraw/zinc/05/30/45/1418053045.db2.gz SUZWZPWOFUBCRH-IBGZPJMESA-N 2 1 398.547 3.424 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000151713784 1418070071 /nfs/dbraw/zinc/07/00/71/1418070071.db2.gz BWBZWDGXLVGXRQ-YPAWHYETSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000151713784 1418070075 /nfs/dbraw/zinc/07/00/75/1418070075.db2.gz BWBZWDGXLVGXRQ-YPAWHYETSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000151713784 1418070078 /nfs/dbraw/zinc/07/00/78/1418070078.db2.gz BWBZWDGXLVGXRQ-YPAWHYETSA-N 2 1 384.568 3.024 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)CC2)[nH+]c1 ZINC000178993436 1429237271 /nfs/dbraw/zinc/23/72/71/1429237271.db2.gz QBHDCLPDNQVKJY-PZJWPPBQSA-N 2 1 382.552 3.082 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)CC2)[nH+]c1 ZINC000178993436 1429237278 /nfs/dbraw/zinc/23/72/78/1429237278.db2.gz QBHDCLPDNQVKJY-PZJWPPBQSA-N 2 1 382.552 3.082 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NCCC[N@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000152195406 1418170181 /nfs/dbraw/zinc/17/01/81/1418170181.db2.gz ZUUUBPDIPLHWAE-OTWHNJEPSA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000152195406 1418170189 /nfs/dbraw/zinc/17/01/89/1418170189.db2.gz ZUUUBPDIPLHWAE-OTWHNJEPSA-N 2 1 375.561 3.160 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[C@H](C)[C@H](n3ccnc3)C2)C1 ZINC000152259145 1418186997 /nfs/dbraw/zinc/18/69/97/1418186997.db2.gz SHGVDXDMOGKRNI-ZGXWSNOMSA-N 2 1 375.561 3.234 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@H](C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000152304124 1418199304 /nfs/dbraw/zinc/19/93/04/1418199304.db2.gz FXIIGWIUEOFTMA-GHTZIAJQSA-N 2 1 395.551 3.239 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)C1 ZINC000152304124 1418199305 /nfs/dbraw/zinc/19/93/05/1418199305.db2.gz FXIIGWIUEOFTMA-GHTZIAJQSA-N 2 1 395.551 3.239 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000179011049 1429241844 /nfs/dbraw/zinc/24/18/44/1429241844.db2.gz RUKCJYKJMIQXHO-QHGAOEGBSA-N 2 1 375.561 3.170 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000179010788 1429242272 /nfs/dbraw/zinc/24/22/72/1429242272.db2.gz NSCPZWBSXRLCFD-GOSISDBHSA-N 2 1 375.561 3.125 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1F)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179391740 1429356168 /nfs/dbraw/zinc/35/61/68/1429356168.db2.gz RWDNENSKUNTWOU-SFHVURJKSA-N 2 1 398.526 3.464 20 0 GGADMP C[N@H+](CCc1nc2ccccc2c(=O)[nH]1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179392962 1429356742 /nfs/dbraw/zinc/35/67/42/1429356742.db2.gz ZAVYJGZYJZNRLE-UHFFFAOYSA-N 2 1 391.519 3.099 20 0 GGADMP CN(Cc1cccs1)C(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179393033 1429356834 /nfs/dbraw/zinc/35/68/34/1429356834.db2.gz REABRNHJVOBGFW-UHFFFAOYSA-N 2 1 386.565 3.340 20 0 GGADMP CC(C)n1nccc1NC(=O)[C@@H](C)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179393232 1429356954 /nfs/dbraw/zinc/35/69/54/1429356954.db2.gz YZJXIBQACGNLFF-GOSISDBHSA-N 2 1 398.555 3.425 20 0 GGADMP C[C@@H](C(=O)NCc1cccs1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179394346 1429357454 /nfs/dbraw/zinc/35/74/54/1429357454.db2.gz QFPAZDGDKRCACI-KRWDZBQOSA-N 2 1 386.565 3.386 20 0 GGADMP Cc1csc2nc(C[N@@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)cc(=O)n12 ZINC000179397619 1429359239 /nfs/dbraw/zinc/35/92/39/1429359239.db2.gz CUJHIJHVFKMENR-UHFFFAOYSA-N 2 1 397.548 3.198 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1nc2c(s1)CCCC2 ZINC000179421804 1429368700 /nfs/dbraw/zinc/36/87/00/1429368700.db2.gz IJQBDRFBSRHIHD-OAHLLOKOSA-N 2 1 386.565 3.164 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1 ZINC000179509921 1429402388 /nfs/dbraw/zinc/40/23/88/1429402388.db2.gz ZURWFJYSONCPPZ-QGZVFWFLSA-N 3 1 379.508 3.367 20 0 GGADMP CCC[C@@H]1CN(C(=O)[C@@H]2CCC[NH+]2C2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000179658977 1429494942 /nfs/dbraw/zinc/49/49/42/1429494942.db2.gz MXIDJWFOFMWZOY-PKTZIBPZSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@@H]1CN(C(=O)[C@@H]2CCC[NH+]2C2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000179658977 1429494943 /nfs/dbraw/zinc/49/49/43/1429494943.db2.gz MXIDJWFOFMWZOY-PKTZIBPZSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@@H]1CN(C(=O)[C@@H]2CCC[N@@H+]2C2CCOCC2)CC[NH+]1Cc1ccccc1 ZINC000179658977 1429494946 /nfs/dbraw/zinc/49/49/46/1429494946.db2.gz MXIDJWFOFMWZOY-PKTZIBPZSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@@H]1CN(C(=O)[C@@H]2CCC[N@H+]2C2CCOCC2)CC[NH+]1Cc1ccccc1 ZINC000179658977 1429494949 /nfs/dbraw/zinc/49/49/49/1429494949.db2.gz MXIDJWFOFMWZOY-PKTZIBPZSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@H]1CN(C(=O)[C@@H]2CCC[NH+]2C2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000179658988 1429494987 /nfs/dbraw/zinc/49/49/87/1429494987.db2.gz MXIDJWFOFMWZOY-GOTSBHOMSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@H]1CN(C(=O)[C@@H]2CCC[NH+]2C2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000179658988 1429494990 /nfs/dbraw/zinc/49/49/90/1429494990.db2.gz MXIDJWFOFMWZOY-GOTSBHOMSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@H]1CN(C(=O)[C@@H]2CCC[N@@H+]2C2CCOCC2)CC[NH+]1Cc1ccccc1 ZINC000179658988 1429494994 /nfs/dbraw/zinc/49/49/94/1429494994.db2.gz MXIDJWFOFMWZOY-GOTSBHOMSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@H]1CN(C(=O)[C@@H]2CCC[N@H+]2C2CCOCC2)CC[NH+]1Cc1ccccc1 ZINC000179658988 1429494996 /nfs/dbraw/zinc/49/49/96/1429494996.db2.gz MXIDJWFOFMWZOY-GOTSBHOMSA-N 2 1 399.579 3.143 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](Cc2nc(-c3cccs3)no2)CC1 ZINC000179677318 1429502872 /nfs/dbraw/zinc/50/28/72/1429502872.db2.gz JXYCHSVVHUSXFX-UHFFFAOYSA-N 2 1 378.542 3.369 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2nc(-c3cccs3)no2)CC1 ZINC000179677318 1429502880 /nfs/dbraw/zinc/50/28/80/1429502880.db2.gz JXYCHSVVHUSXFX-UHFFFAOYSA-N 2 1 378.542 3.369 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](C[C@@H]2CN(c3ccccc3)C(=O)O2)CC1 ZINC000179679383 1429503772 /nfs/dbraw/zinc/50/37/72/1429503772.db2.gz LJKJEOZWXGNFNP-OAQYLSRUSA-N 2 1 389.540 3.082 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000152305327 1422067827 /nfs/dbraw/zinc/06/78/27/1422067827.db2.gz CWZZLDXOIOPKDV-LEWJYISDSA-N 2 1 395.551 3.457 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000152305327 1422067830 /nfs/dbraw/zinc/06/78/30/1422067830.db2.gz CWZZLDXOIOPKDV-LEWJYISDSA-N 2 1 395.551 3.457 20 0 GGADMP C[C@@H]1CCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1n1ccnc1 ZINC000152404769 1422094352 /nfs/dbraw/zinc/09/43/52/1422094352.db2.gz RTMWISKIYADJOE-HMXCVIKNSA-N 2 1 381.524 3.140 20 0 GGADMP C[C@@H]1CCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1n1ccnc1 ZINC000152404611 1422094421 /nfs/dbraw/zinc/09/44/21/1422094421.db2.gz RTMWISKIYADJOE-NRSPTQNISA-N 2 1 381.524 3.140 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3c[nH]nc3-c3ccccc3F)CC2)nc(C)[nH+]1 ZINC000152464579 1422110714 /nfs/dbraw/zinc/11/07/14/1422110714.db2.gz OLFATIXCBSHBAJ-UHFFFAOYSA-N 2 1 380.471 3.381 20 0 GGADMP C[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C[C@H]1n1ccnc1 ZINC000152552544 1422140437 /nfs/dbraw/zinc/14/04/37/1422140437.db2.gz RUNHMXXMPZFJTO-DYESRHJHSA-N 2 1 399.514 3.279 20 0 GGADMP O[C@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)COc1ccc(F)cc1 ZINC000152555107 1422142887 /nfs/dbraw/zinc/14/28/87/1422142887.db2.gz QPRHDZPAQIJQLQ-OAQYLSRUSA-N 2 1 390.474 3.001 20 0 GGADMP Cc1cccc(OC[C@@H](O)C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)c1 ZINC000152890439 1422284660 /nfs/dbraw/zinc/28/46/60/1422284660.db2.gz QZBJSQQHDOFYFA-QFIPXVFZSA-N 2 1 386.511 3.171 20 0 GGADMP Cc1c(C(=O)Nc2ccc(C)cc2OCC[NH+](C)C)cnn1-c1cc[nH+]cc1 ZINC000152903082 1422289961 /nfs/dbraw/zinc/28/99/61/1422289961.db2.gz KGNWBUMLYCSYER-UHFFFAOYSA-N 2 1 379.464 3.077 20 0 GGADMP Cc1c(C(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)cnn1-c1cc[nH+]cc1 ZINC000153019921 1422328948 /nfs/dbraw/zinc/32/89/48/1422328948.db2.gz GBJUORJECBMXRY-SFHVURJKSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1c(C(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)cnn1-c1cc[nH+]cc1 ZINC000153019921 1422328959 /nfs/dbraw/zinc/32/89/59/1422328959.db2.gz GBJUORJECBMXRY-SFHVURJKSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)Nc1ccnn1[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000153039553 1422335903 /nfs/dbraw/zinc/33/59/03/1422335903.db2.gz OHGLIBPHYZKBKJ-FQEVSTJZSA-N 2 1 392.507 3.254 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)Nc1ccnn1[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000153039553 1422335911 /nfs/dbraw/zinc/33/59/11/1422335911.db2.gz OHGLIBPHYZKBKJ-FQEVSTJZSA-N 2 1 392.507 3.254 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NC2CC[NH+](C3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000153094408 1422354403 /nfs/dbraw/zinc/35/44/03/1422354403.db2.gz ZWJXNHBDEYVJOF-GHTZIAJQSA-N 2 1 384.568 3.356 20 0 GGADMP Cc1c(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cnn1-c1ccncc1 ZINC000153426777 1422529673 /nfs/dbraw/zinc/52/96/73/1422529673.db2.gz QGWUBJRNOJWNPO-HKUYNNGSSA-N 2 1 381.524 3.302 20 0 GGADMP Cc1c(C(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)cnn1-c1cc[nH+]cc1 ZINC000153426777 1422529689 /nfs/dbraw/zinc/52/96/89/1422529689.db2.gz QGWUBJRNOJWNPO-HKUYNNGSSA-N 2 1 381.524 3.302 20 0 GGADMP Cc1c(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cnn1-c1cc[nH+]cc1 ZINC000153426777 1422529700 /nfs/dbraw/zinc/52/97/00/1422529700.db2.gz QGWUBJRNOJWNPO-HKUYNNGSSA-N 2 1 381.524 3.302 20 0 GGADMP Cc1c(C(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cnn1-c1cc[nH+]cc1 ZINC000153455668 1422546612 /nfs/dbraw/zinc/54/66/12/1422546612.db2.gz SSPIPCLAUCIYGA-FQEVSTJZSA-N 2 1 389.503 3.170 20 0 GGADMP Cc1c(C(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cnn1-c1cc[nH+]cc1 ZINC000153455668 1422546620 /nfs/dbraw/zinc/54/66/20/1422546620.db2.gz SSPIPCLAUCIYGA-FQEVSTJZSA-N 2 1 389.503 3.170 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1)c1ccc([S@](C)=O)cc1 ZINC000153487049 1422564261 /nfs/dbraw/zinc/56/42/61/1422564261.db2.gz QESQADOWLYQQCG-DLEQGYHRSA-N 2 1 386.561 3.496 20 0 GGADMP CC(C)N(CC[NH+](C)C)C(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000153572395 1422626131 /nfs/dbraw/zinc/62/61/31/1422626131.db2.gz UITJMLDYJFXBPJ-QFBILLFUSA-N 2 1 398.954 3.454 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cccc(NC(=O)OC(C)(C)C)c3)C2)CC1 ZINC000153616015 1422650362 /nfs/dbraw/zinc/65/03/62/1422650362.db2.gz GVYRJHCIJREZMV-HXUWFJFHSA-N 2 1 388.556 3.245 20 0 GGADMP CC(C)[NH+]1CCC(C(=O)Nc2ccnn2[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000153652090 1422679691 /nfs/dbraw/zinc/67/96/91/1422679691.db2.gz VDUZJUOONSDVCT-NRFANRHFSA-N 2 1 395.551 3.389 20 0 GGADMP O=C(c1ccc(C[NH+]2CCSCC2)cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000153652771 1422680061 /nfs/dbraw/zinc/68/00/61/1422680061.db2.gz BIBZJXKEEMLWCL-IFMALSPDSA-N 2 1 399.604 3.324 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c(SC)cc1OC ZINC000153790712 1422759266 /nfs/dbraw/zinc/75/92/66/1422759266.db2.gz OVCGKSZGXNJJDU-HNNXBMFYSA-N 2 1 380.554 3.016 20 0 GGADMP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](CCC(=O)Nc2ccccc2Cl)CC1 ZINC000153926654 1422812137 /nfs/dbraw/zinc/81/21/37/1422812137.db2.gz SINJZUPKHMUTQX-ROUUACIJSA-N 2 1 392.975 3.159 20 0 GGADMP O=C(C[N@@H+]1CCC[C@@H]1c1ccncc1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000154091727 1422838935 /nfs/dbraw/zinc/83/89/35/1422838935.db2.gz BWAKAKOYSHVZIS-JOCHJYFZSA-N 2 1 378.520 3.131 20 0 GGADMP O=C(C[N@H+]1CCC[C@@H]1c1ccncc1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000154091727 1422838936 /nfs/dbraw/zinc/83/89/36/1422838936.db2.gz BWAKAKOYSHVZIS-JOCHJYFZSA-N 2 1 378.520 3.131 20 0 GGADMP CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000154381869 1422881634 /nfs/dbraw/zinc/88/16/34/1422881634.db2.gz DVRRYKYDTFFJKM-HSZRJFAPSA-N 2 1 392.547 3.421 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N3CC[NH+](C4CCCCC4)CC3)cc2)C[C@H](C)O1 ZINC000154593144 1422949245 /nfs/dbraw/zinc/94/92/45/1422949245.db2.gz WCLIVONPZOAPIT-PMACEKPBSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CC[NH+](C4CCCCC4)CC3)cc2)C[C@H](C)O1 ZINC000154593032 1422949476 /nfs/dbraw/zinc/94/94/76/1422949476.db2.gz WCLIVONPZOAPIT-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CC[NH+](C4CCCCC4)CC3)cc2)C[C@H](C)O1 ZINC000154593032 1422949487 /nfs/dbraw/zinc/94/94/87/1422949487.db2.gz WCLIVONPZOAPIT-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCN1CCN(c2ccccc2Cl)CC1 ZINC000154660612 1422989515 /nfs/dbraw/zinc/98/95/15/1422989515.db2.gz XXMPOCQDWVNRLT-GGPKGHCWSA-N 2 1 378.992 3.170 20 0 GGADMP COc1cccc(COC[C@@H](O)C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000154736704 1423016427 /nfs/dbraw/zinc/01/64/27/1423016427.db2.gz KZJOGOLZKWKSDQ-VXKWHMMOSA-N 2 1 390.568 3.017 20 0 GGADMP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CN1Cc2ccc(F)cc2C1=O ZINC000179865793 1429616025 /nfs/dbraw/zinc/61/60/25/1429616025.db2.gz IERIPZYCOUEBAY-UHFFFAOYSA-N 2 1 382.483 3.373 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CN1Cc2ccc(F)cc2C1=O ZINC000179865793 1429616033 /nfs/dbraw/zinc/61/60/33/1429616033.db2.gz IERIPZYCOUEBAY-UHFFFAOYSA-N 2 1 382.483 3.373 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](Cc2cn(C)nc2-c2ccccc2)CC1 ZINC000179910705 1429636204 /nfs/dbraw/zinc/63/62/04/1429636204.db2.gz DPBZSQVINHFOTP-BGYRXZFFSA-N 2 1 381.568 3.078 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](Cc2cn(C)nc2-c2ccccc2)CC1 ZINC000179910705 1429636207 /nfs/dbraw/zinc/63/62/07/1429636207.db2.gz DPBZSQVINHFOTP-BGYRXZFFSA-N 2 1 381.568 3.078 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H](C)[N@@H+]2CCc3ccccc3C2)CC1 ZINC000155600138 1423439188 /nfs/dbraw/zinc/43/91/88/1423439188.db2.gz PQQJIJZPVMTWLG-MOPGFXCFSA-N 2 1 392.547 3.170 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H](C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000155600138 1423439195 /nfs/dbraw/zinc/43/91/95/1423439195.db2.gz PQQJIJZPVMTWLG-MOPGFXCFSA-N 2 1 392.547 3.170 20 0 GGADMP CC1CC[NH+](CC(=O)NC[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000155614804 1423447039 /nfs/dbraw/zinc/44/70/39/1423447039.db2.gz MAAWKGKYAOIQNI-OXQOHEQNSA-N 2 1 381.923 3.320 20 0 GGADMP CC1CC[NH+](CC(=O)NC[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000155614704 1423447513 /nfs/dbraw/zinc/44/75/13/1423447513.db2.gz MAAWKGKYAOIQNI-OXJNMPFZSA-N 2 1 381.923 3.320 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000155662939 1423474983 /nfs/dbraw/zinc/47/49/83/1423474983.db2.gz RQNRNHAGHOFOMC-WMZHIEFXSA-N 2 1 392.547 3.388 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000155663056 1423475381 /nfs/dbraw/zinc/47/53/81/1423475381.db2.gz RQNRNHAGHOFOMC-AUSIDOKSSA-N 2 1 392.547 3.388 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](CCCC(=O)Nc3c(C)cc(C)cc3C)C2)CC1 ZINC000155684408 1423486140 /nfs/dbraw/zinc/48/61/40/1423486140.db2.gz VWTWFRJXDKRPAD-NRFANRHFSA-N 2 1 386.584 3.042 20 0 GGADMP C[N@@H+](CC(=O)NCc1ccccc1C[NH+]1CCCCCC1)[C@@H]1CCSC1 ZINC000155860343 1423565712 /nfs/dbraw/zinc/56/57/12/1423565712.db2.gz VVXZJIPKKWDUQH-HXUWFJFHSA-N 2 1 375.582 3.116 20 0 GGADMP C[NH+](C)Cc1cccc(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)c1 ZINC000155860644 1423566396 /nfs/dbraw/zinc/56/63/96/1423566396.db2.gz SBRUDGKCGHPYGE-UHFFFAOYSA-N 2 1 387.474 3.421 20 0 GGADMP CC1CC[NH+](Cc2ccc(NCc3cnc(N4CC[NH+](C)CC4)nc3)cc2)CC1 ZINC000156077389 1423662122 /nfs/dbraw/zinc/66/21/22/1423662122.db2.gz JQRGVIKUHFZEAT-UHFFFAOYSA-N 2 1 394.567 3.072 20 0 GGADMP C[C@H]1CCC[N@H+](Cc2ccc(NCc3cnc(N4CC[NH+](C)CC4)nc3)cc2)C1 ZINC000156105263 1423674167 /nfs/dbraw/zinc/67/41/67/1423674167.db2.gz PHCFSZJSTVBPLK-IBGZPJMESA-N 2 1 394.567 3.072 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(NCc3cnc(N4CC[NH+](C)CC4)nc3)cc2)C1 ZINC000156105263 1423674176 /nfs/dbraw/zinc/67/41/76/1423674176.db2.gz PHCFSZJSTVBPLK-IBGZPJMESA-N 2 1 394.567 3.072 20 0 GGADMP CNS(=O)(=O)c1ccc([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cc1 ZINC000156228280 1423735535 /nfs/dbraw/zinc/73/55/35/1423735535.db2.gz ZEWYQHKGELXWDL-ZWKOTPCHSA-N 2 1 389.565 3.156 20 0 GGADMP CNS(=O)(=O)c1ccc([C@@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)cc1 ZINC000156228280 1423735540 /nfs/dbraw/zinc/73/55/40/1423735540.db2.gz ZEWYQHKGELXWDL-ZWKOTPCHSA-N 2 1 389.565 3.156 20 0 GGADMP CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCOCC2)C1 ZINC000156240089 1423739313 /nfs/dbraw/zinc/73/93/13/1423739313.db2.gz GNFXWVWTTHMUSN-HXUWFJFHSA-N 2 1 389.540 3.008 20 0 GGADMP CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCOCC2)C1 ZINC000156239968 1423739421 /nfs/dbraw/zinc/73/94/21/1423739421.db2.gz GNFXWVWTTHMUSN-FQEVSTJZSA-N 2 1 389.540 3.008 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000156353880 1423793878 /nfs/dbraw/zinc/79/38/78/1423793878.db2.gz ALWNCDVVRNANMZ-QFIPXVFZSA-N 2 1 384.568 3.095 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4cc(F)ccc43)c2)C1 ZINC000156887725 1423881012 /nfs/dbraw/zinc/88/10/12/1423881012.db2.gz ZTMLOSRVPVDAGI-SIKLNZKXSA-N 2 1 381.495 3.300 20 0 GGADMP COc1ccccc1C[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156893732 1423881909 /nfs/dbraw/zinc/88/19/09/1423881909.db2.gz CRXNRVSKESCNMP-GCJKJVERSA-N 2 1 395.547 3.113 20 0 GGADMP COc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156912549 1423884753 /nfs/dbraw/zinc/88/47/53/1423884753.db2.gz QYARVZZTFRQYJO-XLIONFOSSA-N 2 1 381.520 3.243 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCCOc4ccccc43)c2)C1 ZINC000156932063 1423888450 /nfs/dbraw/zinc/88/84/50/1423888450.db2.gz ZFZWHEXJTSKSBC-RBBKRZOGSA-N 2 1 393.531 3.387 20 0 GGADMP CC[C@H](Cc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156936238 1423889739 /nfs/dbraw/zinc/88/97/39/1423889739.db2.gz NQPSGAFHRKGXFV-XZOQPEGZSA-N 2 1 379.548 3.495 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@H](COc3ccccc3Cl)C2)CC1 ZINC000157068729 1423916969 /nfs/dbraw/zinc/91/69/69/1423916969.db2.gz KGUVXRBTUVCOAH-KRWDZBQOSA-N 2 1 393.959 3.031 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cnn(-c2ccccc2)c1C ZINC000157157294 1423940447 /nfs/dbraw/zinc/94/04/47/1423940447.db2.gz IOXGOEZBWULHQI-FQEVSTJZSA-N 2 1 398.555 3.061 20 0 GGADMP c1ccc(-c2nnn(CCCCC[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)n2)cc1 ZINC000157375551 1423997056 /nfs/dbraw/zinc/99/70/56/1423997056.db2.gz FPZRXXOUTBARIE-NRFANRHFSA-N 2 1 382.556 3.461 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1c(C)cc(N(C)C)cc1C ZINC000157379188 1423998572 /nfs/dbraw/zinc/99/85/72/1423998572.db2.gz KAXYPRMVACOSBC-LJQANCHMSA-N 2 1 389.588 3.249 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(F)cc2Cl)CC1 ZINC000157497719 1424023860 /nfs/dbraw/zinc/02/38/60/1424023860.db2.gz HTQYBFOMJBIWRL-UHFFFAOYSA-N 2 1 383.939 3.395 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000157532244 1424031720 /nfs/dbraw/zinc/03/17/20/1424031720.db2.gz HZABDKDXGDONCC-QGZVFWFLSA-N 2 1 383.540 3.100 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000157532396 1424031838 /nfs/dbraw/zinc/03/18/38/1424031838.db2.gz HZABDKDXGDONCC-KRWDZBQOSA-N 2 1 383.540 3.100 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1 ZINC000157617048 1424049826 /nfs/dbraw/zinc/04/98/26/1424049826.db2.gz PYKKTUXPOAOIHP-MRXNPFEDSA-N 2 1 391.947 3.254 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1N1CCCC1 ZINC000157754595 1424080915 /nfs/dbraw/zinc/08/09/15/1424080915.db2.gz RRIUAIQGWKIQPH-LJQANCHMSA-N 2 1 387.572 3.167 20 0 GGADMP CCCOc1cccc(NC(=O)N(CC[NH+](C)C)C[C@H]2CCC[N@H+]2CC)c1 ZINC000157857991 1424105374 /nfs/dbraw/zinc/10/53/74/1424105374.db2.gz IVKOEKFLEKXHRC-LJQANCHMSA-N 2 1 376.545 3.355 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C[NH+]1CCC(OC2CCCCC2)CC1)c1ccccc1 ZINC000158066802 1424155387 /nfs/dbraw/zinc/15/53/87/1424155387.db2.gz BOWDMVZCWOKBGL-QFIPXVFZSA-N 2 1 387.568 3.219 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000158143079 1424177711 /nfs/dbraw/zinc/17/77/11/1424177711.db2.gz NKNTVYUTAUOOGC-MISYRCLQSA-N 2 1 386.540 3.075 20 0 GGADMP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000158391227 1424242828 /nfs/dbraw/zinc/24/28/28/1424242828.db2.gz GYFUGSPCKGGWRL-CQSZACIVSA-N 2 1 394.350 3.256 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C[NH+]1CCC(OCC2CCCC2)CC1)c1ccccc1 ZINC000158856565 1424357843 /nfs/dbraw/zinc/35/78/43/1424357843.db2.gz UFSOUXWRRFEEDD-QFIPXVFZSA-N 2 1 387.568 3.077 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000158934788 1424376351 /nfs/dbraw/zinc/37/63/51/1424376351.db2.gz XNSDWCQBGDTSSV-UHFFFAOYSA-N 2 1 393.597 3.214 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)NCCC2CC[NH+](C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000158978760 1424385954 /nfs/dbraw/zinc/38/59/54/1424385954.db2.gz RYWVAAJLHVOEGI-DENIHFKCSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1ccc(F)cc1C[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000180066866 1429722721 /nfs/dbraw/zinc/72/27/21/1429722721.db2.gz OTLTXOGGOGPPNN-UHFFFAOYSA-N 2 1 385.483 3.085 20 0 GGADMP CCN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000159046442 1424404347 /nfs/dbraw/zinc/40/43/47/1424404347.db2.gz CMUZPXRCUGJVDN-PMACEKPBSA-N 2 1 384.524 3.188 20 0 GGADMP CCN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159046442 1424404356 /nfs/dbraw/zinc/40/43/56/1424404356.db2.gz CMUZPXRCUGJVDN-PMACEKPBSA-N 2 1 384.524 3.188 20 0 GGADMP C[NH+](C)CCCC1CC[NH+](Cn2c3ccc(Br)cc3oc2=O)CC1 ZINC000160025406 1424563618 /nfs/dbraw/zinc/56/36/18/1424563618.db2.gz ZHQSTKOHPSQSLH-UHFFFAOYSA-N 2 1 396.329 3.368 20 0 GGADMP CN(C(=O)NCCSC(C)(C)C)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000160609588 1424618704 /nfs/dbraw/zinc/61/87/04/1424618704.db2.gz ZZNGRJBUCASNLX-RTBURBONSA-N 2 1 398.661 3.497 20 0 GGADMP O=S(=O)(NCC[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccc(Cl)c1 ZINC000162078345 1424814237 /nfs/dbraw/zinc/81/42/37/1424814237.db2.gz NZRBOHKPALZOAQ-UHFFFAOYSA-N 2 1 399.988 3.005 20 0 GGADMP Cc1ccccc1C[NH+]1CCC([NH2+]C2CCN(C(=O)c3ccoc3)CC2)CC1 ZINC000162148498 1424819985 /nfs/dbraw/zinc/81/99/85/1424819985.db2.gz WWTLNTUVUPPUFX-UHFFFAOYSA-N 2 1 381.520 3.447 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H](C)c3ccc(N4CCOC4=O)cc3)CC2)nc(C)[nH+]1 ZINC000162235328 1424829550 /nfs/dbraw/zinc/82/95/50/1424829550.db2.gz TXKLBKQLAWZVAQ-INIZCTEOSA-N 2 1 395.507 3.370 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000162389308 1424845245 /nfs/dbraw/zinc/84/52/45/1424845245.db2.gz YXGITBDHGOGWFR-HXUWFJFHSA-N 2 1 387.572 3.204 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000162389448 1424845271 /nfs/dbraw/zinc/84/52/71/1424845271.db2.gz YXGITBDHGOGWFR-FQEVSTJZSA-N 2 1 387.572 3.204 20 0 GGADMP COc1cccc(C(=O)NCC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000162405692 1424846869 /nfs/dbraw/zinc/84/68/69/1424846869.db2.gz ONDURDUMKMALBF-MRXNPFEDSA-N 2 1 378.476 3.270 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(OC(C)(C)C)CC1 ZINC000162508889 1424860091 /nfs/dbraw/zinc/86/00/91/1424860091.db2.gz XMBPFWYHQAHQMW-QUCCMNQESA-N 2 1 387.568 3.045 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(OC(C)(C)C)CC1 ZINC000162508889 1424860095 /nfs/dbraw/zinc/86/00/95/1424860095.db2.gz XMBPFWYHQAHQMW-QUCCMNQESA-N 2 1 387.568 3.045 20 0 GGADMP Cn1cc([C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c2cccc(F)c2)cn1 ZINC000180151855 1429763265 /nfs/dbraw/zinc/76/32/65/1429763265.db2.gz KFMASHGYZMCOJZ-QFIPXVFZSA-N 2 1 382.483 3.379 20 0 GGADMP C[C@H]([NH2+]CCCN(C)Cc1ccccc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000162747016 1424887371 /nfs/dbraw/zinc/88/73/71/1424887371.db2.gz KMVPYJGJOCIWNH-INIZCTEOSA-N 2 1 378.513 3.402 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NCc2ccc(-n3nc(C)cc3C)nc2)[C@H](C)C1 ZINC000162786909 1424890574 /nfs/dbraw/zinc/89/05/74/1424890574.db2.gz RNKFLUJMNCQWTP-DYESRHJHSA-N 2 1 385.556 3.111 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(-n3nc(C)cc3C)nc2)[C@H](C)C1 ZINC000162786909 1424890575 /nfs/dbraw/zinc/89/05/75/1424890575.db2.gz RNKFLUJMNCQWTP-DYESRHJHSA-N 2 1 385.556 3.111 20 0 GGADMP COc1cc(NC(=O)CC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c(OC)cc1Cl ZINC000162796325 1424891074 /nfs/dbraw/zinc/89/10/74/1424891074.db2.gz RRAGEPQVVZUHRG-YOEHRIQHSA-N 2 1 395.931 3.102 20 0 GGADMP COc1cc(NC(=O)CC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c(OC)cc1Cl ZINC000162796325 1424891076 /nfs/dbraw/zinc/89/10/76/1424891076.db2.gz RRAGEPQVVZUHRG-YOEHRIQHSA-N 2 1 395.931 3.102 20 0 GGADMP COc1cc(NC(=O)CC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c(OC)cc1Cl ZINC000162796325 1424891077 /nfs/dbraw/zinc/89/10/77/1424891077.db2.gz RRAGEPQVVZUHRG-YOEHRIQHSA-N 2 1 395.931 3.102 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(-n2cnnn2)c1 ZINC000163219510 1424961209 /nfs/dbraw/zinc/96/12/09/1424961209.db2.gz WZAZGMSGCCAKAI-BBTUJRGHSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(-n2cnnn2)c1 ZINC000163219510 1424961211 /nfs/dbraw/zinc/96/12/11/1424961211.db2.gz WZAZGMSGCCAKAI-BBTUJRGHSA-N 2 1 376.508 3.366 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccc2)CC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000163239762 1424965114 /nfs/dbraw/zinc/96/51/14/1424965114.db2.gz UZJIGKBXDRRZIT-NFBKMPQASA-N 2 1 396.579 3.309 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@H]3CCC[N@@H+](CC(C)C)C3)CC2)cs1 ZINC000163335411 1424981363 /nfs/dbraw/zinc/98/13/63/1424981363.db2.gz NLOTUXZWCAYUAD-GOSISDBHSA-N 2 1 392.613 3.148 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@H]3CCC[N@H+](CC(C)C)C3)CC2)cs1 ZINC000163335411 1424981370 /nfs/dbraw/zinc/98/13/70/1424981370.db2.gz NLOTUXZWCAYUAD-GOSISDBHSA-N 2 1 392.613 3.148 20 0 GGADMP CC(C)CC(=O)N1CCC([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000163431817 1424997956 /nfs/dbraw/zinc/99/79/56/1424997956.db2.gz OWGGASRNAUIMMV-UHFFFAOYSA-N 2 1 389.559 3.459 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)C1CCOCC1 ZINC000163975789 1425064800 /nfs/dbraw/zinc/06/48/00/1425064800.db2.gz FCRPTHDUSAYJEA-SFHVURJKSA-N 2 1 376.541 3.081 20 0 GGADMP C[C@H](CC1CCOCC1)[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000163975667 1425064896 /nfs/dbraw/zinc/06/48/96/1425064896.db2.gz UIDQUXFAUZVISL-LJQANCHMSA-N 2 1 390.568 3.471 20 0 GGADMP CC(C)(C)OC(=O)N1CC([NH2+]C2CCN(CCc3ccc(F)cc3)CC2)C1 ZINC000164018828 1425068746 /nfs/dbraw/zinc/06/87/46/1425068746.db2.gz ICWNMYIIBGRFDX-UHFFFAOYSA-N 2 1 377.504 3.042 20 0 GGADMP CCOc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000164258278 1425093012 /nfs/dbraw/zinc/09/30/12/1425093012.db2.gz AHXOVWLFGNDWDL-FGTMMUONSA-N 2 1 388.556 3.037 20 0 GGADMP CC(C)(C)OC(=O)N1CC[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000164530673 1425121311 /nfs/dbraw/zinc/12/13/11/1425121311.db2.gz OWAFNNIKOVUGAJ-FQEVSTJZSA-N 2 1 391.531 3.432 20 0 GGADMP COc1cc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCC2)ccc1S(=O)(=O)C(F)F ZINC000165310106 1425174181 /nfs/dbraw/zinc/17/41/81/1425174181.db2.gz JNWSJZSQGYJWFD-KGLIPLIRSA-N 2 1 390.496 3.074 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCC2)ccc1S(=O)(=O)C(F)F ZINC000165310350 1425175543 /nfs/dbraw/zinc/17/55/43/1425175543.db2.gz JNWSJZSQGYJWFD-ZIAGYGMSSA-N 2 1 390.496 3.074 20 0 GGADMP CC[NH+](CC)CCOc1ccc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000166220219 1425208479 /nfs/dbraw/zinc/20/84/79/1425208479.db2.gz DMMCZMUYHWEPMT-WOJBJXKFSA-N 2 1 375.557 3.132 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1OC ZINC000166220219 1425208484 /nfs/dbraw/zinc/20/84/84/1425208484.db2.gz DMMCZMUYHWEPMT-WOJBJXKFSA-N 3 1 375.557 3.132 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000166220219 1425208488 /nfs/dbraw/zinc/20/84/88/1425208488.db2.gz DMMCZMUYHWEPMT-WOJBJXKFSA-N 3 1 375.557 3.132 20 0 GGADMP FC(F)(F)c1ccc([C@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)N2CCOCC2)cc1 ZINC000166419698 1425213068 /nfs/dbraw/zinc/21/30/68/1425213068.db2.gz UCKDBRBPRAYJIE-AQNXPRMDSA-N 2 1 397.485 3.295 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000167308005 1425223672 /nfs/dbraw/zinc/22/36/72/1425223672.db2.gz SCMHHJYDDFETBM-JOCHJYFZSA-N 2 1 381.520 3.066 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000167308005 1425223684 /nfs/dbraw/zinc/22/36/84/1425223684.db2.gz SCMHHJYDDFETBM-JOCHJYFZSA-N 2 1 381.520 3.066 20 0 GGADMP C[C@@H](c1ccc(NC(=O)C2(c3ccccc3)CC[NH2+]CC2)cc1)[NH+]1CCOCC1 ZINC000167679816 1425230787 /nfs/dbraw/zinc/23/07/87/1425230787.db2.gz UGVFBQYXNYREHB-IBGZPJMESA-N 2 1 393.531 3.340 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)CC[N@@H+]1C ZINC000167889436 1425233333 /nfs/dbraw/zinc/23/33/33/1425233333.db2.gz OOKXBDRUECDWTH-YLJYHZDGSA-N 2 1 398.551 3.014 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)CC[N@H+]1C ZINC000167889436 1425233341 /nfs/dbraw/zinc/23/33/41/1425233341.db2.gz OOKXBDRUECDWTH-YLJYHZDGSA-N 2 1 398.551 3.014 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000169001571 1425241086 /nfs/dbraw/zinc/24/10/86/1425241086.db2.gz XGLOPOLHNYNNIL-QFIPXVFZSA-N 2 1 377.532 3.089 20 0 GGADMP C[C@H](CC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)[C@@H]1CCC[NH2+]C1 ZINC000168952677 1425241471 /nfs/dbraw/zinc/24/14/71/1425241471.db2.gz ICRQSLNIWHNTGA-SUMDDJOVSA-N 2 1 397.485 3.422 20 0 GGADMP COc1ccccc1[C@H]([NH3+])C(=O)Nc1ccc(OCC[NH+]2CCCC2)c(C)c1 ZINC000169092422 1425242141 /nfs/dbraw/zinc/24/21/41/1425242141.db2.gz MKQLDDKGRAKCAT-NRFANRHFSA-N 2 1 383.492 3.117 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[N@H+]3C[C@H](C)C[C@H](C)C3)CC2)cs1 ZINC000170685342 1425298480 /nfs/dbraw/zinc/29/84/80/1425298480.db2.gz YBMFIWOSGJWALY-CALCHBBNSA-N 2 1 392.613 3.148 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)cs1 ZINC000170685342 1425298485 /nfs/dbraw/zinc/29/84/85/1425298485.db2.gz YBMFIWOSGJWALY-CALCHBBNSA-N 2 1 392.613 3.148 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[NH+]3C[C@H](C)C[C@@H](C)C3)CC2)cs1 ZINC000170685347 1425298582 /nfs/dbraw/zinc/29/85/82/1425298582.db2.gz YBMFIWOSGJWALY-IAGOWNOFSA-N 2 1 392.613 3.148 20 0 GGADMP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)CCCC[NH+]3CCOCC3)cc2)C1 ZINC000170694307 1425303678 /nfs/dbraw/zinc/30/36/78/1425303678.db2.gz QDBOAJMIUHBFDG-HXUWFJFHSA-N 2 1 387.568 3.037 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)CCCC[NH+]3CCOCC3)cc2)C1 ZINC000170694307 1425303687 /nfs/dbraw/zinc/30/36/87/1425303687.db2.gz QDBOAJMIUHBFDG-HXUWFJFHSA-N 2 1 387.568 3.037 20 0 GGADMP CC[NH+]1CCC(n2nccc2NC(=O)C2CCN(c3ccc(C)c[nH+]3)CC2)CC1 ZINC000170765454 1425331472 /nfs/dbraw/zinc/33/14/72/1425331472.db2.gz PIPYJXUUZWHGKP-UHFFFAOYSA-N 2 1 396.539 3.098 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)[C@@H](c3ccccc3)[NH+](C)C)c(C)c2)CC1 ZINC000171015718 1425438058 /nfs/dbraw/zinc/43/80/58/1425438058.db2.gz YJBFWFIVBXBYJM-JOCHJYFZSA-N 2 1 380.536 3.378 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000171212590 1425542591 /nfs/dbraw/zinc/54/25/91/1425542591.db2.gz BVVMNRBVLSIYSC-WMZOPIPTSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000171212590 1425542593 /nfs/dbraw/zinc/54/25/93/1425542593.db2.gz BVVMNRBVLSIYSC-WMZOPIPTSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1nccn1C[C@@H](C)CNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000171215741 1425544211 /nfs/dbraw/zinc/54/42/11/1425544211.db2.gz CRBRHCOJJBSXAG-FQEVSTJZSA-N 2 1 397.567 3.178 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000171215741 1425544219 /nfs/dbraw/zinc/54/42/19/1425544219.db2.gz CRBRHCOJJBSXAG-FQEVSTJZSA-N 2 1 397.567 3.178 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000171215741 1425544225 /nfs/dbraw/zinc/54/42/25/1425544225.db2.gz CRBRHCOJJBSXAG-FQEVSTJZSA-N 2 1 397.567 3.178 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](Cc2nc(-c3ccc4c(c3)OCO4)no2)CC1 ZINC000171296256 1425601580 /nfs/dbraw/zinc/60/15/80/1425601580.db2.gz GYAQSGMRVBPOST-UHFFFAOYSA-N 2 1 386.496 3.409 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2nc(-c3ccc4c(c3)OCO4)no2)CC1 ZINC000171296256 1425601581 /nfs/dbraw/zinc/60/15/81/1425601581.db2.gz GYAQSGMRVBPOST-UHFFFAOYSA-N 2 1 386.496 3.409 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cn4cc(Cl)ccc4n3)CC2)C[C@@H](C)O1 ZINC000171304418 1425605700 /nfs/dbraw/zinc/60/57/00/1425605700.db2.gz ZQXJIOGDYNSHCI-HZPDHXFCSA-N 2 1 376.932 3.309 20 0 GGADMP Cc1ccc(C)c(NC(=O)[C@H](C)[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000171306008 1425606749 /nfs/dbraw/zinc/60/67/49/1425606749.db2.gz STCITNMLQCQYLH-ZCNNSNEGSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1ccc(C)c(NC(=O)[C@H](C)[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000171306008 1425606754 /nfs/dbraw/zinc/60/67/54/1425606754.db2.gz STCITNMLQCQYLH-ZCNNSNEGSA-N 2 1 387.568 3.452 20 0 GGADMP CC(C)N(C(=O)C[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000171306535 1425606763 /nfs/dbraw/zinc/60/67/63/1425606763.db2.gz LLHVPOHYQSWEMM-PMACEKPBSA-N 2 1 387.568 3.249 20 0 GGADMP Cc1ccc(C)c(NC(=O)[C@H](C)[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000171306019 1425606848 /nfs/dbraw/zinc/60/68/48/1425606848.db2.gz STCITNMLQCQYLH-AQNXPRMDSA-N 2 1 387.568 3.452 20 0 GGADMP C[C@H](CNC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1)C[NH+]1CCCC1 ZINC000171313699 1425612777 /nfs/dbraw/zinc/61/27/77/1425612777.db2.gz XQQAIYNAZFOSEQ-HXUWFJFHSA-N 2 1 386.584 3.272 20 0 GGADMP c1c(C[NH2+]CCCCN2CC[NH+](Cc3ccccc3)CC2)nc2ccccn12 ZINC000171379580 1425649847 /nfs/dbraw/zinc/64/98/47/1425649847.db2.gz SBEXWVOWVYEIQU-UHFFFAOYSA-N 2 1 377.536 3.022 20 0 GGADMP CC(C)(CNC(=O)N1CCC[C@@H]1C[NH+]1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000171633261 1425766477 /nfs/dbraw/zinc/76/64/77/1425766477.db2.gz VEBTWXMQKYBQBS-OAQYLSRUSA-N 2 1 384.568 3.093 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000171662238 1425780460 /nfs/dbraw/zinc/78/04/60/1425780460.db2.gz VMXDKVUANLVJHK-JOCHJYFZSA-N 2 1 386.584 3.318 20 0 GGADMP Cc1ccc(OC2CC[NH+](CC(=O)NC3CC[NH+](C(C)C)CC3)CC2)cc1C ZINC000172246384 1425964240 /nfs/dbraw/zinc/96/42/40/1425964240.db2.gz ARLIGYIDVRTSBN-UHFFFAOYSA-N 2 1 387.568 3.136 20 0 GGADMP CN(CC[NH+]1CCN(c2ccccc2)CC1)C(=O)Nc1cccc(C[NH+](C)C)c1 ZINC000172335040 1426004259 /nfs/dbraw/zinc/00/42/59/1426004259.db2.gz SIGFXPREMVDNQY-UHFFFAOYSA-N 2 1 395.551 3.034 20 0 GGADMP C[C@H]1C[C@@H](N(C)C(=O)CCCC[NH+]2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000172411826 1426030491 /nfs/dbraw/zinc/03/04/91/1426030491.db2.gz KNCVNKKELPKMCC-UNMCSNQZSA-N 2 1 387.568 3.000 20 0 GGADMP C[C@H]1C[C@@H](N(C)C(=O)CCCC[NH+]2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000172411826 1426030502 /nfs/dbraw/zinc/03/05/02/1426030502.db2.gz KNCVNKKELPKMCC-UNMCSNQZSA-N 2 1 387.568 3.000 20 0 GGADMP CSCC[C@@H](C)[N@@H+](C)CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000172432933 1426042129 /nfs/dbraw/zinc/04/21/29/1426042129.db2.gz OIZNAOZRSKXUJL-GOSISDBHSA-N 2 1 377.598 3.149 20 0 GGADMP C[C@H](CNC(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1)C[NH+]1CCOCC1 ZINC000172460306 1426048947 /nfs/dbraw/zinc/04/89/47/1426048947.db2.gz JWCDIXPKZJDOGP-HXUWFJFHSA-N 2 1 395.547 3.017 20 0 GGADMP C[C@H](CNC(=O)c1cccc(C[N@@H+](C)Cc2ccccc2)c1)C[NH+]1CCOCC1 ZINC000172460306 1426048955 /nfs/dbraw/zinc/04/89/55/1426048955.db2.gz JWCDIXPKZJDOGP-HXUWFJFHSA-N 2 1 395.547 3.017 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)c1cccc(F)c1 ZINC000172517809 1426068236 /nfs/dbraw/zinc/06/82/36/1426068236.db2.gz MUFZQUHCYOUWOA-FQEVSTJZSA-N 2 1 376.520 3.088 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[N@@H+](C2CCCC2)CC1)[NH+]1CCc2sccc2C1 ZINC000172550479 1426082708 /nfs/dbraw/zinc/08/27/08/1426082708.db2.gz FCPVKOIROYHNGS-KRWDZBQOSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)[NH+]1CCc2sccc2C1 ZINC000172550479 1426082718 /nfs/dbraw/zinc/08/27/18/1426082718.db2.gz FCPVKOIROYHNGS-KRWDZBQOSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[NH+](C2CCCC2)CC1)[N@@H+]1CCc2sccc2C1 ZINC000172550479 1426082724 /nfs/dbraw/zinc/08/27/24/1426082724.db2.gz FCPVKOIROYHNGS-KRWDZBQOSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[NH+](C2CCCC2)CC1)[N@H+]1CCc2sccc2C1 ZINC000172550479 1426082732 /nfs/dbraw/zinc/08/27/32/1426082732.db2.gz FCPVKOIROYHNGS-KRWDZBQOSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@@H+]1CCc2sccc2C1 ZINC000172550473 1426082750 /nfs/dbraw/zinc/08/27/50/1426082750.db2.gz MDUUWDPIZRSPNN-PKOBYXMFSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2sccc2C1 ZINC000172550473 1426082761 /nfs/dbraw/zinc/08/27/61/1426082761.db2.gz MDUUWDPIZRSPNN-PKOBYXMFSA-N 2 1 390.597 3.155 20 0 GGADMP CC(C)(CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000172549388 1426083048 /nfs/dbraw/zinc/08/30/48/1426083048.db2.gz AIJQEDCDDDNDKZ-JOCHJYFZSA-N 2 1 398.595 3.483 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)c1ccc(F)cc1 ZINC000172556842 1426085688 /nfs/dbraw/zinc/08/56/88/1426085688.db2.gz JOKAFAQNGCWCAK-FQEVSTJZSA-N 2 1 376.520 3.088 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172652082 1426128111 /nfs/dbraw/zinc/12/81/11/1426128111.db2.gz GCXWACZKQGUIFB-UHFFFAOYSA-N 2 1 399.583 3.229 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000172655035 1426129275 /nfs/dbraw/zinc/12/92/75/1426129275.db2.gz WGBRITPOJCVMPH-MRXNPFEDSA-N 2 1 384.471 3.168 20 0 GGADMP CC[NH+](CC)CCSCC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000172783835 1426186164 /nfs/dbraw/zinc/18/61/64/1426186164.db2.gz CHMUXDGNCXPOAV-KRWDZBQOSA-N 2 1 379.570 3.093 20 0 GGADMP C[C@H](c1ccc(NC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)cc1)[NH+]1CCOCC1 ZINC000173136838 1426359032 /nfs/dbraw/zinc/35/90/32/1426359032.db2.gz GGIJJTQCICSDIP-NQIIRXRSSA-N 2 1 388.556 3.418 20 0 GGADMP C[C@H](c1ccc(NC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1)[NH+]1CCOCC1 ZINC000173136838 1426359036 /nfs/dbraw/zinc/35/90/36/1426359036.db2.gz GGIJJTQCICSDIP-NQIIRXRSSA-N 2 1 388.556 3.418 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000173323607 1426505875 /nfs/dbraw/zinc/50/58/75/1426505875.db2.gz GZKORVOZBUCXRA-FYYLOGMGSA-N 2 1 394.563 3.453 20 0 GGADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173325677 1426507429 /nfs/dbraw/zinc/50/74/29/1426507429.db2.gz MQZBDORQPDUTDS-OTWHNJEPSA-N 2 1 395.613 3.346 20 0 GGADMP O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)NCCCCC[NH+]1CCCCC1 ZINC000173327155 1426508272 /nfs/dbraw/zinc/50/82/72/1426508272.db2.gz NUYHMEOYCDQDOV-QFIPXVFZSA-N 2 1 387.568 3.050 20 0 GGADMP O=C(C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)NCCCCC[NH+]1CCCCC1 ZINC000173327155 1426508280 /nfs/dbraw/zinc/50/82/80/1426508280.db2.gz NUYHMEOYCDQDOV-QFIPXVFZSA-N 2 1 387.568 3.050 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@H](C)[NH+]3CCCCCC3)CC2)cs1 ZINC000173328016 1426509221 /nfs/dbraw/zinc/50/92/21/1426509221.db2.gz UNOZEAGDBFZMHX-KRWDZBQOSA-N 2 1 392.613 3.298 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1OC ZINC000173335304 1426516521 /nfs/dbraw/zinc/51/65/21/1426516521.db2.gz QGLKAVQHKPHRCU-GOSISDBHSA-N 2 1 383.536 3.302 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000173349491 1426527300 /nfs/dbraw/zinc/52/73/00/1426527300.db2.gz NUZOLTJLQHXJII-MOPGFXCFSA-N 2 1 376.545 3.180 20 0 GGADMP C[C@H]1CCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000173351902 1426528492 /nfs/dbraw/zinc/52/84/92/1426528492.db2.gz HUQKEHJTLFBIST-ICSRJNTNSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@H]1CCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@H+]1Cc1ccccc1 ZINC000173351902 1426528499 /nfs/dbraw/zinc/52/84/99/1426528499.db2.gz HUQKEHJTLFBIST-ICSRJNTNSA-N 2 1 384.524 3.188 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccs2)CC1 ZINC000173402395 1426585502 /nfs/dbraw/zinc/58/55/02/1426585502.db2.gz FLJQJWAVCJWNCY-CEXWTWQISA-N 2 1 390.597 3.399 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)NCCCCn1cc[nH+]c1C)[NH+]1CCCC1 ZINC000173401785 1426585987 /nfs/dbraw/zinc/58/59/87/1426585987.db2.gz RAJPYCBYQVISAO-HXUWFJFHSA-N 2 1 399.539 3.117 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000173425641 1426607965 /nfs/dbraw/zinc/60/79/65/1426607965.db2.gz YEYMBYOQCOJFSL-NRFANRHFSA-N 2 1 383.540 3.135 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000173425641 1426607970 /nfs/dbraw/zinc/60/79/70/1426607970.db2.gz YEYMBYOQCOJFSL-NRFANRHFSA-N 2 1 383.540 3.135 20 0 GGADMP CCOc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)CCn1cc[nH+]c1C(C)C ZINC000173476039 1426650559 /nfs/dbraw/zinc/65/05/59/1426650559.db2.gz OUAJJEXOYPCGTB-UHFFFAOYSA-N 2 1 399.539 3.186 20 0 GGADMP COc1cc(NC(=O)CC[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(OC)cc1Cl ZINC000173494863 1426666516 /nfs/dbraw/zinc/66/65/16/1426666516.db2.gz QNRIYNHHRLVXEU-HNNXBMFYSA-N 2 1 395.931 3.104 20 0 GGADMP CC[C@@](C)([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1nccs1 ZINC000173500300 1426669454 /nfs/dbraw/zinc/66/94/54/1426669454.db2.gz FPUUTVDFVADOPE-OAQYLSRUSA-N 2 1 386.565 3.270 20 0 GGADMP C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)NC1CC[NH+](Cc3ccc(Cl)cc3)CC1)C2 ZINC000173558310 1426729572 /nfs/dbraw/zinc/72/95/72/1426729572.db2.gz UPVHKJNVCONNCT-VQTJNVASSA-N 2 1 390.959 3.183 20 0 GGADMP CSc1ccc(OCC[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)cc1 ZINC000173596756 1426762625 /nfs/dbraw/zinc/76/26/25/1426762625.db2.gz XMWASQRDIMFLGU-RTBURBONSA-N 2 1 377.598 3.278 20 0 GGADMP C(=C/C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1)\CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173602973 1426774271 /nfs/dbraw/zinc/77/42/71/1426774271.db2.gz IDIBDCILPUSWHZ-XMUPPXAMSA-N 3 1 388.644 3.158 20 0 GGADMP C(=C/C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1)\CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173602973 1426774288 /nfs/dbraw/zinc/77/42/88/1426774288.db2.gz IDIBDCILPUSWHZ-XMUPPXAMSA-N 3 1 388.644 3.158 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1 ZINC000173792891 1426852681 /nfs/dbraw/zinc/85/26/81/1426852681.db2.gz GPBZNZGYJKQCKR-OAHLLOKOSA-N 2 1 397.947 3.350 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CC[NH+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000173895413 1426883656 /nfs/dbraw/zinc/88/36/56/1426883656.db2.gz HOJWOZCGAZUHSP-IBGZPJMESA-N 2 1 383.540 3.091 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000173895413 1426883657 /nfs/dbraw/zinc/88/36/57/1426883657.db2.gz HOJWOZCGAZUHSP-IBGZPJMESA-N 2 1 383.540 3.091 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000173895413 1426883661 /nfs/dbraw/zinc/88/36/61/1426883661.db2.gz HOJWOZCGAZUHSP-IBGZPJMESA-N 2 1 383.540 3.091 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(Cc2ccc(CN3CC[C@H](C[N@H+](C)CC)C3)cc2)C1 ZINC000173921875 1426892738 /nfs/dbraw/zinc/89/27/38/1426892738.db2.gz HJADEWMYNFNGKX-DNQXCXABSA-N 2 1 386.628 3.234 20 0 GGADMP CCC[C@H](NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000173948872 1426905666 /nfs/dbraw/zinc/90/56/66/1426905666.db2.gz ANFJBBYFTDQVCH-QFIPXVFZSA-N 2 1 387.568 3.221 20 0 GGADMP CSc1cccc(NC(=O)[C@@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000173957573 1426909271 /nfs/dbraw/zinc/90/92/71/1426909271.db2.gz DSZRVWHBKUQBHA-QGZVFWFLSA-N 2 1 391.581 3.312 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CC[NH+](C2CC2)C1 ZINC000173959275 1426910073 /nfs/dbraw/zinc/91/00/73/1426910073.db2.gz DPWNARDASBYRPT-GOSISDBHSA-N 2 1 396.535 3.195 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CC[NH+](C2CC2)C1 ZINC000173959275 1426910076 /nfs/dbraw/zinc/91/00/76/1426910076.db2.gz DPWNARDASBYRPT-GOSISDBHSA-N 2 1 396.535 3.195 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000173959275 1426910077 /nfs/dbraw/zinc/91/00/77/1426910077.db2.gz DPWNARDASBYRPT-GOSISDBHSA-N 2 1 396.535 3.195 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000173959275 1426910080 /nfs/dbraw/zinc/91/00/80/1426910080.db2.gz DPWNARDASBYRPT-GOSISDBHSA-N 2 1 396.535 3.195 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1Cl ZINC000173961459 1426911606 /nfs/dbraw/zinc/91/16/06/1426911606.db2.gz MLNNSSHKIAMUQM-KRWDZBQOSA-N 2 1 393.959 3.094 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CC[NH+](C2CC2)C1 ZINC000173964254 1426912991 /nfs/dbraw/zinc/91/29/91/1426912991.db2.gz QYSWTEDGNFFEOF-SFTDATJTSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000173964254 1426912997 /nfs/dbraw/zinc/91/29/97/1426912997.db2.gz QYSWTEDGNFFEOF-SFTDATJTSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000173964254 1426913003 /nfs/dbraw/zinc/91/30/03/1426913003.db2.gz QYSWTEDGNFFEOF-SFTDATJTSA-N 2 1 384.568 3.024 20 0 GGADMP COc1ccc(NC(=O)CC[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000173976995 1426921894 /nfs/dbraw/zinc/92/18/94/1426921894.db2.gz FALRUHRPWHKSCY-HXUWFJFHSA-N 2 1 381.520 3.478 20 0 GGADMP COc1ccc(NC(=O)CC[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000173976995 1426921898 /nfs/dbraw/zinc/92/18/98/1426921898.db2.gz FALRUHRPWHKSCY-HXUWFJFHSA-N 2 1 381.520 3.478 20 0 GGADMP COc1ccc(NC(=O)CC[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000173976995 1426921901 /nfs/dbraw/zinc/92/19/01/1426921901.db2.gz FALRUHRPWHKSCY-HXUWFJFHSA-N 2 1 381.520 3.478 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1)C[NH+]1CCCC1 ZINC000174111214 1427006769 /nfs/dbraw/zinc/00/67/69/1427006769.db2.gz UOQTYPDVBUEPCO-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1)C[NH+]1CCCC1 ZINC000174111214 1427006775 /nfs/dbraw/zinc/00/67/75/1427006775.db2.gz UOQTYPDVBUEPCO-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP CN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174112321 1427007290 /nfs/dbraw/zinc/00/72/90/1427007290.db2.gz YKXCPFFCVVFDRJ-WOJBJXKFSA-N 2 1 384.524 3.188 20 0 GGADMP CN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174112321 1427007299 /nfs/dbraw/zinc/00/72/99/1427007299.db2.gz YKXCPFFCVVFDRJ-WOJBJXKFSA-N 2 1 384.524 3.188 20 0 GGADMP Cc1cc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)on1 ZINC000174156354 1427024903 /nfs/dbraw/zinc/02/49/03/1427024903.db2.gz JFTRPZJPUBVNJI-MRXNPFEDSA-N 2 1 382.464 3.325 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000174217672 1427055769 /nfs/dbraw/zinc/05/57/69/1427055769.db2.gz IFBKMLUDAIFCEG-RBUKOAKNSA-N 2 1 390.597 3.087 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174220461 1427057163 /nfs/dbraw/zinc/05/71/63/1427057163.db2.gz QTYZTGRXTOFXLX-GHTZIAJQSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174220461 1427057169 /nfs/dbraw/zinc/05/71/69/1427057169.db2.gz QTYZTGRXTOFXLX-GHTZIAJQSA-N 2 1 383.540 3.134 20 0 GGADMP O=C(C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)Nc1cccc2ccccc21 ZINC000174238147 1427064434 /nfs/dbraw/zinc/06/44/34/1427064434.db2.gz UQBGPWAHBGQTNP-UHFFFAOYSA-N 2 1 381.520 3.355 20 0 GGADMP c1ccc(-n2nc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)c3c2CCC3)cc1 ZINC000174239984 1427064976 /nfs/dbraw/zinc/06/49/76/1427064976.db2.gz RUEVLUPHJASKFF-UHFFFAOYSA-N 2 1 394.563 3.438 20 0 GGADMP CC(C)(C)c1ccc(NC(=O)C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000174240518 1427065151 /nfs/dbraw/zinc/06/51/51/1427065151.db2.gz PVMGVEXKSBOENP-UHFFFAOYSA-N 2 1 387.568 3.499 20 0 GGADMP Cc1ccc(NC(=O)C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1Cl ZINC000174241841 1427065733 /nfs/dbraw/zinc/06/57/33/1427065733.db2.gz FMENPEFJQBUJAM-UHFFFAOYSA-N 2 1 379.932 3.164 20 0 GGADMP Clc1ccc(-c2nnc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)o2)cc1 ZINC000174241264 1427065794 /nfs/dbraw/zinc/06/57/94/1427065794.db2.gz WVHMPYVJQCLQEN-UHFFFAOYSA-N 2 1 390.915 3.467 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174288572 1427086994 /nfs/dbraw/zinc/08/69/94/1427086994.db2.gz MOVRVSLKZRCDQF-OAQYLSRUSA-N 2 1 383.540 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174288572 1427086998 /nfs/dbraw/zinc/08/69/98/1427086998.db2.gz MOVRVSLKZRCDQF-OAQYLSRUSA-N 2 1 383.540 3.278 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)N[C@H](C)C[N@H+]3C[C@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000174313873 1427097290 /nfs/dbraw/zinc/09/72/90/1427097290.db2.gz AOFNKMAJGSYSOO-CEXWTWQISA-N 2 1 387.572 3.024 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)N[C@H](C)C[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000174313873 1427097295 /nfs/dbraw/zinc/09/72/95/1427097295.db2.gz AOFNKMAJGSYSOO-CEXWTWQISA-N 2 1 387.572 3.024 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)N[C@@H](C)C[N@H+]3C[C@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000174313858 1427097318 /nfs/dbraw/zinc/09/73/18/1427097318.db2.gz AOFNKMAJGSYSOO-OTWHNJEPSA-N 2 1 387.572 3.024 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)N[C@@H](C)C[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000174313858 1427097325 /nfs/dbraw/zinc/09/73/25/1427097325.db2.gz AOFNKMAJGSYSOO-OTWHNJEPSA-N 2 1 387.572 3.024 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000174345237 1427112010 /nfs/dbraw/zinc/11/20/10/1427112010.db2.gz DXWDFQQIKPBDGL-JOCHJYFZSA-N 2 1 386.584 3.414 20 0 GGADMP C[N@@H+](CCC(=O)Nc1ccc2c(c1)OCO2)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174400596 1427140030 /nfs/dbraw/zinc/14/00/30/1427140030.db2.gz XJIOVRWWIXCLCG-IBGZPJMESA-N 2 1 395.503 3.198 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc2c(c1)OCO2)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174400596 1427140034 /nfs/dbraw/zinc/14/00/34/1427140034.db2.gz XJIOVRWWIXCLCG-IBGZPJMESA-N 2 1 395.503 3.198 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc2c(c1)OCO2)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174400596 1427140036 /nfs/dbraw/zinc/14/00/36/1427140036.db2.gz XJIOVRWWIXCLCG-IBGZPJMESA-N 2 1 395.503 3.198 20 0 GGADMP C[N@@H+](CCC(=O)N1CCc2sccc2C1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174401404 1427140348 /nfs/dbraw/zinc/14/03/48/1427140348.db2.gz XRVLCCXOJXCFMJ-HXUWFJFHSA-N 2 1 397.588 3.477 20 0 GGADMP C[NH+](CCC(=O)N1CCc2sccc2C1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174401404 1427140356 /nfs/dbraw/zinc/14/03/56/1427140356.db2.gz XRVLCCXOJXCFMJ-HXUWFJFHSA-N 2 1 397.588 3.477 20 0 GGADMP C[NH+](CCC(=O)N1CCc2sccc2C1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174401404 1427140362 /nfs/dbraw/zinc/14/03/62/1427140362.db2.gz XRVLCCXOJXCFMJ-HXUWFJFHSA-N 2 1 397.588 3.477 20 0 GGADMP C[N@@H+](CCC(=O)N1CCc2sccc2C1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174401386 1427140622 /nfs/dbraw/zinc/14/06/22/1427140622.db2.gz XRVLCCXOJXCFMJ-FQEVSTJZSA-N 2 1 397.588 3.477 20 0 GGADMP C[NH+](CCC(=O)N1CCc2sccc2C1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174401386 1427140634 /nfs/dbraw/zinc/14/06/34/1427140634.db2.gz XRVLCCXOJXCFMJ-FQEVSTJZSA-N 2 1 397.588 3.477 20 0 GGADMP C[NH+](CCC(=O)N1CCc2sccc2C1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174401386 1427140641 /nfs/dbraw/zinc/14/06/41/1427140641.db2.gz XRVLCCXOJXCFMJ-FQEVSTJZSA-N 2 1 397.588 3.477 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000174455575 1427163538 /nfs/dbraw/zinc/16/35/38/1427163538.db2.gz KWOCVVQUDZGGAV-IBGZPJMESA-N 2 1 392.613 3.476 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000174455356 1427163820 /nfs/dbraw/zinc/16/38/20/1427163820.db2.gz SYIAUBJSGROVKA-IBGZPJMESA-N 2 1 392.613 3.333 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1oc(-c2ccccc2)nc1C ZINC000174458156 1427165371 /nfs/dbraw/zinc/16/53/71/1427165371.db2.gz ZFVDOFKHTPEHFW-LJQANCHMSA-N 2 1 384.524 3.138 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000174460124 1427165998 /nfs/dbraw/zinc/16/59/98/1427165998.db2.gz AONJKVFGYXACIR-OALUTQOASA-N 2 1 392.613 3.333 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000174460124 1427166007 /nfs/dbraw/zinc/16/60/07/1427166007.db2.gz AONJKVFGYXACIR-OALUTQOASA-N 2 1 392.613 3.333 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000174460124 1427166011 /nfs/dbraw/zinc/16/60/11/1427166011.db2.gz AONJKVFGYXACIR-OALUTQOASA-N 2 1 392.613 3.333 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000174485383 1427177029 /nfs/dbraw/zinc/17/70/29/1427177029.db2.gz RAAXCUOCKOKDEZ-QFIPXVFZSA-N 2 1 384.568 3.215 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000174496707 1427182472 /nfs/dbraw/zinc/18/24/72/1427182472.db2.gz LPCHPXIAXZDMBC-OALUTQOASA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CC[C@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC000174496707 1427182476 /nfs/dbraw/zinc/18/24/76/1427182476.db2.gz LPCHPXIAXZDMBC-OALUTQOASA-N 2 1 383.540 3.134 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000174525123 1427203750 /nfs/dbraw/zinc/20/37/50/1427203750.db2.gz WJJYFYGOTJDBTQ-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](CCC(=O)Nc3c(Cl)cccc3Cl)C2)CC1 ZINC000174545373 1427215857 /nfs/dbraw/zinc/21/58/57/1427215857.db2.gz OLCWNIBGKMITPH-HNNXBMFYSA-N 2 1 399.366 3.034 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@@H](c2ccc(C)o2)[NH+]2CCCC2)C1 ZINC000174568198 1427228541 /nfs/dbraw/zinc/22/85/41/1427228541.db2.gz HXFMMUOFAYEEQR-MOPGFXCFSA-N 2 1 376.545 3.098 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)[N@H+]4C)c2)CC1 ZINC000174680429 1427305934 /nfs/dbraw/zinc/30/59/34/1427305934.db2.gz SXJPZVXPVRMPKC-YADHBBJMSA-N 2 1 384.568 3.297 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](C(C)C)CC1 ZINC000174689435 1427310870 /nfs/dbraw/zinc/31/08/70/1427310870.db2.gz WMFFRIPTVICOCC-NRFANRHFSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)CC1 ZINC000174703599 1427319013 /nfs/dbraw/zinc/31/90/13/1427319013.db2.gz KGMLFQMAGZISTJ-UHFFFAOYSA-N 2 1 379.495 3.166 20 0 GGADMP Cc1cc2oc(=O)cc(C[N@@H+](C)CCCN3CC[NH+](C)CC3)c2cc1C(C)C ZINC000174713563 1427325257 /nfs/dbraw/zinc/32/52/57/1427325257.db2.gz QRSAWSFEWSOMPA-UHFFFAOYSA-N 2 1 385.552 3.294 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1-c1ccccc1)[N@@H+](C)CCCN1CC[NH+](C)CC1 ZINC000174715888 1427327461 /nfs/dbraw/zinc/32/74/61/1427327461.db2.gz SUXKLQJLQSXIFB-HXUWFJFHSA-N 2 1 394.563 3.250 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1cccc(C(=O)Nc2ccccc2)c1 ZINC000174729747 1427335362 /nfs/dbraw/zinc/33/53/62/1427335362.db2.gz WXQGQAIYLGIINB-UHFFFAOYSA-N 2 1 380.536 3.008 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NCC1CC[NH+](C)CC1 ZINC000174746515 1427345842 /nfs/dbraw/zinc/34/58/42/1427345842.db2.gz XVNYYQNYZVWMEE-UHFFFAOYSA-N 2 1 384.524 3.053 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NCC1CC[NH+](C)CC1 ZINC000174746515 1427345852 /nfs/dbraw/zinc/34/58/52/1427345852.db2.gz XVNYYQNYZVWMEE-UHFFFAOYSA-N 2 1 384.524 3.053 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000174790510 1427369670 /nfs/dbraw/zinc/36/96/70/1427369670.db2.gz FDDCBEWYBPFJKA-UHFFFAOYSA-N 2 1 396.535 3.338 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000174790510 1427369676 /nfs/dbraw/zinc/36/96/76/1427369676.db2.gz FDDCBEWYBPFJKA-UHFFFAOYSA-N 2 1 396.535 3.338 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000174803768 1427378406 /nfs/dbraw/zinc/37/84/06/1427378406.db2.gz PFHGHKRQAXGNAB-LJQANCHMSA-N 2 1 386.584 3.459 20 0 GGADMP CC(C)c1[nH+]ccn1CCC(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CCOCC1 ZINC000174850406 1427405690 /nfs/dbraw/zinc/40/56/90/1427405690.db2.gz PHOQIASSKZRNAE-IBGZPJMESA-N 2 1 398.551 3.413 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000174960150 1427467560 /nfs/dbraw/zinc/46/75/60/1427467560.db2.gz USFUKVLTOMXWEN-HXUWFJFHSA-N 2 1 397.567 3.481 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000174960150 1427467566 /nfs/dbraw/zinc/46/75/66/1427467566.db2.gz USFUKVLTOMXWEN-HXUWFJFHSA-N 2 1 397.567 3.481 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000174960150 1427467571 /nfs/dbraw/zinc/46/75/71/1427467571.db2.gz USFUKVLTOMXWEN-HXUWFJFHSA-N 2 1 397.567 3.481 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2ncsc2c1 ZINC000174963211 1427469098 /nfs/dbraw/zinc/46/90/98/1427469098.db2.gz UICGNDRDYATQJV-MRXNPFEDSA-N 2 1 375.542 3.176 20 0 GGADMP C[C@@H](C(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000174971592 1427473312 /nfs/dbraw/zinc/47/33/12/1427473312.db2.gz OLFHBNBCILOFGL-UNMCSNQZSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@@H](C(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000174971592 1427473318 /nfs/dbraw/zinc/47/33/18/1427473318.db2.gz OLFHBNBCILOFGL-UNMCSNQZSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@@H](C(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000174971592 1427473324 /nfs/dbraw/zinc/47/33/24/1427473324.db2.gz OLFHBNBCILOFGL-UNMCSNQZSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@@H](C(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000174971592 1427473330 /nfs/dbraw/zinc/47/33/30/1427473330.db2.gz OLFHBNBCILOFGL-UNMCSNQZSA-N 2 1 391.559 3.414 20 0 GGADMP CC[NH+](CC)CCN(CC(C)C)C(=O)NC1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000175276271 1427642368 /nfs/dbraw/zinc/64/23/68/1427642368.db2.gz MFPIWPYMQPKPDP-UHFFFAOYSA-N 2 1 389.588 3.368 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000175299772 1427658627 /nfs/dbraw/zinc/65/86/27/1427658627.db2.gz UYRGTACBESCWDI-RLLQIKCJSA-N 2 1 384.524 3.235 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@H+]1Cc1ccccc1 ZINC000175299772 1427658632 /nfs/dbraw/zinc/65/86/32/1427658632.db2.gz UYRGTACBESCWDI-RLLQIKCJSA-N 2 1 384.524 3.235 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC2CC[NH+](CCC(C)C)CC2)cn1 ZINC000175429413 1427749842 /nfs/dbraw/zinc/74/98/42/1427749842.db2.gz TVDAXSKBBLTPLJ-UHFFFAOYSA-N 2 1 398.555 3.133 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[NH+](CC2CC2)CC1 ZINC000175454432 1427763394 /nfs/dbraw/zinc/76/33/94/1427763394.db2.gz TZFQMEZEVCADOE-UHFFFAOYSA-N 2 1 396.535 3.149 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[NH+](CC2CC2)CC1 ZINC000175454432 1427763399 /nfs/dbraw/zinc/76/33/99/1427763399.db2.gz TZFQMEZEVCADOE-UHFFFAOYSA-N 2 1 396.535 3.149 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000175462720 1427768131 /nfs/dbraw/zinc/76/81/31/1427768131.db2.gz IBTXOMVAUZYQBM-FQEVSTJZSA-N 2 1 375.561 3.125 20 0 GGADMP Cc1nccn1C[C@@H](C)CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473713 1427773789 /nfs/dbraw/zinc/77/37/89/1427773789.db2.gz NYMWLGUDMUHPIF-UEXGIBASSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473713 1427773792 /nfs/dbraw/zinc/77/37/92/1427773792.db2.gz NYMWLGUDMUHPIF-UEXGIBASSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473713 1427773798 /nfs/dbraw/zinc/77/37/98/1427773798.db2.gz NYMWLGUDMUHPIF-UEXGIBASSA-N 2 1 383.540 3.180 20 0 GGADMP CC1CC[NH+](CCNC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)CC1 ZINC000175474956 1427774926 /nfs/dbraw/zinc/77/49/26/1427774926.db2.gz LCYKJCWGUUEZQP-UHFFFAOYSA-N 2 1 398.551 3.443 20 0 GGADMP CC1CC[NH+](CCNC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)CC1 ZINC000175474956 1427774936 /nfs/dbraw/zinc/77/49/36/1427774936.db2.gz LCYKJCWGUUEZQP-UHFFFAOYSA-N 2 1 398.551 3.443 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC[C@@H]2C[NH+]2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000175629389 1427837920 /nfs/dbraw/zinc/83/79/20/1427837920.db2.gz LAWZJARWWBXULQ-BAGYTPMASA-N 2 1 384.568 3.309 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000175632477 1427838273 /nfs/dbraw/zinc/83/82/73/1427838273.db2.gz STNZSXQEGHTJMS-FCEUIQTBSA-N 2 1 384.568 3.167 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(COC(C)C)cc1 ZINC000175634297 1427838729 /nfs/dbraw/zinc/83/87/29/1427838729.db2.gz SXAJUAGIMYUQSR-NRFANRHFSA-N 2 1 390.572 3.491 20 0 GGADMP O=C(NC1CC[NH+](C2CCCC2)CC1)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000175636668 1427839810 /nfs/dbraw/zinc/83/98/10/1427839810.db2.gz JFDNXYGTVJCDLU-NRFANRHFSA-N 2 1 384.568 3.357 20 0 GGADMP C[N@@H+](CCNC(=O)NC1CC[NH+](CC2CCCC2)CC1)Cc1ccc(F)cc1 ZINC000175692722 1427860491 /nfs/dbraw/zinc/86/04/91/1427860491.db2.gz CDZUFCYITPRXOI-UHFFFAOYSA-N 2 1 390.547 3.211 20 0 GGADMP O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000175766440 1427884507 /nfs/dbraw/zinc/88/45/07/1427884507.db2.gz XIBOZMKMZWSTIJ-QHCPKHFHSA-N 2 1 399.579 3.048 20 0 GGADMP O=C(C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000175766440 1427884509 /nfs/dbraw/zinc/88/45/09/1427884509.db2.gz XIBOZMKMZWSTIJ-QHCPKHFHSA-N 2 1 399.579 3.048 20 0 GGADMP CC[NH+](CC)[C@@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000175768851 1427886044 /nfs/dbraw/zinc/88/60/44/1427886044.db2.gz DQTMJLAOULTGPL-GOSISDBHSA-N 2 1 376.570 3.183 20 0 GGADMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1 ZINC000175863497 1427940107 /nfs/dbraw/zinc/94/01/07/1427940107.db2.gz JZRRDFRVAPAUKZ-OAQYLSRUSA-N 2 1 395.551 3.202 20 0 GGADMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000175863497 1427940110 /nfs/dbraw/zinc/94/01/10/1427940110.db2.gz JZRRDFRVAPAUKZ-OAQYLSRUSA-N 2 1 395.551 3.202 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)N[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000175869827 1427943035 /nfs/dbraw/zinc/94/30/35/1427943035.db2.gz GPJKNPYWWJTLCF-SFTDATJTSA-N 2 1 381.524 3.030 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000175869827 1427943039 /nfs/dbraw/zinc/94/30/39/1427943039.db2.gz GPJKNPYWWJTLCF-SFTDATJTSA-N 2 1 381.524 3.030 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000176015781 1428028511 /nfs/dbraw/zinc/02/85/11/1428028511.db2.gz HMQOTIMDUSEVBO-NRFANRHFSA-N 2 1 376.589 3.205 20 0 GGADMP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000176044471 1428046974 /nfs/dbraw/zinc/04/69/74/1428046974.db2.gz PGXHMZVIDYDFBQ-OKZBNKHCSA-N 2 1 378.586 3.132 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000176056416 1428055781 /nfs/dbraw/zinc/05/57/81/1428055781.db2.gz CJBOBUZZWDGMQH-SFHVURJKSA-N 2 1 383.540 3.134 20 0 GGADMP CC[NH+](CC)[C@@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000176129106 1428101971 /nfs/dbraw/zinc/10/19/71/1428101971.db2.gz UZJMZEBCIXYLID-QZTJIDSGSA-N 2 1 378.586 3.086 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000176139986 1428113362 /nfs/dbraw/zinc/11/33/62/1428113362.db2.gz ZMYITHFYAXNLRT-OAQYLSRUSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)cn1 ZINC000180176789 1429782573 /nfs/dbraw/zinc/78/25/73/1429782573.db2.gz WEWRNZPAHGWFPD-MSOLQXFVSA-N 2 1 385.512 3.359 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2C)cn1 ZINC000180176499 1429782659 /nfs/dbraw/zinc/78/26/59/1429782659.db2.gz OARXCHLZSTYINE-YJBOKZPZSA-N 2 1 385.512 3.311 20 0 GGADMP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1nc2ccc(Cl)cc2n1C ZINC000180210629 1429802790 /nfs/dbraw/zinc/80/27/90/1429802790.db2.gz QAQNAHUXAJAQPG-AWEZNQCLSA-N 2 1 387.915 3.413 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000180293578 1429827238 /nfs/dbraw/zinc/82/72/38/1429827238.db2.gz SBBXCTJRMCGYQC-QHCPKHFHSA-N 2 1 392.547 3.469 20 0 GGADMP C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180313225 1429833823 /nfs/dbraw/zinc/83/38/23/1429833823.db2.gz CQWCOOUQIHPWML-SFHVURJKSA-N 2 1 387.572 3.108 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000180376638 1429850453 /nfs/dbraw/zinc/85/04/53/1429850453.db2.gz NEGMDNJUTGVYRG-UHFFFAOYSA-N 2 1 398.555 3.315 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NCC3CCN(c4cc[nH+]cc4)CC3)CC2)[nH+]c1 ZINC000180555847 1429896799 /nfs/dbraw/zinc/89/67/99/1429896799.db2.gz GUTRKUBDTPLYOI-UHFFFAOYSA-N 2 1 393.535 3.034 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+](CCc3cccc(F)c3)C3CCCC3)cn2)CC1 ZINC000180597479 1429922314 /nfs/dbraw/zinc/92/23/14/1429922314.db2.gz IMXAEEFZCDZCHB-UHFFFAOYSA-N 2 1 397.542 3.355 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+](CCc3cccc(F)c3)C3CCCC3)cn2)CC1 ZINC000180597479 1429922318 /nfs/dbraw/zinc/92/23/18/1429922318.db2.gz IMXAEEFZCDZCHB-UHFFFAOYSA-N 2 1 397.542 3.355 20 0 GGADMP C[NH+](C)Cc1cccc(NC(=O)NCc2ccccc2C[N@H+]2CCC[C@H]2CO)c1 ZINC000180708426 1429990992 /nfs/dbraw/zinc/99/09/92/1429990992.db2.gz NFSYDHHQQQYBLI-QFIPXVFZSA-N 2 1 396.535 3.027 20 0 GGADMP O=C(NCCC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)C(F)(F)F ZINC000180723121 1430000970 /nfs/dbraw/zinc/00/09/70/1430000970.db2.gz YSSZNDGMILAXEO-ROUUACIJSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(NCCC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1)C(F)(F)F ZINC000180723121 1430000979 /nfs/dbraw/zinc/00/09/79/1430000979.db2.gz YSSZNDGMILAXEO-ROUUACIJSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(NCCC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1)C(F)(F)F ZINC000180723121 1430000988 /nfs/dbraw/zinc/00/09/88/1430000988.db2.gz YSSZNDGMILAXEO-ROUUACIJSA-N 2 1 383.458 3.042 20 0 GGADMP C[C@H](NCC1([NH+]2CCCCC2)CCOCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000180739150 1430009904 /nfs/dbraw/zinc/00/99/04/1430009904.db2.gz VTRHGOLCIIBOFF-FQEVSTJZSA-N 2 1 389.584 3.313 20 0 GGADMP C[C@@H](NCC1([NH+]2CCCCC2)CCOCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000180738988 1430009915 /nfs/dbraw/zinc/00/99/15/1430009915.db2.gz LVDCTXTUASHKDE-HXUWFJFHSA-N 2 1 389.584 3.313 20 0 GGADMP C[C@H](CC(=O)Nc1cccnc1Cl)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180739751 1430010584 /nfs/dbraw/zinc/01/05/84/1430010584.db2.gz DMYZBEPMVCDGMV-MRXNPFEDSA-N 2 1 394.947 3.077 20 0 GGADMP COc1cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000180783110 1430036836 /nfs/dbraw/zinc/03/68/36/1430036836.db2.gz FLOJCGBZOHSDIV-QUCCMNQESA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000180783110 1430036848 /nfs/dbraw/zinc/03/68/48/1430036848.db2.gz FLOJCGBZOHSDIV-QUCCMNQESA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000180783110 1430036858 /nfs/dbraw/zinc/03/68/58/1430036858.db2.gz FLOJCGBZOHSDIV-QUCCMNQESA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000180783110 1430036868 /nfs/dbraw/zinc/03/68/68/1430036868.db2.gz FLOJCGBZOHSDIV-QUCCMNQESA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(-c2noc(CCCCC[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)n2)ccc1O ZINC000180865355 1430076311 /nfs/dbraw/zinc/07/63/11/1430076311.db2.gz FBXKTNYYVGZLGL-NVXWUHKLSA-N 2 1 388.512 3.236 20 0 GGADMP CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180879830 1430085590 /nfs/dbraw/zinc/08/55/90/1430085590.db2.gz WENFADWJYNZQJL-MOPGFXCFSA-N 2 1 395.588 3.305 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cccnc1Cl ZINC000180975602 1430146931 /nfs/dbraw/zinc/14/69/31/1430146931.db2.gz PKNCQBKCARIPBX-INIZCTEOSA-N 2 1 386.927 3.411 20 0 GGADMP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000181244380 1430255394 /nfs/dbraw/zinc/25/53/94/1430255394.db2.gz PANKFJJSMHPECH-JOCHJYFZSA-N 2 1 380.536 3.449 20 0 GGADMP C[C@@H](NC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000181414421 1430291949 /nfs/dbraw/zinc/29/19/49/1430291949.db2.gz VIXWHEDKERUVPB-YSZBQJHXSA-N 2 1 389.584 3.046 20 0 GGADMP C[C@@H](NC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000181414025 1430292149 /nfs/dbraw/zinc/29/21/49/1430292149.db2.gz DTPOUCLTEWPRBV-LEOXJPRUSA-N 2 1 389.584 3.046 20 0 GGADMP COc1cc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc(OC)c1OC ZINC000181418001 1430293340 /nfs/dbraw/zinc/29/33/40/1430293340.db2.gz SGDUUIYRVZSBCZ-IPELMVKDSA-N 2 1 392.540 3.131 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@@H]21 ZINC000181431379 1430297186 /nfs/dbraw/zinc/29/71/86/1430297186.db2.gz NMIIGCHMYOJYOV-NQIIRXRSSA-N 2 1 383.536 3.259 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@@H]21 ZINC000181431379 1430297190 /nfs/dbraw/zinc/29/71/90/1430297190.db2.gz NMIIGCHMYOJYOV-NQIIRXRSSA-N 2 1 383.536 3.259 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@@H]21 ZINC000181431379 1430297193 /nfs/dbraw/zinc/29/71/93/1430297193.db2.gz NMIIGCHMYOJYOV-NQIIRXRSSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCN(C)S(=O)(=O)c3cccs3)CC2)C1 ZINC000181504747 1430312048 /nfs/dbraw/zinc/31/20/48/1430312048.db2.gz DQVNCFKSEUOHGP-FUHWJXTLSA-N 2 1 399.626 3.001 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000181518901 1430314154 /nfs/dbraw/zinc/31/41/54/1430314154.db2.gz QBPCILDHEGQLQQ-ROUUACIJSA-N 2 1 391.556 3.379 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000181576555 1430322582 /nfs/dbraw/zinc/32/25/82/1430322582.db2.gz LSMPXYZXVDKJLW-FRQCXROJSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000181576555 1430322585 /nfs/dbraw/zinc/32/25/85/1430322585.db2.gz LSMPXYZXVDKJLW-FRQCXROJSA-N 2 1 387.474 3.395 20 0 GGADMP O=C1C[C@@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000181821628 1430367147 /nfs/dbraw/zinc/36/71/47/1430367147.db2.gz LENWHZNUDNSDNS-QHCPKHFHSA-N 2 1 391.559 3.332 20 0 GGADMP O[C@@H](COc1ccccc1C(F)(F)F)C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000181901907 1430380464 /nfs/dbraw/zinc/38/04/64/1430380464.db2.gz AHLOPNYKQQTXBF-DLBZAZTESA-N 2 1 386.458 3.395 20 0 GGADMP O[C@@H](COc1ccccc1C(F)(F)F)C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000181901907 1430380467 /nfs/dbraw/zinc/38/04/67/1430380467.db2.gz AHLOPNYKQQTXBF-DLBZAZTESA-N 2 1 386.458 3.395 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCC[C@@H](Cc2nccn2C)C1)C1CC[NH+](C)CC1 ZINC000182088994 1430409841 /nfs/dbraw/zinc/40/98/41/1430409841.db2.gz UIVDXCACFURKDC-FQEVSTJZSA-N 2 1 395.595 3.405 20 0 GGADMP C[C@H](CCNC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCCCC1 ZINC000182243349 1430435801 /nfs/dbraw/zinc/43/58/01/1430435801.db2.gz ZCHOCRMCZGJAJS-AQNXPRMDSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@H](CCNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCCCC1 ZINC000182243349 1430435806 /nfs/dbraw/zinc/43/58/06/1430435806.db2.gz ZCHOCRMCZGJAJS-AQNXPRMDSA-N 2 1 387.568 3.290 20 0 GGADMP CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)cc1 ZINC000182242882 1430435863 /nfs/dbraw/zinc/43/58/63/1430435863.db2.gz SKJFNDSGNOFIDQ-GAJHUEQPSA-N 2 1 381.520 3.453 20 0 GGADMP Cc1cc2ncc([C@H](C)[NH2+]Cc3ccccc3C[N@H+]3CCC[C@@H]3CO)c(C)n2n1 ZINC000182244582 1430436217 /nfs/dbraw/zinc/43/62/17/1430436217.db2.gz YJXJGXLQASWXJB-LAUBAEHRSA-N 2 1 393.535 3.154 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc2c(c1)OCCO2 ZINC000182247137 1430436567 /nfs/dbraw/zinc/43/65/67/1430436567.db2.gz UVYNAUBBVGZJNP-DYESRHJHSA-N 2 1 382.504 3.265 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000182255440 1430438003 /nfs/dbraw/zinc/43/80/03/1430438003.db2.gz ZFMKMLBDZIHRQH-FGZHOGPDSA-N 2 1 384.568 3.298 20 0 GGADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc2c(c1)OCCO2 ZINC000182259085 1430438710 /nfs/dbraw/zinc/43/87/10/1430438710.db2.gz RNVLDLPOAWARMS-LEWJYISDSA-N 2 1 382.504 3.265 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cccc(N2CCOC2=O)c1 ZINC000182272002 1430440742 /nfs/dbraw/zinc/44/07/42/1430440742.db2.gz KULAYPASGQARJV-VGSWGCGISA-N 2 1 395.503 3.061 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc2c(c1)OCCCO2 ZINC000182272413 1430440774 /nfs/dbraw/zinc/44/07/74/1430440774.db2.gz BNJZKCNXLAWCRQ-UWJYYQICSA-N 2 1 382.504 3.265 20 0 GGADMP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)CCCO2 ZINC000182273095 1430441258 /nfs/dbraw/zinc/44/12/58/1430441258.db2.gz BBXPEYAVORSISE-SIKLNZKXSA-N 2 1 382.504 3.265 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)CC1 ZINC000182302317 1430445164 /nfs/dbraw/zinc/44/51/64/1430445164.db2.gz SGUIEGBXNZQKMC-UNMCSNQZSA-N 2 1 384.568 3.085 20 0 GGADMP C[C@@H](NC(=O)NCCC[N@@H+](C)Cc1ccccc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182376142 1430455419 /nfs/dbraw/zinc/45/54/19/1430455419.db2.gz AYSAREHKFUXIAH-TZIWHRDSSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+](C)Cc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182376142 1430455422 /nfs/dbraw/zinc/45/54/22/1430455422.db2.gz AYSAREHKFUXIAH-TZIWHRDSSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+](C)Cc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182376142 1430455423 /nfs/dbraw/zinc/45/54/23/1430455423.db2.gz AYSAREHKFUXIAH-TZIWHRDSSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@@H](NC(=O)NCCC[N@@H+](C)Cc1ccccc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182376184 1430455472 /nfs/dbraw/zinc/45/54/72/1430455472.db2.gz AYSAREHKFUXIAH-CTNGQTDRSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+](C)Cc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182376184 1430455476 /nfs/dbraw/zinc/45/54/76/1430455476.db2.gz AYSAREHKFUXIAH-CTNGQTDRSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+](C)Cc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182376184 1430455478 /nfs/dbraw/zinc/45/54/78/1430455478.db2.gz AYSAREHKFUXIAH-CTNGQTDRSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@H](NC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182409034 1430462320 /nfs/dbraw/zinc/46/23/20/1430462320.db2.gz IAAHUWHAGNLQBV-HSALFYBXSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@H](NC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182409034 1430462321 /nfs/dbraw/zinc/46/23/21/1430462321.db2.gz IAAHUWHAGNLQBV-HSALFYBXSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@H](NC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182409034 1430462322 /nfs/dbraw/zinc/46/23/22/1430462322.db2.gz IAAHUWHAGNLQBV-HSALFYBXSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCCC[C@@H]3S(C)(=O)=O)cc2)C1 ZINC000182430186 1430466369 /nfs/dbraw/zinc/46/63/69/1430466369.db2.gz LBKBJDCSOYJVDL-UIFIKXQLSA-N 2 1 378.582 3.364 20 0 GGADMP CC[C@H]([NH2+]CC(=O)N1CCC[N@H+](Cc2ccc(C)cc2)CC1)c1c(C)noc1C ZINC000182449446 1430469532 /nfs/dbraw/zinc/46/95/32/1430469532.db2.gz RINCNIJPNMVZLV-NRFANRHFSA-N 2 1 398.551 3.375 20 0 GGADMP CC[C@H]([NH2+]CC(=O)N1CCC[N@@H+](Cc2ccc(C)cc2)CC1)c1c(C)noc1C ZINC000182449446 1430469534 /nfs/dbraw/zinc/46/95/34/1430469534.db2.gz RINCNIJPNMVZLV-NRFANRHFSA-N 2 1 398.551 3.375 20 0 GGADMP C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000182471968 1430473556 /nfs/dbraw/zinc/47/35/56/1430473556.db2.gz ASJKDXKRYWIISZ-YADHBBJMSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccc(F)cc1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182546800 1430487993 /nfs/dbraw/zinc/48/79/93/1430487993.db2.gz PORBOAVREVCTPW-MDKPJZGXSA-N 2 1 390.547 3.381 20 0 GGADMP O=C(NC1CC[NH+](Cc2cccnc2)CC1)[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000182630752 1430505788 /nfs/dbraw/zinc/50/57/88/1430505788.db2.gz CJJIAWSQBKJLNQ-HSZRJFAPSA-N 2 1 392.547 3.217 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182678906 1430515987 /nfs/dbraw/zinc/51/59/87/1430515987.db2.gz JUXWGAOLWHMVRL-DFQSSKMNSA-N 2 1 376.589 3.203 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[NH+](CC2CCCC2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182678906 1430515990 /nfs/dbraw/zinc/51/59/90/1430515990.db2.gz JUXWGAOLWHMVRL-DFQSSKMNSA-N 2 1 376.589 3.203 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[NH+](CC2CCCC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182678906 1430515992 /nfs/dbraw/zinc/51/59/92/1430515992.db2.gz JUXWGAOLWHMVRL-DFQSSKMNSA-N 2 1 376.589 3.203 20 0 GGADMP C[C@@H](NC(=O)NCC[N@@H+](C)Cc1ccc(F)cc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182689878 1430518051 /nfs/dbraw/zinc/51/80/51/1430518051.db2.gz GIRVAHAKTUDLJP-MJGOQNOKSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@@H](NC(=O)NCC[NH+](C)Cc1ccc(F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182689878 1430518052 /nfs/dbraw/zinc/51/80/52/1430518052.db2.gz GIRVAHAKTUDLJP-MJGOQNOKSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@@H](NC(=O)NCC[NH+](C)Cc1ccc(F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182689878 1430518054 /nfs/dbraw/zinc/51/80/54/1430518054.db2.gz GIRVAHAKTUDLJP-MJGOQNOKSA-N 2 1 390.547 3.210 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2sccc2C(N)=O)CC1 ZINC000182758468 1430534878 /nfs/dbraw/zinc/53/48/78/1430534878.db2.gz SOKVOFCSFBLOIY-HNNXBMFYSA-N 2 1 394.585 3.008 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](CCCc3cccc(F)c3)CC2)CC1 ZINC000182773199 1430537376 /nfs/dbraw/zinc/53/73/76/1430537376.db2.gz RJPVAAVBKWKIFI-UHFFFAOYSA-N 2 1 375.532 3.025 20 0 GGADMP C[C@@H](NC(=O)NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182777873 1430538045 /nfs/dbraw/zinc/53/80/45/1430538045.db2.gz WCTDINLBYCMRQT-QUCCMNQESA-N 2 1 399.583 3.250 20 0 GGADMP C[C@H](NC(=O)NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182777854 1430538256 /nfs/dbraw/zinc/53/82/56/1430538256.db2.gz WCTDINLBYCMRQT-ICSRJNTNSA-N 2 1 399.583 3.250 20 0 GGADMP CC[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1nccn1C ZINC000182796765 1430541716 /nfs/dbraw/zinc/54/17/16/1430541716.db2.gz NTPFOXALBYOSKH-OAQYLSRUSA-N 2 1 386.540 3.151 20 0 GGADMP CC[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1nccn1C ZINC000182796765 1430541723 /nfs/dbraw/zinc/54/17/23/1430541723.db2.gz NTPFOXALBYOSKH-OAQYLSRUSA-N 2 1 386.540 3.151 20 0 GGADMP C[NH+]1CCN(C(=O)CC[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000182819007 1430546438 /nfs/dbraw/zinc/54/64/38/1430546438.db2.gz OHIWVJQXQRVTAB-QGZVFWFLSA-N 2 1 383.508 3.132 20 0 GGADMP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCCC[C@H]3S(C)(=O)=O)c2)CC1 ZINC000182841125 1430551358 /nfs/dbraw/zinc/55/13/58/1430551358.db2.gz MBWFIKPUKMCEJN-LEWJYISDSA-N 2 1 378.582 3.364 20 0 GGADMP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCCC[C@H]3S(C)(=O)=O)c2)CC1 ZINC000182841108 1430551453 /nfs/dbraw/zinc/55/14/53/1430551453.db2.gz MBWFIKPUKMCEJN-NHCUHLMSSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@H](NC(=O)N1CCN(CCc2ccccc2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182885654 1430561569 /nfs/dbraw/zinc/56/15/69/1430561569.db2.gz UIEITMHVEBIDLU-UNMCSNQZSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](CCc2ccccc2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182885654 1430561574 /nfs/dbraw/zinc/56/15/74/1430561574.db2.gz UIEITMHVEBIDLU-UNMCSNQZSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](CCc2ccccc2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182885654 1430561585 /nfs/dbraw/zinc/56/15/85/1430561585.db2.gz UIEITMHVEBIDLU-UNMCSNQZSA-N 2 1 398.595 3.209 20 0 GGADMP CS(=O)(=O)[C@@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000182884773 1430561901 /nfs/dbraw/zinc/56/19/01/1430561901.db2.gz ROIHWAOJMNLHLO-WOJBJXKFSA-N 2 1 399.000 3.497 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1cccs1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182914049 1430570038 /nfs/dbraw/zinc/57/00/38/1430570038.db2.gz TUBUGNKQHRJHOS-MSOLQXFVSA-N 2 1 392.613 3.474 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)CC(=O)N(C1CCCCC1)C1CCCCC1 ZINC000182967575 1430582127 /nfs/dbraw/zinc/58/21/27/1430582127.db2.gz NEVKJZWETUNBTH-UHFFFAOYSA-N 2 1 392.632 3.050 20 0 GGADMP CC[NH+](CC)Cc1cc([C@@H](C)NCC2([NH+](C)C)CCOCC2)ccc1OC ZINC000182967504 1430582307 /nfs/dbraw/zinc/58/23/07/1430582307.db2.gz IEIWQMZOWMIHIT-GOSISDBHSA-N 2 1 377.573 3.298 20 0 GGADMP COc1c(C)c[nH+]c(CN2CCC([N@H+](C)Cc3ccc(CO)cc3)CC2)c1C ZINC000182997845 1430588866 /nfs/dbraw/zinc/58/88/66/1430588866.db2.gz HWPQXTORSCEXSG-UHFFFAOYSA-N 2 1 383.536 3.296 20 0 GGADMP COc1c(C)c[nH+]c(CN2CCC([N@@H+](C)Cc3ccc(CO)cc3)CC2)c1C ZINC000182997845 1430588867 /nfs/dbraw/zinc/58/88/67/1430588867.db2.gz HWPQXTORSCEXSG-UHFFFAOYSA-N 2 1 383.536 3.296 20 0 GGADMP COC[C@@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccc(F)c(F)c1 ZINC000183082496 1430608669 /nfs/dbraw/zinc/60/86/69/1430608669.db2.gz SAUMCAWSNVVKOO-LJQANCHMSA-N 2 1 376.451 3.318 20 0 GGADMP COCCC[NH+]1CCC(N[C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183135906 1430625557 /nfs/dbraw/zinc/62/55/57/1430625557.db2.gz FZZGPPMUTWQUDF-OEMFJLHTSA-N 2 1 385.596 3.378 20 0 GGADMP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183135906 1430625565 /nfs/dbraw/zinc/62/55/65/1430625565.db2.gz FZZGPPMUTWQUDF-OEMFJLHTSA-N 3 1 385.596 3.378 20 0 GGADMP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183135906 1430625574 /nfs/dbraw/zinc/62/55/74/1430625574.db2.gz FZZGPPMUTWQUDF-OEMFJLHTSA-N 3 1 385.596 3.378 20 0 GGADMP CS(=O)(=O)C1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183152947 1430630883 /nfs/dbraw/zinc/63/08/83/1430630883.db2.gz VYSNOKXFUBBUGS-VQSBLYBRSA-N 2 1 390.593 3.233 20 0 GGADMP CS(=O)(=O)C1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183152947 1430630888 /nfs/dbraw/zinc/63/08/88/1430630888.db2.gz VYSNOKXFUBBUGS-VQSBLYBRSA-N 2 1 390.593 3.233 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cccc(S(=O)(=O)N(C)C)c2)cc1 ZINC000183154829 1430631367 /nfs/dbraw/zinc/63/13/67/1430631367.db2.gz MHGULTKVOGRNIU-INIZCTEOSA-N 2 1 398.532 3.282 20 0 GGADMP COc1cccc([C@@H]2[C@@H](NC(=O)CCn3cc[nH+]c3C(C)C)CC[N@@H+]2C2CC2)c1 ZINC000183272253 1430666588 /nfs/dbraw/zinc/66/65/88/1430666588.db2.gz NHLRHASPOUHLII-RBBKRZOGSA-N 2 1 396.535 3.499 20 0 GGADMP COc1cccc([C@@H]2[C@@H](NC(=O)CCn3cc[nH+]c3C(C)C)CC[N@H+]2C2CC2)c1 ZINC000183272253 1430666595 /nfs/dbraw/zinc/66/65/95/1430666595.db2.gz NHLRHASPOUHLII-RBBKRZOGSA-N 2 1 396.535 3.499 20 0 GGADMP CC(C)OCC[NH+]1CCC([NH2+][C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)CC1 ZINC000183543199 1430738786 /nfs/dbraw/zinc/73/87/86/1430738786.db2.gz IHAGSOVXTUBDET-GOSISDBHSA-N 2 1 383.577 3.255 20 0 GGADMP COc1ccccc1CCNC(=O)C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000183685933 1430772686 /nfs/dbraw/zinc/77/26/86/1430772686.db2.gz HVPFJOOHBWFUIN-KRWDZBQOSA-N 2 1 392.503 3.199 20 0 GGADMP C[C@H](CC[NH2+][C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)[NH+]1CCCCC1 ZINC000184502496 1430895917 /nfs/dbraw/zinc/89/59/17/1430895917.db2.gz LVCCRPWOVWLTII-MSOLQXFVSA-N 2 1 379.570 3.142 20 0 GGADMP CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000184553410 1430903309 /nfs/dbraw/zinc/90/33/09/1430903309.db2.gz LNGRUKOGRFAZFZ-JOCHJYFZSA-N 2 1 386.584 3.317 20 0 GGADMP CC1(C(=O)NCC[N@H+]2CCc3ccccc3C2)CC[NH+](Cc2ccccc2)CC1 ZINC000184636399 1430925775 /nfs/dbraw/zinc/92/57/75/1430925775.db2.gz BYKDYZMVVYRDNJ-UHFFFAOYSA-N 2 1 391.559 3.463 20 0 GGADMP O=C1C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)CN1Cc1ccccc1C(F)(F)F ZINC000184670706 1430937518 /nfs/dbraw/zinc/93/75/18/1430937518.db2.gz YKSNBGJCLBUYRV-IXDOHACOSA-N 2 1 381.442 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000184742500 1430961506 /nfs/dbraw/zinc/96/15/06/1430961506.db2.gz WAJBUVMERHRDNB-QZTJIDSGSA-N 2 1 397.588 3.379 20 0 GGADMP Cc1ccsc1CNC(=O)C[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000184747315 1430963780 /nfs/dbraw/zinc/96/37/80/1430963780.db2.gz WDRPKXAZABQPKV-QZTJIDSGSA-N 2 1 385.577 3.419 20 0 GGADMP COc1cccc(CNC(=O)C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000184747102 1430963795 /nfs/dbraw/zinc/96/37/95/1430963795.db2.gz JMELCSHWYJKMND-OALUTQOASA-N 2 1 395.547 3.058 20 0 GGADMP Cc1cccc(CNC(=O)C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000184752906 1430966015 /nfs/dbraw/zinc/96/60/15/1430966015.db2.gz NKUHECCRIWCFDE-WOJBJXKFSA-N 2 1 379.548 3.357 20 0 GGADMP Cc1csc2nc(C[NH2+]C3[C@H](C)C[N@@H+](Cc4ccccc4)C[C@@H]3C)cc(=O)n12 ZINC000184753212 1430966873 /nfs/dbraw/zinc/96/68/73/1430966873.db2.gz VYQRVXYXUNMJPK-GWTOYCKXSA-N 2 1 396.560 3.311 20 0 GGADMP Cc1csc2nc(C[NH2+]C3[C@H](C)C[N@H+](Cc4ccccc4)C[C@@H]3C)cc(=O)n12 ZINC000184753212 1430966879 /nfs/dbraw/zinc/96/68/79/1430966879.db2.gz VYQRVXYXUNMJPK-GWTOYCKXSA-N 2 1 396.560 3.311 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2cccc(N3CC[NH+](CC)CC3)c2)C1 ZINC000184901408 1431017086 /nfs/dbraw/zinc/01/70/86/1431017086.db2.gz ARBKMRRWHHTGQO-IBGZPJMESA-N 2 1 387.572 3.024 20 0 GGADMP CC[NH+]1CCN(c2cccc(NC(=O)N[C@@H]3CC[N@@H+](CC4CCCC4)C3)c2)CC1 ZINC000184921253 1431021942 /nfs/dbraw/zinc/02/19/42/1431021942.db2.gz XFMUKDRCZJLAOF-OAQYLSRUSA-N 2 1 399.583 3.215 20 0 GGADMP CC[NH+]1CCN(c2cccc(NC(=O)NCC[N@@H+](C)Cc3ccccc3)c2)CC1 ZINC000184923706 1431022402 /nfs/dbraw/zinc/02/24/02/1431022402.db2.gz OCFSSZLJAJZZLC-UHFFFAOYSA-N 2 1 395.551 3.082 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC[C@@H](C)[NH+]2CCCCC2)cc1F ZINC000184960281 1431031330 /nfs/dbraw/zinc/03/13/30/1431031330.db2.gz QXBLWVNVDFINIX-MRXNPFEDSA-N 2 1 387.503 3.384 20 0 GGADMP Cc1nc2c(s1)[C@@H]([N@@H+](C)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)CCC2 ZINC000184984661 1431036351 /nfs/dbraw/zinc/03/63/51/1431036351.db2.gz NFBBDXLDYFPIFX-OALUTQOASA-N 2 1 386.565 3.180 20 0 GGADMP Cc1nc2c(s1)[C@@H]([N@H+](C)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)CCC2 ZINC000184984661 1431036354 /nfs/dbraw/zinc/03/63/54/1431036354.db2.gz NFBBDXLDYFPIFX-OALUTQOASA-N 2 1 386.565 3.180 20 0 GGADMP Cc1cccc(NC2CC[NH+](CC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)CC2)c1 ZINC000184987070 1431036757 /nfs/dbraw/zinc/03/67/57/1431036757.db2.gz NFVVSKUKQHPKDI-QHCPKHFHSA-N 2 1 394.563 3.290 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000185136374 1431070033 /nfs/dbraw/zinc/07/00/33/1431070033.db2.gz HOXHTAKZVZQFED-LJQANCHMSA-N 2 1 378.948 3.213 20 0 GGADMP CC[C@@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1cc(Br)ccc1O ZINC000185210487 1431085607 /nfs/dbraw/zinc/08/56/07/1431085607.db2.gz QVMRJEKZDIYCHS-QGZVFWFLSA-N 2 1 384.362 3.223 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000185309799 1431109321 /nfs/dbraw/zinc/10/93/21/1431109321.db2.gz AGOVUPLAEOIOGX-DYESRHJHSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000185309799 1431109322 /nfs/dbraw/zinc/10/93/22/1431109322.db2.gz AGOVUPLAEOIOGX-DYESRHJHSA-N 2 1 383.540 3.037 20 0 GGADMP O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1Cl ZINC000185322104 1431113390 /nfs/dbraw/zinc/11/33/90/1431113390.db2.gz XTJLOLGGTHXZRS-SFHVURJKSA-N 2 1 389.883 3.495 20 0 GGADMP COc1ccc(C[C@@H](C)C[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1F ZINC000185322149 1431113662 /nfs/dbraw/zinc/11/36/62/1431113662.db2.gz VKMHNCGGWSUGEH-UTKZUKDTSA-N 2 1 386.511 3.369 20 0 GGADMP O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1Cl ZINC000185322178 1431113888 /nfs/dbraw/zinc/11/38/88/1431113888.db2.gz YWCWNPYUSFMYID-KRWDZBQOSA-N 2 1 375.856 3.105 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC2(C[NH+](C)C)CCCC2)cc1F ZINC000185549567 1431169090 /nfs/dbraw/zinc/16/90/90/1431169090.db2.gz OSNIMJPZORNXLL-UHFFFAOYSA-N 2 1 387.503 3.241 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCc1ccc(Cl)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185659989 1431198806 /nfs/dbraw/zinc/19/88/06/1431198806.db2.gz RYZHOOUNSQYIDE-FUHWJXTLSA-N 2 1 377.960 3.241 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185659989 1431198811 /nfs/dbraw/zinc/19/88/11/1431198811.db2.gz RYZHOOUNSQYIDE-FUHWJXTLSA-N 2 1 377.960 3.241 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCOc1cccc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185682405 1431204367 /nfs/dbraw/zinc/20/43/67/1431204367.db2.gz GTXVUOJOOBDEIG-DLBZAZTESA-N 2 1 393.959 3.078 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCOc1cccc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185682405 1431204371 /nfs/dbraw/zinc/20/43/71/1431204371.db2.gz GTXVUOJOOBDEIG-DLBZAZTESA-N 2 1 393.959 3.078 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCOc1cccc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185682456 1431204927 /nfs/dbraw/zinc/20/49/27/1431204927.db2.gz GTXVUOJOOBDEIG-SJORKVTESA-N 2 1 393.959 3.078 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCOc1cccc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185682456 1431204930 /nfs/dbraw/zinc/20/49/30/1431204930.db2.gz GTXVUOJOOBDEIG-SJORKVTESA-N 2 1 393.959 3.078 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCCOC1CCCCC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185695365 1431208321 /nfs/dbraw/zinc/20/83/21/1431208321.db2.gz UYAYURCVIZQZCA-MOPGFXCFSA-N 2 1 379.589 3.085 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCCOC1CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185695365 1431208324 /nfs/dbraw/zinc/20/83/24/1431208324.db2.gz UYAYURCVIZQZCA-MOPGFXCFSA-N 2 1 379.589 3.085 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185708013 1431211596 /nfs/dbraw/zinc/21/15/96/1431211596.db2.gz JYMAOUBJDQBADV-DOTOQJQBSA-N 2 1 395.494 3.147 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185708013 1431211599 /nfs/dbraw/zinc/21/15/99/1431211599.db2.gz JYMAOUBJDQBADV-DOTOQJQBSA-N 2 1 395.494 3.147 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185708031 1431211782 /nfs/dbraw/zinc/21/17/82/1431211782.db2.gz JYMAOUBJDQBADV-NVXWUHKLSA-N 2 1 395.494 3.147 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185708031 1431211789 /nfs/dbraw/zinc/21/17/89/1431211789.db2.gz JYMAOUBJDQBADV-NVXWUHKLSA-N 2 1 395.494 3.147 20 0 GGADMP CCCOc1ccc(CNC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185712007 1431213058 /nfs/dbraw/zinc/21/30/58/1431213058.db2.gz CDDGVDPAYANFPC-UYAOXDASSA-N 2 1 387.568 3.334 20 0 GGADMP CCCOc1ccc(CNC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185712007 1431213063 /nfs/dbraw/zinc/21/30/63/1431213063.db2.gz CDDGVDPAYANFPC-UYAOXDASSA-N 2 1 387.568 3.334 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)Nc1ccccc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185714820 1431213742 /nfs/dbraw/zinc/21/37/42/1431213742.db2.gz YWYKCGSAUVKCDK-PMPSAXMXSA-N 2 1 390.503 3.105 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)Nc1ccccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185714820 1431213748 /nfs/dbraw/zinc/21/37/48/1431213748.db2.gz YWYKCGSAUVKCDK-PMPSAXMXSA-N 2 1 390.503 3.105 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C(=O)NC(=O)Nc1ccccc1F ZINC000185714769 1431213960 /nfs/dbraw/zinc/21/39/60/1431213960.db2.gz YWYKCGSAUVKCDK-HRCADAONSA-N 2 1 390.503 3.105 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C(=O)NC(=O)Nc1ccccc1F ZINC000185714769 1431213962 /nfs/dbraw/zinc/21/39/62/1431213962.db2.gz YWYKCGSAUVKCDK-HRCADAONSA-N 2 1 390.503 3.105 20 0 GGADMP C[C@H]([NH2+]CCCOc1ccc(S(C)(=O)=O)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185723991 1431216055 /nfs/dbraw/zinc/21/60/55/1431216055.db2.gz CBFYSAHZDCWYIS-ZWKOTPCHSA-N 2 1 394.581 3.102 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC000185742042 1431220596 /nfs/dbraw/zinc/22/05/96/1431220596.db2.gz UAUPUEWCEGAJFU-ZWKOTPCHSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC000185742042 1431220601 /nfs/dbraw/zinc/22/06/01/1431220601.db2.gz UAUPUEWCEGAJFU-ZWKOTPCHSA-N 2 1 386.540 3.194 20 0 GGADMP COc1ccc(CN(C(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)C2CC2)cc1 ZINC000185745613 1431222118 /nfs/dbraw/zinc/22/21/18/1431222118.db2.gz ALLDBANTJVAVIS-QUCCMNQESA-N 2 1 399.579 3.429 20 0 GGADMP COc1ccc(CN(C(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C2CC2)cc1 ZINC000185745613 1431222125 /nfs/dbraw/zinc/22/21/25/1431222125.db2.gz ALLDBANTJVAVIS-QUCCMNQESA-N 2 1 399.579 3.429 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000185748063 1431222789 /nfs/dbraw/zinc/22/27/89/1431222789.db2.gz GQCLEYNUFOQIKX-RYLXDESZSA-N 2 1 385.552 3.258 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000185748063 1431222798 /nfs/dbraw/zinc/22/27/98/1431222798.db2.gz GQCLEYNUFOQIKX-RYLXDESZSA-N 2 1 385.552 3.258 20 0 GGADMP Cc1cccc(OCCCNC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185750463 1431223995 /nfs/dbraw/zinc/22/39/95/1431223995.db2.gz RHUWLWCFOPFLQY-VQTJNVASSA-N 2 1 387.568 3.123 20 0 GGADMP Cc1cccc(OCCCNC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185750463 1431223997 /nfs/dbraw/zinc/22/39/97/1431223997.db2.gz RHUWLWCFOPFLQY-VQTJNVASSA-N 2 1 387.568 3.123 20 0 GGADMP C[C@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1=O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185751215 1431224018 /nfs/dbraw/zinc/22/40/18/1431224018.db2.gz AKTBESUJJIIVGS-QMTMVMCOSA-N 2 1 377.479 3.313 20 0 GGADMP C[C@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1=O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185751215 1431224024 /nfs/dbraw/zinc/22/40/24/1431224024.db2.gz AKTBESUJJIIVGS-QMTMVMCOSA-N 2 1 377.479 3.313 20 0 GGADMP C[C@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1=O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185751255 1431224711 /nfs/dbraw/zinc/22/47/11/1431224711.db2.gz AKTBESUJJIIVGS-YZVOILCLSA-N 2 1 377.479 3.313 20 0 GGADMP C[C@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1=O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185751255 1431224719 /nfs/dbraw/zinc/22/47/19/1431224719.db2.gz AKTBESUJJIIVGS-YZVOILCLSA-N 2 1 377.479 3.313 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccccc1OC(F)F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185757148 1431226146 /nfs/dbraw/zinc/22/61/46/1431226146.db2.gz GFUQHYLMKJWAHJ-HUUCEWRRSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccccc1OC(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185757148 1431226149 /nfs/dbraw/zinc/22/61/49/1431226149.db2.gz GFUQHYLMKJWAHJ-HUUCEWRRSA-N 2 1 381.467 3.469 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185757915 1431226517 /nfs/dbraw/zinc/22/65/17/1431226517.db2.gz PJGFVIKNHGFPPC-IXDOHACOSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185757915 1431226524 /nfs/dbraw/zinc/22/65/24/1431226524.db2.gz PJGFVIKNHGFPPC-IXDOHACOSA-N 2 1 389.540 3.273 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCOc1ccc(Cl)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185757666 1431226804 /nfs/dbraw/zinc/22/68/04/1431226804.db2.gz BNJXUZQNJGSUIA-IAGOWNOFSA-N 2 1 393.959 3.078 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCOc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185757666 1431226813 /nfs/dbraw/zinc/22/68/13/1431226813.db2.gz BNJXUZQNJGSUIA-IAGOWNOFSA-N 2 1 393.959 3.078 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185757958 1431227036 /nfs/dbraw/zinc/22/70/36/1431227036.db2.gz PJGFVIKNHGFPPC-IKGGRYGDSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185757958 1431227037 /nfs/dbraw/zinc/22/70/37/1431227037.db2.gz PJGFVIKNHGFPPC-IKGGRYGDSA-N 2 1 389.540 3.273 20 0 GGADMP Cc1cc2ncn(C[C@H](O)C[NH2+][C@@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)c2cc1C ZINC000185761144 1431227252 /nfs/dbraw/zinc/22/72/52/1431227252.db2.gz FYDFOTOHFTWOOG-QKNQBKEWSA-N 2 1 384.568 3.257 20 0 GGADMP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2csc(COc3ccccc3)n2)CC1 ZINC000185894896 1431268197 /nfs/dbraw/zinc/26/81/97/1431268197.db2.gz NNUOTFKVPSAWSN-UHFFFAOYSA-N 2 1 388.581 3.228 20 0 GGADMP C[C@@H](C[NH+]1CCCCCC1)NC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186108504 1431332089 /nfs/dbraw/zinc/33/20/89/1431332089.db2.gz JPNAFTKIUYNLGJ-UNMCSNQZSA-N 2 1 386.584 3.414 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000186302201 1431376050 /nfs/dbraw/zinc/37/60/50/1431376050.db2.gz ONJFMTNRBFXOKY-UHFFFAOYSA-N 2 1 384.524 3.119 20 0 GGADMP CCO[C@@H]1C[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C12CCOCC2 ZINC000186316253 1431380413 /nfs/dbraw/zinc/38/04/13/1431380413.db2.gz IASQMALAVNTNNE-FCHUYYIVSA-N 2 1 390.543 3.396 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000186327539 1431383721 /nfs/dbraw/zinc/38/37/21/1431383721.db2.gz KCUXLACWFUEDGY-UHFFFAOYSA-N 2 1 384.524 3.263 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O ZINC000186408128 1431406009 /nfs/dbraw/zinc/40/60/09/1431406009.db2.gz QDWCWRUKMHVRGB-QGZVFWFLSA-N 2 1 380.414 3.338 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O ZINC000186408128 1431406010 /nfs/dbraw/zinc/40/60/10/1431406010.db2.gz QDWCWRUKMHVRGB-QGZVFWFLSA-N 2 1 380.414 3.338 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)C1CCS(=O)(=O)CC1 ZINC000187010054 1431588932 /nfs/dbraw/zinc/58/89/32/1431588932.db2.gz VGESIBAHMISDCQ-MSOLQXFVSA-N 2 1 378.582 3.221 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](N[C@@H](C)C(=O)Nc2cc(F)ccc2F)[C@H](C)C1 ZINC000187012689 1431589158 /nfs/dbraw/zinc/58/91/58/1431589158.db2.gz HJLQXRHYLLTTDH-VKJFTORMSA-N 2 1 383.483 3.018 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000187023860 1431593354 /nfs/dbraw/zinc/59/33/54/1431593354.db2.gz YITDHCUYZJMTBH-UWVAXJGDSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000187023860 1431593358 /nfs/dbraw/zinc/59/33/58/1431593358.db2.gz YITDHCUYZJMTBH-UWVAXJGDSA-N 2 1 395.975 3.244 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc4c(c3)CCC(=O)N4C)CC2)oc1C ZINC000187234990 1431659120 /nfs/dbraw/zinc/65/91/20/1431659120.db2.gz OMQXMHWBUFGHQM-UHFFFAOYSA-N 2 1 396.535 3.202 20 0 GGADMP COc1ccc(-c2ccncc2)cc1C[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000187250844 1431666550 /nfs/dbraw/zinc/66/65/50/1431666550.db2.gz JPDQSGYCKWSHQX-GOSISDBHSA-N 2 1 381.520 3.348 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1)c1ccco1 ZINC000188172486 1431856587 /nfs/dbraw/zinc/85/65/87/1431856587.db2.gz SPRPBSGTWAMDAC-WOJBJXKFSA-N 2 1 384.524 3.092 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1)c1ccco1 ZINC000188172486 1431856588 /nfs/dbraw/zinc/85/65/88/1431856588.db2.gz SPRPBSGTWAMDAC-WOJBJXKFSA-N 2 1 384.524 3.092 20 0 GGADMP CC[NH+](CC)Cc1ccc(NC(=O)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC000188371598 1431878244 /nfs/dbraw/zinc/87/82/44/1431878244.db2.gz NLPALVNFDMBYNM-QFIPXVFZSA-N 2 1 381.520 3.368 20 0 GGADMP CC[NH+](CC)Cc1ccc(NC(=O)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC000188371598 1431878245 /nfs/dbraw/zinc/87/82/45/1431878245.db2.gz NLPALVNFDMBYNM-QFIPXVFZSA-N 2 1 381.520 3.368 20 0 GGADMP C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)[N@H+](C)CCC[NH+]1CCCCC1 ZINC000189243829 1432070340 /nfs/dbraw/zinc/07/03/40/1432070340.db2.gz IKNVEESUXPHPKY-SFHVURJKSA-N 2 1 379.570 3.095 20 0 GGADMP C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)[N@@H+](C)CCC[NH+]1CCCCC1 ZINC000189243829 1432070346 /nfs/dbraw/zinc/07/03/46/1432070346.db2.gz IKNVEESUXPHPKY-SFHVURJKSA-N 2 1 379.570 3.095 20 0 GGADMP C[C@H](c1cccc(N2CCCS2(=O)=O)c1)[N@H+](C)CCC[NH+]1CCCCC1 ZINC000189243849 1432070483 /nfs/dbraw/zinc/07/04/83/1432070483.db2.gz IKNVEESUXPHPKY-GOSISDBHSA-N 2 1 379.570 3.095 20 0 GGADMP C[C@H](c1cccc(N2CCCS2(=O)=O)c1)[N@@H+](C)CCC[NH+]1CCCCC1 ZINC000189243849 1432070489 /nfs/dbraw/zinc/07/04/89/1432070489.db2.gz IKNVEESUXPHPKY-GOSISDBHSA-N 2 1 379.570 3.095 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000189796544 1432238092 /nfs/dbraw/zinc/23/80/92/1432238092.db2.gz XTTMJQOFTQHOKV-GOSISDBHSA-N 2 1 392.592 3.310 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000189796544 1432238101 /nfs/dbraw/zinc/23/81/01/1432238101.db2.gz XTTMJQOFTQHOKV-GOSISDBHSA-N 2 1 392.592 3.310 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cccc(C)c2C)[C@H](C)C1 ZINC000189991833 1432301017 /nfs/dbraw/zinc/30/10/17/1432301017.db2.gz NXLTYZDSJUQFTR-HOJAQTOUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cccc(C)c2C)[C@H](C)C1 ZINC000189991833 1432301022 /nfs/dbraw/zinc/30/10/22/1432301022.db2.gz NXLTYZDSJUQFTR-HOJAQTOUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc3oc(C(=O)OC)cc3c2)[C@H](C)C1 ZINC000189998222 1432301631 /nfs/dbraw/zinc/30/16/31/1432301631.db2.gz SKXVMCUTQCSJMB-VQIMIIECSA-N 2 1 388.508 3.446 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(=O)oc3c(C)c(O)ccc23)[C@H](C)C1 ZINC000190000872 1432302263 /nfs/dbraw/zinc/30/22/63/1432302263.db2.gz QDFIXMVYLIXWKW-BEFAXECRSA-N 2 1 388.508 3.034 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(=O)oc3c(C)c(O)ccc23)[C@H](C)C1 ZINC000190000872 1432302267 /nfs/dbraw/zinc/30/22/67/1432302267.db2.gz QDFIXMVYLIXWKW-BEFAXECRSA-N 2 1 388.508 3.034 20 0 GGADMP CCN(CCC[NH+](C)C)C(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000190071923 1432314404 /nfs/dbraw/zinc/31/44/04/1432314404.db2.gz CKFHPULDSZDPJH-VQIMIIECSA-N 2 1 398.954 3.455 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000191269301 1432614959 /nfs/dbraw/zinc/61/49/59/1432614959.db2.gz MSDKWVWBHFVPQA-UHFFFAOYSA-N 2 1 399.938 3.101 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000191302665 1432626258 /nfs/dbraw/zinc/62/62/58/1432626258.db2.gz GSNSASMXOIHJBH-UHFFFAOYSA-N 2 1 388.463 3.054 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000191302665 1432626273 /nfs/dbraw/zinc/62/62/73/1432626273.db2.gz GSNSASMXOIHJBH-UHFFFAOYSA-N 2 1 388.463 3.054 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000191484927 1432669880 /nfs/dbraw/zinc/66/98/80/1432669880.db2.gz TUBFSZJDEZTJFG-MRXNPFEDSA-N 2 1 385.512 3.143 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000191484927 1432669885 /nfs/dbraw/zinc/66/98/85/1432669885.db2.gz TUBFSZJDEZTJFG-MRXNPFEDSA-N 2 1 385.512 3.143 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)NC(=O)Nc1cccc(C)c1C ZINC000191487956 1432670517 /nfs/dbraw/zinc/67/05/17/1432670517.db2.gz WUBNEYCWFNYVJN-UHFFFAOYSA-N 2 1 385.512 3.123 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)NC(=O)Nc1cccc(C)c1C ZINC000191487956 1432670519 /nfs/dbraw/zinc/67/05/19/1432670519.db2.gz WUBNEYCWFNYVJN-UHFFFAOYSA-N 2 1 385.512 3.123 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H](O)Cn1cnc2cc(C)c(C)cc21 ZINC000191501452 1432673553 /nfs/dbraw/zinc/67/35/53/1432673553.db2.gz FLNWYWDABZOIBH-LJQANCHMSA-N 2 1 383.540 3.185 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H](O)Cn1cnc2cc(C)c(C)cc21 ZINC000191501452 1432673561 /nfs/dbraw/zinc/67/35/61/1432673561.db2.gz FLNWYWDABZOIBH-LJQANCHMSA-N 2 1 383.540 3.185 20 0 GGADMP CN(c1ccccc1C[N@@H+]1CCSC[C@@H]1c1cnn(C)c1)C1CC[NH+](C)CC1 ZINC000191745268 1432716377 /nfs/dbraw/zinc/71/63/77/1432716377.db2.gz LSKHHVUKRHGVKV-JOCHJYFZSA-N 2 1 399.608 3.241 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCSC[C@@H]1c1cnn(C)c1)C1CC[NH+](C)CC1 ZINC000191745268 1432716383 /nfs/dbraw/zinc/71/63/83/1432716383.db2.gz LSKHHVUKRHGVKV-JOCHJYFZSA-N 2 1 399.608 3.241 20 0 GGADMP FC(F)(F)CC[NH+]1CCC(NC[C@@H]2C[N@H+](Cc3ccccc3)CCCO2)CC1 ZINC000191838177 1432736677 /nfs/dbraw/zinc/73/66/77/1432736677.db2.gz ITPLOCGWZXXIKR-HXUWFJFHSA-N 2 1 399.501 3.284 20 0 GGADMP FC(F)(F)CC[NH+]1CCC(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)CC1 ZINC000191838177 1432736680 /nfs/dbraw/zinc/73/66/80/1432736680.db2.gz ITPLOCGWZXXIKR-HXUWFJFHSA-N 2 1 399.501 3.284 20 0 GGADMP O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)[C@@H]1CC[NH+](C2CCCCC2)C1 ZINC000192232417 1432820358 /nfs/dbraw/zinc/82/03/58/1432820358.db2.gz VWCHSXOCSAJOQX-FYYLOGMGSA-N 2 1 399.579 3.048 20 0 GGADMP O=C(NC[C@@H]1C[NH+](Cc2ccccc2)CCCO1)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000192232417 1432820360 /nfs/dbraw/zinc/82/03/60/1432820360.db2.gz VWCHSXOCSAJOQX-FYYLOGMGSA-N 2 1 399.579 3.048 20 0 GGADMP O=C(NC[C@@H]1C[NH+](Cc2ccccc2)CCCO1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000192232417 1432820362 /nfs/dbraw/zinc/82/03/62/1432820362.db2.gz VWCHSXOCSAJOQX-FYYLOGMGSA-N 2 1 399.579 3.048 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(SC)cc1OC ZINC000192682486 1432874997 /nfs/dbraw/zinc/87/49/97/1432874997.db2.gz WMRGEZOUBVNLRB-INIZCTEOSA-N 2 1 394.585 3.297 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@@H](C)[C@H]2CNC(=O)OC(C)(C)C)CC1 ZINC000192751925 1432884579 /nfs/dbraw/zinc/88/45/79/1432884579.db2.gz KMQOOOVKJGHXHB-WOJBJXKFSA-N 2 1 396.620 3.028 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@H](C)[C@H]2CNC(=O)OC(C)(C)C)CC1 ZINC000192751937 1432884689 /nfs/dbraw/zinc/88/46/89/1432884689.db2.gz KMQOOOVKJGHXHB-VQTJNVASSA-N 2 1 396.620 3.028 20 0 GGADMP O=C(Nc1ccnn1[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CC[NH+](C2CC2)CC1 ZINC000192763059 1432886533 /nfs/dbraw/zinc/88/65/33/1432886533.db2.gz UHKNUBMGDPMUDF-NRFANRHFSA-N 2 1 393.535 3.143 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)CC1 ZINC000192775118 1432888834 /nfs/dbraw/zinc/88/88/34/1432888834.db2.gz DVUUXOWOZICFRI-YADHBBJMSA-N 2 1 377.548 3.130 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)C2CC[NH+](C3CC3)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000192792237 1432891479 /nfs/dbraw/zinc/89/14/79/1432891479.db2.gz HCSQGYIUKUSGMD-UZLBHIALSA-N 2 1 393.934 3.463 20 0 GGADMP CCOC(=O)c1oc2c(c1C)[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)CCC2 ZINC000192829193 1432895967 /nfs/dbraw/zinc/89/59/67/1432895967.db2.gz GFSUWUYKAPHBDT-SFHVURJKSA-N 2 1 391.556 3.005 20 0 GGADMP CCOC(=O)c1oc2c(c1C)[C@H]([NH2+]C1CC[NH+](C[C@@H]3CCOC3)CC1)CCC2 ZINC000192880827 1432902534 /nfs/dbraw/zinc/90/25/34/1432902534.db2.gz GQSYZMAAYKWHSD-FUHWJXTLSA-N 2 1 390.524 3.233 20 0 GGADMP Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192932467 1432909985 /nfs/dbraw/zinc/90/99/85/1432909985.db2.gz ONIMBMZZTZTGCL-KRWDZBQOSA-N 2 1 396.457 3.281 20 0 GGADMP Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192932467 1432909987 /nfs/dbraw/zinc/90/99/87/1432909987.db2.gz ONIMBMZZTZTGCL-KRWDZBQOSA-N 2 1 396.457 3.281 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)[nH+]c1 ZINC000193175028 1432951181 /nfs/dbraw/zinc/95/11/81/1432951181.db2.gz JJRQFBYIAUIBHZ-QGZVFWFLSA-N 2 1 387.553 3.390 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC2CC[NH+](CCc3ccccc3)CC2)[nH+]c1 ZINC000193265988 1432971287 /nfs/dbraw/zinc/97/12/87/1432971287.db2.gz LPIKAWVXBURHHR-UHFFFAOYSA-N 2 1 395.551 3.198 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)CC1 ZINC000193621404 1433030175 /nfs/dbraw/zinc/03/01/75/1433030175.db2.gz QFMPCNPEAZUVQJ-LJQANCHMSA-N 2 1 380.964 3.316 20 0 GGADMP C[C@H](CNC(=O)NCCCC[N@@H+]1CCC[C@H](C)C1)[NH+]1CCc2sccc2C1 ZINC000193761659 1433054770 /nfs/dbraw/zinc/05/47/70/1433054770.db2.gz UHVKFZAQSUVLSG-ZWKOTPCHSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@H](CNC(=O)NCCCC[N@H+]1CCC[C@H](C)C1)[NH+]1CCc2sccc2C1 ZINC000193761659 1433054772 /nfs/dbraw/zinc/05/47/72/1433054772.db2.gz UHVKFZAQSUVLSG-ZWKOTPCHSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCC[C@H](C)C1)[N@@H+]1CCc2sccc2C1 ZINC000193761659 1433054775 /nfs/dbraw/zinc/05/47/75/1433054775.db2.gz UHVKFZAQSUVLSG-ZWKOTPCHSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCC[C@H](C)C1)[N@H+]1CCc2sccc2C1 ZINC000193761659 1433054777 /nfs/dbraw/zinc/05/47/77/1433054777.db2.gz UHVKFZAQSUVLSG-ZWKOTPCHSA-N 2 1 392.613 3.306 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NC[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)[nH+]c1 ZINC000193809303 1433064511 /nfs/dbraw/zinc/06/45/11/1433064511.db2.gz GWPYIISRPFOJDE-NRFANRHFSA-N 2 1 392.547 3.245 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NC[C@@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)[nH+]c1 ZINC000193809303 1433064517 /nfs/dbraw/zinc/06/45/17/1433064517.db2.gz GWPYIISRPFOJDE-NRFANRHFSA-N 2 1 392.547 3.245 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000193933116 1433087835 /nfs/dbraw/zinc/08/78/35/1433087835.db2.gz ZOXKOTTYIUSUNS-JOCHJYFZSA-N 2 1 380.536 3.070 20 0 GGADMP COC[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(Cl)cc1 ZINC000194019427 1433101838 /nfs/dbraw/zinc/10/18/38/1433101838.db2.gz XCIMZGJXOBAEMD-FQEVSTJZSA-N 2 1 389.927 3.109 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000194031748 1433104525 /nfs/dbraw/zinc/10/45/25/1433104525.db2.gz YTLXICJRXLXUQE-JOCHJYFZSA-N 2 1 380.536 3.070 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3[C@H]4CCO[C@H]4C34CCC4)CC2)cs1 ZINC000194036887 1433105198 /nfs/dbraw/zinc/10/51/98/1433105198.db2.gz CSXWGECDPJILAZ-YZGWKJHDSA-N 2 1 375.582 3.465 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000194111425 1433119420 /nfs/dbraw/zinc/11/94/20/1433119420.db2.gz YVCYBIPNSHOACY-JOCHJYFZSA-N 2 1 398.595 3.462 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000194116198 1433120387 /nfs/dbraw/zinc/12/03/87/1433120387.db2.gz AQVXAFAXSVKMQG-QHCPKHFHSA-N 2 1 394.563 3.460 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000194116198 1433120391 /nfs/dbraw/zinc/12/03/91/1433120391.db2.gz AQVXAFAXSVKMQG-QHCPKHFHSA-N 2 1 394.563 3.460 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000194116198 1433120393 /nfs/dbraw/zinc/12/03/93/1433120393.db2.gz AQVXAFAXSVKMQG-QHCPKHFHSA-N 2 1 394.563 3.460 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NCCCC[NH+]3C[C@@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000194163308 1433129006 /nfs/dbraw/zinc/12/90/06/1433129006.db2.gz JWSTWCBDABJWPW-PMACEKPBSA-N 2 1 386.584 3.481 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)Cc1ccc(F)cc1 ZINC000194225646 1433142837 /nfs/dbraw/zinc/14/28/37/1433142837.db2.gz CJSDJNZHQBVDAY-OAQYLSRUSA-N 2 1 398.526 3.079 20 0 GGADMP C[NH+](CCNC(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1)Cc1ccc(F)cc1 ZINC000194225646 1433142839 /nfs/dbraw/zinc/14/28/39/1433142839.db2.gz CJSDJNZHQBVDAY-OAQYLSRUSA-N 2 1 398.526 3.079 20 0 GGADMP C[NH+](CCNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)Cc1ccc(F)cc1 ZINC000194225646 1433142842 /nfs/dbraw/zinc/14/28/42/1433142842.db2.gz CJSDJNZHQBVDAY-OAQYLSRUSA-N 2 1 398.526 3.079 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000194265148 1433152020 /nfs/dbraw/zinc/15/20/20/1433152020.db2.gz SLLXNPMJJQPPQC-VXKWHMMOSA-N 2 1 386.584 3.176 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000194265148 1433152023 /nfs/dbraw/zinc/15/20/23/1433152023.db2.gz SLLXNPMJJQPPQC-VXKWHMMOSA-N 2 1 386.584 3.176 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000194265148 1433152027 /nfs/dbraw/zinc/15/20/27/1433152027.db2.gz SLLXNPMJJQPPQC-VXKWHMMOSA-N 2 1 386.584 3.176 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000194414482 1433174385 /nfs/dbraw/zinc/17/43/85/1433174385.db2.gz OKDKZKJFRLAZDV-YADHBBJMSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(C[N@H+]1CC[C@H](c2ccccc2)C1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000194643344 1433210242 /nfs/dbraw/zinc/21/02/42/1433210242.db2.gz NNBQXYCIGOXOSM-QHCPKHFHSA-N 2 1 377.532 3.388 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)Nc1ccccc1C[NH+]1CCSCC1 ZINC000194647837 1433210989 /nfs/dbraw/zinc/21/09/89/1433210989.db2.gz JWVFVLBXHAFTFC-UHFFFAOYSA-N 2 1 376.570 3.233 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H](C)Cn1cc[nH+]c1C)c1ccsc1 ZINC000194891631 1433258525 /nfs/dbraw/zinc/25/85/25/1433258525.db2.gz PMTXCPLGTIJNLK-CRAIPNDOSA-N 2 1 377.558 3.271 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000194900917 1433260603 /nfs/dbraw/zinc/26/06/03/1433260603.db2.gz PHZQMLSVEKDTGZ-SFHVURJKSA-N 2 1 375.561 3.125 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000194900917 1433260605 /nfs/dbraw/zinc/26/06/05/1433260605.db2.gz PHZQMLSVEKDTGZ-SFHVURJKSA-N 2 1 375.561 3.125 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)CC1 ZINC000194958038 1433272363 /nfs/dbraw/zinc/27/23/63/1433272363.db2.gz UADBDYWPJXCUNJ-MRXNPFEDSA-N 2 1 378.586 3.058 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)CC1 ZINC000194958038 1433272364 /nfs/dbraw/zinc/27/23/64/1433272364.db2.gz UADBDYWPJXCUNJ-MRXNPFEDSA-N 2 1 378.586 3.058 20 0 GGADMP COC(=O)COc1ccccc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000195132956 1433296871 /nfs/dbraw/zinc/29/68/71/1433296871.db2.gz MAJXMGLLTAWWSN-UYAOXDASSA-N 2 1 382.504 3.411 20 0 GGADMP COC(=O)COc1ccccc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195132956 1433296874 /nfs/dbraw/zinc/29/68/74/1433296874.db2.gz MAJXMGLLTAWWSN-UYAOXDASSA-N 2 1 382.504 3.411 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000195132824 1433297075 /nfs/dbraw/zinc/29/70/75/1433297075.db2.gz CFLJKGBLKKLFFZ-SJLPKXTDSA-N 2 1 390.524 3.402 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000195132824 1433297080 /nfs/dbraw/zinc/29/70/80/1433297080.db2.gz CFLJKGBLKKLFFZ-SJLPKXTDSA-N 2 1 390.524 3.402 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000195136972 1433297619 /nfs/dbraw/zinc/29/76/19/1433297619.db2.gz SAKUSQFROFNARG-PKOBYXMFSA-N 2 1 387.549 3.231 20 0 GGADMP C[N@H+](CC(=O)N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)Cc1ccccc1 ZINC000195295362 1433316211 /nfs/dbraw/zinc/31/62/11/1433316211.db2.gz XRHKBDATAMVAQN-NRFANRHFSA-N 2 1 393.531 3.223 20 0 GGADMP C[N@@H+](CC(=O)N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)Cc1ccccc1 ZINC000195295362 1433316213 /nfs/dbraw/zinc/31/62/13/1433316213.db2.gz XRHKBDATAMVAQN-NRFANRHFSA-N 2 1 393.531 3.223 20 0 GGADMP CN(c1ccc(NC(=O)[C@H](c2ccccc2)[NH+](C)C)cc1)C1CC[NH+](C)CC1 ZINC000195306889 1433317497 /nfs/dbraw/zinc/31/74/97/1433317497.db2.gz YFBDNVQTPCDGHU-QFIPXVFZSA-N 2 1 380.536 3.458 20 0 GGADMP C[NH+](C)[C@@H](C(=O)Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1ccccc1 ZINC000195311250 1433317833 /nfs/dbraw/zinc/31/78/33/1433317833.db2.gz HIDSUPOAYDMBKA-HSZRJFAPSA-N 2 1 392.547 3.460 20 0 GGADMP C[NH+](C)[C@@H](C(=O)N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1ccccc1 ZINC000195315212 1433318410 /nfs/dbraw/zinc/31/84/10/1433318410.db2.gz UIYWTBRUXOZVEL-RBBKRZOGSA-N 2 1 393.531 3.394 20 0 GGADMP C[NH+](C)[C@@H](C(=O)N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1ccccc1 ZINC000195315223 1433318446 /nfs/dbraw/zinc/31/84/46/1433318446.db2.gz UIYWTBRUXOZVEL-IFMALSPDSA-N 2 1 393.531 3.394 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@H](c2nccs2)C1 ZINC000195342359 1433320806 /nfs/dbraw/zinc/32/08/06/1433320806.db2.gz UBYZFMMKLYUOFJ-HOJAQTOUSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000195342359 1433320808 /nfs/dbraw/zinc/32/08/08/1433320808.db2.gz UBYZFMMKLYUOFJ-HOJAQTOUSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC[C@H](c2nccs2)C1 ZINC000195342359 1433320811 /nfs/dbraw/zinc/32/08/11/1433320811.db2.gz UBYZFMMKLYUOFJ-HOJAQTOUSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@H](c2nccs2)C1 ZINC000195342359 1433320815 /nfs/dbraw/zinc/32/08/15/1433320815.db2.gz UBYZFMMKLYUOFJ-HOJAQTOUSA-N 2 1 398.576 3.102 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@H](C(C)C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000226426185 1433368534 /nfs/dbraw/zinc/36/85/34/1433368534.db2.gz DTGZOVCXPKKNMC-IPJJNNNSSA-N 2 1 389.584 3.231 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000229085909 1433371785 /nfs/dbraw/zinc/37/17/85/1433371785.db2.gz LXWNZJDXXUFUIT-IXDOHACOSA-N 2 1 393.959 3.488 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000229085909 1433371787 /nfs/dbraw/zinc/37/17/87/1433371787.db2.gz LXWNZJDXXUFUIT-IXDOHACOSA-N 2 1 393.959 3.488 20 0 GGADMP CC(C)Oc1cccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000236830564 1433380490 /nfs/dbraw/zinc/38/04/90/1433380490.db2.gz KSSCJCFBKQNOFA-JOCHJYFZSA-N 2 1 395.547 3.461 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(-n3ccnc3)cc2)CC1 ZINC000236843023 1433380706 /nfs/dbraw/zinc/38/07/06/1433380706.db2.gz VKFSLYUALSHXLO-UHFFFAOYSA-N 2 1 389.547 3.300 20 0 GGADMP CCOc1c(Br)cc(C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1OC ZINC000237005085 1433385741 /nfs/dbraw/zinc/38/57/41/1433385741.db2.gz WPZWLBBIIAKIPV-ZDUSSCGKSA-N 2 1 383.330 3.430 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C[C@H]([NH3+])c3ccccc3)CC2)cs1 ZINC000237042911 1433387092 /nfs/dbraw/zinc/38/70/92/1433387092.db2.gz HQVRZOVZELPHRY-IBGZPJMESA-N 2 1 386.565 3.124 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C[C@H](C)C3CC[NH2+]CC3)CC2)cs1 ZINC000237042825 1433387149 /nfs/dbraw/zinc/38/71/49/1433387149.db2.gz NVVAUBNAHDYVMJ-INIZCTEOSA-N 2 1 392.613 3.060 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCCC[NH2+]2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000237124788 1433390028 /nfs/dbraw/zinc/39/00/28/1433390028.db2.gz KTIVVKVJDUFFCX-NXHRZFHOSA-N 2 1 383.458 3.347 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2ccc(OC)c(OCc3ccccc3)c2)CC1 ZINC000237124261 1433390061 /nfs/dbraw/zinc/39/00/61/1433390061.db2.gz QTGLTTYVJDDTSE-UHFFFAOYSA-N 2 1 384.520 3.475 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC(C)(C)CNC[C@@H](O)C[NH+]1CCc2ccccc2C1 ZINC000237131219 1433390285 /nfs/dbraw/zinc/39/02/85/1433390285.db2.gz GGHNUCITGZUJPK-XMMPIXPASA-N 2 1 395.591 3.153 20 0 GGADMP C[NH+](Cc1ccccc1)CC(C)(C)CNC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000237131219 1433390286 /nfs/dbraw/zinc/39/02/86/1433390286.db2.gz GGHNUCITGZUJPK-XMMPIXPASA-N 2 1 395.591 3.153 20 0 GGADMP C[NH+](Cc1ccccc1)CC(C)(C)CNC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000237131219 1433390287 /nfs/dbraw/zinc/39/02/87/1433390287.db2.gz GGHNUCITGZUJPK-XMMPIXPASA-N 2 1 395.591 3.153 20 0 GGADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H](O)CN1CCc2ccccc2C1 ZINC000237131219 1433390288 /nfs/dbraw/zinc/39/02/88/1433390288.db2.gz GGHNUCITGZUJPK-XMMPIXPASA-N 2 1 395.591 3.153 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H](O)CN1CCc2ccccc2C1 ZINC000237131219 1433390289 /nfs/dbraw/zinc/39/02/89/1433390289.db2.gz GGHNUCITGZUJPK-XMMPIXPASA-N 2 1 395.591 3.153 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)[C@@H]2Cc3ccccc3C[NH2+]2)cc1 ZINC000237352684 1433398802 /nfs/dbraw/zinc/39/88/02/1433398802.db2.gz MNKOOSGNLRIZQG-JPYJTQIMSA-N 2 1 377.532 3.392 20 0 GGADMP C[C@@H](CC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[C@H]1CCC[NH2+]C1 ZINC000237400605 1433400810 /nfs/dbraw/zinc/40/08/10/1433400810.db2.gz YOIGNGWBDAAUQX-RDJZCZTQSA-N 2 1 379.495 3.071 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)C2(c3ccccc3)CC[NH2+]CC2)C[N@H+]1Cc1ccccc1 ZINC000237480164 1433405604 /nfs/dbraw/zinc/40/56/04/1433405604.db2.gz WIFKORJLFWQQCJ-DENIHFKCSA-N 2 1 377.532 3.087 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000237562909 1433409926 /nfs/dbraw/zinc/40/99/26/1433409926.db2.gz MDYZUVCAJFSLMY-MRXNPFEDSA-N 2 1 395.507 3.179 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CCN(C(=O)CC[C@@H]([NH3+])c3ccccc3)CC2)C[C@H](C)O1 ZINC000237605465 1433412363 /nfs/dbraw/zinc/41/23/63/1433412363.db2.gz QANBHYUXEUHQPK-XQBPLPMBSA-N 2 1 387.568 3.205 20 0 GGADMP Cc1ccc(NC(=O)CC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1NC(=O)C[NH+]1CCCCC1 ZINC000237668268 1433415833 /nfs/dbraw/zinc/41/58/33/1433415833.db2.gz BCBOYBCEJWJQKN-YQQQUEKLSA-N 2 1 398.551 3.279 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[C@H]([NH3+])c1ccccc1 ZINC000237701682 1433417837 /nfs/dbraw/zinc/41/78/37/1433417837.db2.gz FZQPVWHNSZEZHZ-VFNWGFHPSA-N 2 1 387.474 3.382 20 0 GGADMP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[N@H+]1CCC[C@H]1CO ZINC000237720085 1433419155 /nfs/dbraw/zinc/41/91/55/1433419155.db2.gz HEOOCVJLLBHHJE-FQEVSTJZSA-N 2 1 390.959 3.469 20 0 GGADMP C[C@]1(C(=O)N2CCC[N@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CCCC[NH2+]1 ZINC000237792162 1433424117 /nfs/dbraw/zinc/42/41/17/1433424117.db2.gz VLYPUYQYTMUOFB-LJQANCHMSA-N 2 1 383.458 3.272 20 0 GGADMP C[C@]1(C(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CCCC[NH2+]1 ZINC000237792162 1433424121 /nfs/dbraw/zinc/42/41/21/1433424121.db2.gz VLYPUYQYTMUOFB-LJQANCHMSA-N 2 1 383.458 3.272 20 0 GGADMP [NH3+][C@@H]1CCCCCC[C@H]1C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000237888870 1433431985 /nfs/dbraw/zinc/43/19/85/1433431985.db2.gz PUDSJKHYWJGPIW-YLJYHZDGSA-N 2 1 379.495 3.343 20 0 GGADMP [NH3+][C@@H]1CCCCCC[C@H]1C(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1 ZINC000237905020 1433433228 /nfs/dbraw/zinc/43/32/28/1433433228.db2.gz MDVBHOGBBHTAMW-NHCUHLMSSA-N 2 1 398.551 3.210 20 0 GGADMP O=C([C@@H]1CC12CC[NH2+]CC2)N1CC[N@@H+](Cc2ccccc2)C2(CCCCC2)C1 ZINC000237934486 1433435594 /nfs/dbraw/zinc/43/55/94/1433435594.db2.gz YVWWOJLGXHPNPC-NRFANRHFSA-N 2 1 381.564 3.423 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cccc4[nH]ccc43)c2)C1 ZINC000237939382 1433435980 /nfs/dbraw/zinc/43/59/80/1433435980.db2.gz DLRJMEXXDQGKCG-FQEVSTJZSA-N 2 1 376.504 3.155 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]Cc2cccc3[nH]ccc32)c1 ZINC000238021993 1433439703 /nfs/dbraw/zinc/43/97/03/1433439703.db2.gz UJLGQADZTXYAKJ-UHFFFAOYSA-N 2 1 392.503 3.119 20 0 GGADMP Cc1cccc(NC(=O)[C@H](C)[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c1C ZINC000245386629 1433457014 /nfs/dbraw/zinc/45/70/14/1433457014.db2.gz PGSYYZILSXQECF-BJLQDIEVSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1F ZINC000245391635 1433458329 /nfs/dbraw/zinc/45/83/29/1433458329.db2.gz QXTVIKXYKOYGOI-HZPDHXFCSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1F ZINC000245391635 1433458330 /nfs/dbraw/zinc/45/83/30/1433458330.db2.gz QXTVIKXYKOYGOI-HZPDHXFCSA-N 2 1 387.503 3.239 20 0 GGADMP C[C@@H]1CCC[N@H+](CCCCNC(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245413412 1433463201 /nfs/dbraw/zinc/46/32/01/1433463201.db2.gz BOGMBHDUBCLNEO-WIYYLYMNSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245413412 1433463202 /nfs/dbraw/zinc/46/32/02/1433463202.db2.gz BOGMBHDUBCLNEO-WIYYLYMNSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000245413412 1433463203 /nfs/dbraw/zinc/46/32/03/1433463203.db2.gz BOGMBHDUBCLNEO-WIYYLYMNSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000245413412 1433463204 /nfs/dbraw/zinc/46/32/04/1433463204.db2.gz BOGMBHDUBCLNEO-WIYYLYMNSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@H]1CCC[N@H+](CCCCNC(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245413411 1433463231 /nfs/dbraw/zinc/46/32/31/1433463231.db2.gz BOGMBHDUBCLNEO-GHTZIAJQSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245413411 1433463232 /nfs/dbraw/zinc/46/32/32/1433463232.db2.gz BOGMBHDUBCLNEO-GHTZIAJQSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000245413411 1433463233 /nfs/dbraw/zinc/46/32/33/1433463233.db2.gz BOGMBHDUBCLNEO-GHTZIAJQSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000245413411 1433463234 /nfs/dbraw/zinc/46/32/34/1433463234.db2.gz BOGMBHDUBCLNEO-GHTZIAJQSA-N 2 1 375.532 3.418 20 0 GGADMP C[C@@H](C(=O)NCCc1cccs1)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000245439877 1433467920 /nfs/dbraw/zinc/46/79/20/1433467920.db2.gz GCUVSCVQJVDQNF-AZUAARDMSA-N 2 1 385.577 3.249 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000245455441 1433471358 /nfs/dbraw/zinc/47/13/58/1433471358.db2.gz IBSBIEDMYHNRCT-ZWKOTPCHSA-N 2 1 381.586 3.100 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000245587289 1433488286 /nfs/dbraw/zinc/48/82/86/1433488286.db2.gz AONJKVFGYXACIR-MOPGFXCFSA-N 2 1 392.613 3.333 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000245587289 1433488287 /nfs/dbraw/zinc/48/82/87/1433488287.db2.gz AONJKVFGYXACIR-MOPGFXCFSA-N 2 1 392.613 3.333 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000245587289 1433488289 /nfs/dbraw/zinc/48/82/89/1433488289.db2.gz AONJKVFGYXACIR-MOPGFXCFSA-N 2 1 392.613 3.333 20 0 GGADMP COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1 ZINC000245612482 1433491082 /nfs/dbraw/zinc/49/10/82/1433491082.db2.gz LCEWCNQKFWCBDQ-FCHUYYIVSA-N 2 1 381.520 3.251 20 0 GGADMP COc1ccc([C@@H]2CCC[N@H+]2CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1 ZINC000245612482 1433491085 /nfs/dbraw/zinc/49/10/85/1433491085.db2.gz LCEWCNQKFWCBDQ-FCHUYYIVSA-N 2 1 381.520 3.251 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)NC[C@@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245644870 1433495001 /nfs/dbraw/zinc/49/50/01/1433495001.db2.gz AZKLBUCFSAIZEZ-IPELMVKDSA-N 2 1 381.923 3.463 20 0 GGADMP CC[NH+]1CCCC[C@@H]1C(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245644870 1433495002 /nfs/dbraw/zinc/49/50/02/1433495002.db2.gz AZKLBUCFSAIZEZ-IPELMVKDSA-N 2 1 381.923 3.463 20 0 GGADMP CC[NH+]1CCCC[C@@H]1C(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245644870 1433495003 /nfs/dbraw/zinc/49/50/03/1433495003.db2.gz AZKLBUCFSAIZEZ-IPELMVKDSA-N 2 1 381.923 3.463 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)NCC[NH+]2CCCCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245645942 1433495014 /nfs/dbraw/zinc/49/50/14/1433495014.db2.gz BHRKNKINWGAQJT-QFBILLFUSA-N 2 1 396.938 3.257 20 0 GGADMP CSc1ccc(C(=O)N(C)[C@@H]2CCCC[C@@H]2[N@@H+](C)C2CCN(C)CC2)o1 ZINC000245702398 1433502504 /nfs/dbraw/zinc/50/25/04/1433502504.db2.gz LPDINCGVLANNMZ-DLBZAZTESA-N 2 1 379.570 3.411 20 0 GGADMP CSc1ccc(C(=O)N(C)[C@@H]2CCCC[C@H]2[N@@H+](C)C2CCN(C)CC2)o1 ZINC000245702404 1433502624 /nfs/dbraw/zinc/50/26/24/1433502624.db2.gz LPDINCGVLANNMZ-IAGOWNOFSA-N 2 1 379.570 3.411 20 0 GGADMP CN(C(=O)COc1ccc(F)cc1)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000245702408 1433502762 /nfs/dbraw/zinc/50/27/62/1433502762.db2.gz LPQPHHXOKKXAOW-LEWJYISDSA-N 2 1 391.531 3.000 20 0 GGADMP C[C@H](OCCCNC(=O)C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1)c1ccccc1 ZINC000245721793 1433505959 /nfs/dbraw/zinc/50/59/59/1433505959.db2.gz UVBIXZFDCQENJX-IRFCIJBXSA-N 2 1 384.524 3.050 20 0 GGADMP CC(C)N(CC[NH+](C)C)C(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245733926 1433507859 /nfs/dbraw/zinc/50/78/59/1433507859.db2.gz UITJMLDYJFXBPJ-APWZRJJASA-N 2 1 398.954 3.454 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CNC(=O)NC[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245763109 1433513771 /nfs/dbraw/zinc/51/37/71/1433513771.db2.gz ZVVQVQJJUPMXMU-GPMSIDNRSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NC[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245763109 1433513778 /nfs/dbraw/zinc/51/37/78/1433513778.db2.gz ZVVQVQJJUPMXMU-GPMSIDNRSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245763109 1433513782 /nfs/dbraw/zinc/51/37/82/1433513782.db2.gz ZVVQVQJJUPMXMU-GPMSIDNRSA-N 2 1 396.938 3.255 20 0 GGADMP Cn1ccnc1C[C@H]1CCC[N@@H+](C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000245805690 1433520771 /nfs/dbraw/zinc/52/07/71/1433520771.db2.gz BJMDDSTWCNRBOO-AEFFLSMTSA-N 2 1 381.442 3.297 20 0 GGADMP C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245813961 1433521462 /nfs/dbraw/zinc/52/14/62/1433521462.db2.gz CWWSIDVFPWZGII-CVEARBPZSA-N 2 1 390.478 3.172 20 0 GGADMP C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245813961 1433521463 /nfs/dbraw/zinc/52/14/63/1433521463.db2.gz CWWSIDVFPWZGII-CVEARBPZSA-N 2 1 390.478 3.172 20 0 GGADMP CN(C(=O)C[N@H+]1CCC[C@H](Cc2nccn2C)C1)[C@H]1CCCc2ccccc21 ZINC000245860244 1433529017 /nfs/dbraw/zinc/52/90/17/1433529017.db2.gz KQUHVZMWHXLDOA-NQIIRXRSSA-N 2 1 380.536 3.211 20 0 GGADMP CN(C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)[C@H]1CCCc2ccccc21 ZINC000245860244 1433529021 /nfs/dbraw/zinc/52/90/21/1433529021.db2.gz KQUHVZMWHXLDOA-NQIIRXRSSA-N 2 1 380.536 3.211 20 0 GGADMP CN(C(=O)C[N@H+]1CCC[C@@H](Cc2nccn2C)C1)[C@H]1CCCc2ccccc21 ZINC000245860251 1433529183 /nfs/dbraw/zinc/52/91/83/1433529183.db2.gz KQUHVZMWHXLDOA-RXVVDRJESA-N 2 1 380.536 3.211 20 0 GGADMP CN(C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)[C@H]1CCCc2ccccc21 ZINC000245860251 1433529189 /nfs/dbraw/zinc/52/91/89/1433529189.db2.gz KQUHVZMWHXLDOA-RXVVDRJESA-N 2 1 380.536 3.211 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000245863418 1433529548 /nfs/dbraw/zinc/52/95/48/1433529548.db2.gz DCCGONBAFWBEHS-FGTMMUONSA-N 2 1 376.570 3.153 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000245877754 1433532277 /nfs/dbraw/zinc/53/22/77/1433532277.db2.gz ASJKDXKRYWIISZ-FCHUYYIVSA-N 2 1 384.568 3.024 20 0 GGADMP CCC[C@@H]1CN(C(=O)[C@H]2CCC[NH+]2C2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000245895243 1433536448 /nfs/dbraw/zinc/53/64/48/1433536448.db2.gz MXIDJWFOFMWZOY-DHIUTWEWSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@@H]1CN(C(=O)[C@H]2CCC[NH+]2C2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000245895243 1433536452 /nfs/dbraw/zinc/53/64/52/1433536452.db2.gz MXIDJWFOFMWZOY-DHIUTWEWSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@@H]1CN(C(=O)[C@H]2CCC[N@@H+]2C2CCOCC2)CC[NH+]1Cc1ccccc1 ZINC000245895243 1433536455 /nfs/dbraw/zinc/53/64/55/1433536455.db2.gz MXIDJWFOFMWZOY-DHIUTWEWSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@@H]1CN(C(=O)[C@H]2CCC[N@H+]2C2CCOCC2)CC[NH+]1Cc1ccccc1 ZINC000245895243 1433536460 /nfs/dbraw/zinc/53/64/60/1433536460.db2.gz MXIDJWFOFMWZOY-DHIUTWEWSA-N 2 1 399.579 3.143 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000245914610 1433541162 /nfs/dbraw/zinc/54/11/62/1433541162.db2.gz XRSGBDKVIJUHTN-QRVBRYPASA-N 2 1 390.597 3.228 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000245914610 1433541169 /nfs/dbraw/zinc/54/11/69/1433541169.db2.gz XRSGBDKVIJUHTN-QRVBRYPASA-N 2 1 390.597 3.228 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000245914610 1433541176 /nfs/dbraw/zinc/54/11/76/1433541176.db2.gz XRSGBDKVIJUHTN-QRVBRYPASA-N 2 1 390.597 3.228 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)NC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000245918082 1433542346 /nfs/dbraw/zinc/54/23/46/1433542346.db2.gz FZUDDQWBKFRRJG-WIYYLYMNSA-N 2 1 387.572 3.171 20 0 GGADMP CC[C@H]1c2ccsc2CCN1C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245928725 1433545354 /nfs/dbraw/zinc/54/53/54/1433545354.db2.gz ULOXINRZNPTJOD-WMZOPIPTSA-N 2 1 386.565 3.272 20 0 GGADMP CC[C@H]1c2ccsc2CCN1C(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245928725 1433545364 /nfs/dbraw/zinc/54/53/64/1433545364.db2.gz ULOXINRZNPTJOD-WMZOPIPTSA-N 2 1 386.565 3.272 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)CC1 ZINC000245945958 1433548996 /nfs/dbraw/zinc/54/89/96/1433548996.db2.gz NVEFXRXRTFUFDA-CEXWTWQISA-N 2 1 387.572 3.027 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]3C[NH+](C)CC[C@H]32)CC[N@H+]1Cc1ccccc1 ZINC000245960780 1433550978 /nfs/dbraw/zinc/55/09/78/1433550978.db2.gz MPCRDZLYZVQIAG-ZHHKINOHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)CC[NH+]1Cc1ccccc1 ZINC000245960780 1433550983 /nfs/dbraw/zinc/55/09/83/1433550983.db2.gz MPCRDZLYZVQIAG-ZHHKINOHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)CC[NH+]1Cc1ccccc1 ZINC000245960780 1433550985 /nfs/dbraw/zinc/55/09/85/1433550985.db2.gz MPCRDZLYZVQIAG-ZHHKINOHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]3C[NH+](C)CC[C@H]32)CC[N@H+]1Cc1ccccc1 ZINC000245960765 1433551280 /nfs/dbraw/zinc/55/12/80/1433551280.db2.gz MPCRDZLYZVQIAG-FVTFTPSCSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@H]32)CC[NH+]1Cc1ccccc1 ZINC000245960765 1433551285 /nfs/dbraw/zinc/55/12/85/1433551285.db2.gz MPCRDZLYZVQIAG-FVTFTPSCSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)CC[NH+]1Cc1ccccc1 ZINC000245960765 1433551289 /nfs/dbraw/zinc/55/12/89/1433551289.db2.gz MPCRDZLYZVQIAG-FVTFTPSCSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000245981310 1433553053 /nfs/dbraw/zinc/55/30/53/1433553053.db2.gz YKKIXZIVCFCVGK-GUDVDZBRSA-N 2 1 387.572 3.027 20 0 GGADMP C[C@H](c1cn(-c2ccccc2)nn1)N1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000245988088 1433553974 /nfs/dbraw/zinc/55/39/74/1433553974.db2.gz FRLDJTLVENEUQL-CEXWTWQISA-N 2 1 383.540 3.150 20 0 GGADMP C[C@H](c1cn(-c2ccccc2)nn1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000245988088 1433553975 /nfs/dbraw/zinc/55/39/75/1433553975.db2.gz FRLDJTLVENEUQL-CEXWTWQISA-N 2 1 383.540 3.150 20 0 GGADMP C[C@H](c1cn(-c2ccccc2)nn1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000245988088 1433553976 /nfs/dbraw/zinc/55/39/76/1433553976.db2.gz FRLDJTLVENEUQL-CEXWTWQISA-N 2 1 383.540 3.150 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21)c1ccccc1Cl ZINC000245993568 1433554736 /nfs/dbraw/zinc/55/47/36/1433554736.db2.gz RAEZAJZBXSPNAY-ATZDWAIDSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)c1ccccc1Cl ZINC000245993568 1433554740 /nfs/dbraw/zinc/55/47/40/1433554740.db2.gz RAEZAJZBXSPNAY-ATZDWAIDSA-N 2 1 378.948 3.068 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000246055065 1433562163 /nfs/dbraw/zinc/56/21/63/1433562163.db2.gz DYDJPPNXKZMVMM-QRVBRYPASA-N 2 1 388.556 3.322 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000246055065 1433562167 /nfs/dbraw/zinc/56/21/67/1433562167.db2.gz DYDJPPNXKZMVMM-QRVBRYPASA-N 2 1 388.556 3.322 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000246061618 1433562832 /nfs/dbraw/zinc/56/28/32/1433562832.db2.gz ZFMKMLBDZIHRQH-FCHUYYIVSA-N 2 1 384.568 3.298 20 0 GGADMP Cc1nccn1CCCN(C)C(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000246091367 1433567165 /nfs/dbraw/zinc/56/71/65/1433567165.db2.gz IZMHACVNQXUBQS-NGRWLJPCSA-N 2 1 397.567 3.380 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000246091367 1433567170 /nfs/dbraw/zinc/56/71/70/1433567170.db2.gz IZMHACVNQXUBQS-NGRWLJPCSA-N 2 1 397.567 3.380 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000246091367 1433567175 /nfs/dbraw/zinc/56/71/75/1433567175.db2.gz IZMHACVNQXUBQS-NGRWLJPCSA-N 2 1 397.567 3.380 20 0 GGADMP Cn1ccnc1C[C@@H]1CCC[N@H+]([C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1 ZINC000246091779 1433567265 /nfs/dbraw/zinc/56/72/65/1433567265.db2.gz JQXQLYHLGRAJQF-KSSFIOAISA-N 2 1 390.890 3.273 20 0 GGADMP C[C@H]1CCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000246111464 1433570311 /nfs/dbraw/zinc/57/03/11/1433570311.db2.gz HUQKEHJTLFBIST-AZUAARDMSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@H]1CCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)CC[N@H+]1Cc1ccccc1 ZINC000246111464 1433570314 /nfs/dbraw/zinc/57/03/14/1433570314.db2.gz HUQKEHJTLFBIST-AZUAARDMSA-N 2 1 384.524 3.188 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@H](c2ccc(C)o2)[NH+]2CCCC2)C1 ZINC000246113476 1433570782 /nfs/dbraw/zinc/57/07/82/1433570782.db2.gz HXFMMUOFAYEEQR-RTBURBONSA-N 2 1 376.545 3.098 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[NH+]1C1CC1 ZINC000246135218 1433572889 /nfs/dbraw/zinc/57/28/89/1433572889.db2.gz BHRYCJULUIGJSK-YSNWRPKNSA-N 2 1 384.568 3.306 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[NH+]1C1CC1 ZINC000246135218 1433572892 /nfs/dbraw/zinc/57/28/92/1433572892.db2.gz BHRYCJULUIGJSK-YSNWRPKNSA-N 2 1 384.568 3.306 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)N[C@H](C)C(C)(C)C[NH+](C)C ZINC000246149026 1433574944 /nfs/dbraw/zinc/57/49/44/1433574944.db2.gz CPIMOPPGYCCBMB-UYAOXDASSA-N 2 1 389.588 3.054 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(CC[N@@H+]4CC[C@@H](C[NH+]5CCCC5)C4)nc(N)c23)C1 ZINC000246152814 1433575290 /nfs/dbraw/zinc/57/52/90/1433575290.db2.gz GCYQOZXXWMJNEP-CVEARBPZSA-N 2 1 399.608 3.359 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(CC[N@H+]4CC[C@@H](C[NH+]5CCCC5)C4)nc(N)c23)C1 ZINC000246152814 1433575293 /nfs/dbraw/zinc/57/52/93/1433575293.db2.gz GCYQOZXXWMJNEP-CVEARBPZSA-N 2 1 399.608 3.359 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc(OCC)cc2)C1 ZINC000246163607 1433576732 /nfs/dbraw/zinc/57/67/32/1433576732.db2.gz IIIZMNPSKMQUIN-UGKGYDQZSA-N 2 1 387.568 3.413 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[NH+]2C ZINC000246191117 1433580044 /nfs/dbraw/zinc/58/00/44/1433580044.db2.gz MKOZLIXUJYOXSY-RTWAWAEBSA-N 2 1 396.535 3.290 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[NH+]2C ZINC000246191117 1433580046 /nfs/dbraw/zinc/58/00/46/1433580046.db2.gz MKOZLIXUJYOXSY-RTWAWAEBSA-N 2 1 396.535 3.290 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000246191117 1433580049 /nfs/dbraw/zinc/58/00/49/1433580049.db2.gz MKOZLIXUJYOXSY-RTWAWAEBSA-N 2 1 396.535 3.290 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000246191117 1433580050 /nfs/dbraw/zinc/58/00/50/1433580050.db2.gz MKOZLIXUJYOXSY-RTWAWAEBSA-N 2 1 396.535 3.290 20 0 GGADMP O=C(NCCC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)C(F)(F)F ZINC000246211494 1433582307 /nfs/dbraw/zinc/58/23/07/1433582307.db2.gz YSSZNDGMILAXEO-ZWKOTPCHSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(NCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1)C(F)(F)F ZINC000246211494 1433582311 /nfs/dbraw/zinc/58/23/11/1433582311.db2.gz YSSZNDGMILAXEO-ZWKOTPCHSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(NCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1)C(F)(F)F ZINC000246211494 1433582313 /nfs/dbraw/zinc/58/23/13/1433582313.db2.gz YSSZNDGMILAXEO-ZWKOTPCHSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(C[N@H+]1CCS[C@H]2CCCC[C@H]21)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000246219075 1433583069 /nfs/dbraw/zinc/58/30/69/1433583069.db2.gz ZIOKKECBHSEBPG-RTWAWAEBSA-N 2 1 387.593 3.259 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246226258 1433584112 /nfs/dbraw/zinc/58/41/12/1433584112.db2.gz BUJFUTWKIZUDRR-SVFBPWRDSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246226258 1433584114 /nfs/dbraw/zinc/58/41/14/1433584114.db2.gz BUJFUTWKIZUDRR-SVFBPWRDSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246226258 1433584118 /nfs/dbraw/zinc/58/41/18/1433584118.db2.gz BUJFUTWKIZUDRR-SVFBPWRDSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246287817 1433590279 /nfs/dbraw/zinc/59/02/79/1433590279.db2.gz IGKFRACJKLMUDI-HBFSDRIKSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246287817 1433590283 /nfs/dbraw/zinc/59/02/83/1433590283.db2.gz IGKFRACJKLMUDI-HBFSDRIKSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246287817 1433590286 /nfs/dbraw/zinc/59/02/86/1433590286.db2.gz IGKFRACJKLMUDI-HBFSDRIKSA-N 2 1 376.589 3.155 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000246294308 1433590809 /nfs/dbraw/zinc/59/08/09/1433590809.db2.gz DMTASGVFISCNFX-TUNNFDKTSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000246294308 1433590812 /nfs/dbraw/zinc/59/08/12/1433590812.db2.gz DMTASGVFISCNFX-TUNNFDKTSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000246294308 1433590814 /nfs/dbraw/zinc/59/08/14/1433590814.db2.gz DMTASGVFISCNFX-TUNNFDKTSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000246294308 1433590816 /nfs/dbraw/zinc/59/08/16/1433590816.db2.gz DMTASGVFISCNFX-TUNNFDKTSA-N 2 1 390.568 3.159 20 0 GGADMP O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246297355 1433591746 /nfs/dbraw/zinc/59/17/46/1433591746.db2.gz IXKRDIQKOGWCSO-MDNUFGMLSA-N 2 1 396.579 3.482 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)[NH+](C)Cc1ccccc1 ZINC000246313209 1433593520 /nfs/dbraw/zinc/59/35/20/1433593520.db2.gz JZILQKCZPBNQQW-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000246317072 1433593761 /nfs/dbraw/zinc/59/37/61/1433593761.db2.gz GLRWYKGFNZIYHT-MSOLQXFVSA-N 2 1 387.524 3.330 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000246317072 1433593764 /nfs/dbraw/zinc/59/37/64/1433593764.db2.gz GLRWYKGFNZIYHT-MSOLQXFVSA-N 2 1 387.524 3.330 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000246317072 1433593767 /nfs/dbraw/zinc/59/37/67/1433593767.db2.gz GLRWYKGFNZIYHT-MSOLQXFVSA-N 2 1 387.524 3.330 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000246323787 1433595024 /nfs/dbraw/zinc/59/50/24/1433595024.db2.gz HFCYWTSWALHWAU-NJYVYQBISA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)C1 ZINC000246323787 1433595027 /nfs/dbraw/zinc/59/50/27/1433595027.db2.gz HFCYWTSWALHWAU-NJYVYQBISA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)C1 ZINC000246323787 1433595029 /nfs/dbraw/zinc/59/50/29/1433595029.db2.gz HFCYWTSWALHWAU-NJYVYQBISA-N 2 1 378.605 3.403 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N(C)[C@H]2CC[NH+](C)C[C@@H]2C)C1 ZINC000246324741 1433595326 /nfs/dbraw/zinc/59/53/26/1433595326.db2.gz NFKOUIQCZAEYKK-DXIQSLLYSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)C1 ZINC000246324741 1433595327 /nfs/dbraw/zinc/59/53/27/1433595327.db2.gz NFKOUIQCZAEYKK-DXIQSLLYSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)C1 ZINC000246324741 1433595328 /nfs/dbraw/zinc/59/53/28/1433595328.db2.gz NFKOUIQCZAEYKK-DXIQSLLYSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000246334117 1433596257 /nfs/dbraw/zinc/59/62/57/1433596257.db2.gz HHRGRYUZTGWMQJ-RXRQOCSWSA-N 2 1 386.584 3.315 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000246333712 1433596264 /nfs/dbraw/zinc/59/62/64/1433596264.db2.gz HDBACHLKCZTNDG-NPHXMPSESA-N 2 1 398.595 3.413 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000246334153 1433596421 /nfs/dbraw/zinc/59/64/21/1433596421.db2.gz HHRGRYUZTGWMQJ-ZQONDGBOSA-N 2 1 386.584 3.315 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1)c1cccs1 ZINC000246345963 1433598141 /nfs/dbraw/zinc/59/81/41/1433598141.db2.gz LUCGJBZNCKTONF-KZNAEPCWSA-N 2 1 393.597 3.137 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cccc(N2CCCC2=O)c1 ZINC000246344868 1433598351 /nfs/dbraw/zinc/59/83/51/1433598351.db2.gz HCAYCTBMQMIFRV-MTNREXPMSA-N 2 1 385.552 3.232 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c(OC)c1 ZINC000246348031 1433598691 /nfs/dbraw/zinc/59/86/91/1433598691.db2.gz HKNCVUGNSMDVBV-MSOLQXFVSA-N 2 1 391.556 3.379 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c(OC)c1 ZINC000246348045 1433598772 /nfs/dbraw/zinc/59/87/72/1433598772.db2.gz HKNCVUGNSMDVBV-QZTJIDSGSA-N 2 1 391.556 3.379 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246362564 1433600446 /nfs/dbraw/zinc/60/04/46/1433600446.db2.gz NKNTVYUTAUOOGC-YSIASYRMSA-N 2 1 386.540 3.075 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C)C[C@H]1C)c1cccc(OC)c1 ZINC000246363143 1433601147 /nfs/dbraw/zinc/60/11/47/1433601147.db2.gz QGWSNBMTUZPNMS-DUXKGJEZSA-N 2 1 390.572 3.060 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CC[N@@H+](C)C[C@H]1C)c1cccc(OC)c1 ZINC000246363150 1433601208 /nfs/dbraw/zinc/60/12/08/1433601208.db2.gz QGWSNBMTUZPNMS-JRGCBEDISA-N 2 1 390.572 3.060 20 0 GGADMP O=C([C@@H]1CCC[N@H+]1Cc1ccc(F)cc1)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246368802 1433601783 /nfs/dbraw/zinc/60/17/83/1433601783.db2.gz HDTMSIQQUGJIIS-COPCDDAFSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246368802 1433601784 /nfs/dbraw/zinc/60/17/84/1433601784.db2.gz HDTMSIQQUGJIIS-COPCDDAFSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccc(F)cc1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246368802 1433601785 /nfs/dbraw/zinc/60/17/85/1433601785.db2.gz HDTMSIQQUGJIIS-COPCDDAFSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccc(F)cc1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246368802 1433601786 /nfs/dbraw/zinc/60/17/86/1433601786.db2.gz HDTMSIQQUGJIIS-COPCDDAFSA-N 2 1 385.527 3.265 20 0 GGADMP C[C@@H]1C[NH+](CCC2CCN(C(=O)[C@H](c3ccccc3)[NH+](C)C)CC2)C[C@@H](C)O1 ZINC000246383646 1433604623 /nfs/dbraw/zinc/60/46/23/1433604623.db2.gz OZPMAYSVOZGFFD-KNKQGSTJSA-N 2 1 387.568 3.027 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@@H]1CC[N@H+](C)C[C@H]1C ZINC000246389476 1433605357 /nfs/dbraw/zinc/60/53/57/1433605357.db2.gz OFTKXUMMCGMRBK-XZAAFUHCSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@H]1N(C)C(=O)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000246389476 1433605363 /nfs/dbraw/zinc/60/53/63/1433605363.db2.gz OFTKXUMMCGMRBK-XZAAFUHCSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@H]1N(C)C(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000246389476 1433605364 /nfs/dbraw/zinc/60/53/64/1433605364.db2.gz OFTKXUMMCGMRBK-XZAAFUHCSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@H]1CC[N@H+](C)C[C@@H]1C ZINC000246389456 1433605544 /nfs/dbraw/zinc/60/55/44/1433605544.db2.gz OFTKXUMMCGMRBK-WJJPVSRMSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@H]1CC[NH+](C)C[C@@H]1C ZINC000246389456 1433605545 /nfs/dbraw/zinc/60/55/45/1433605545.db2.gz OFTKXUMMCGMRBK-WJJPVSRMSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@H]1CC[NH+](C)C[C@@H]1C ZINC000246389456 1433605546 /nfs/dbraw/zinc/60/55/46/1433605546.db2.gz OFTKXUMMCGMRBK-WJJPVSRMSA-N 2 1 386.584 3.125 20 0 GGADMP O=C([C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246398621 1433607044 /nfs/dbraw/zinc/60/70/44/1433607044.db2.gz JXSCVAJKBJFJQT-XPNTWCBSSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[NH+](Cc2ccccc2)C1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246398621 1433607045 /nfs/dbraw/zinc/60/70/45/1433607045.db2.gz JXSCVAJKBJFJQT-XPNTWCBSSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[NH+](Cc2ccccc2)C1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246398621 1433607046 /nfs/dbraw/zinc/60/70/46/1433607046.db2.gz JXSCVAJKBJFJQT-XPNTWCBSSA-N 2 1 381.564 3.374 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246400268 1433607685 /nfs/dbraw/zinc/60/76/85/1433607685.db2.gz PXXJQCUFDSKHGW-SBHAEUEKSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246400268 1433607687 /nfs/dbraw/zinc/60/76/87/1433607687.db2.gz PXXJQCUFDSKHGW-SBHAEUEKSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246400268 1433607689 /nfs/dbraw/zinc/60/76/89/1433607689.db2.gz PXXJQCUFDSKHGW-SBHAEUEKSA-N 2 1 376.589 3.157 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000246403813 1433608090 /nfs/dbraw/zinc/60/80/90/1433608090.db2.gz LMZNQBXFSGYLTO-NJYVYQBISA-N 2 1 378.605 3.260 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)C1 ZINC000246403813 1433608091 /nfs/dbraw/zinc/60/80/91/1433608091.db2.gz LMZNQBXFSGYLTO-NJYVYQBISA-N 2 1 378.605 3.260 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)C1 ZINC000246403813 1433608094 /nfs/dbraw/zinc/60/80/94/1433608094.db2.gz LMZNQBXFSGYLTO-NJYVYQBISA-N 2 1 378.605 3.260 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000246415253 1433609578 /nfs/dbraw/zinc/60/95/78/1433609578.db2.gz SFVCHDVQAAXZBM-RTBURBONSA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000246415253 1433609579 /nfs/dbraw/zinc/60/95/79/1433609579.db2.gz SFVCHDVQAAXZBM-RTBURBONSA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000246415253 1433609580 /nfs/dbraw/zinc/60/95/80/1433609580.db2.gz SFVCHDVQAAXZBM-RTBURBONSA-N 2 1 392.613 3.476 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)N[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000246426074 1433610640 /nfs/dbraw/zinc/61/06/40/1433610640.db2.gz CICJOTMVSZKLLM-QMMLZNLJSA-N 2 1 381.524 3.029 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)N[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000246426074 1433610643 /nfs/dbraw/zinc/61/06/43/1433610643.db2.gz CICJOTMVSZKLLM-QMMLZNLJSA-N 2 1 381.524 3.029 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)C1 ZINC000246443650 1433613667 /nfs/dbraw/zinc/61/36/67/1433613667.db2.gz DQQHFSQPUUCFAV-HMXCVIKNSA-N 2 1 395.551 3.455 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000246443650 1433613668 /nfs/dbraw/zinc/61/36/68/1433613668.db2.gz DQQHFSQPUUCFAV-HMXCVIKNSA-N 2 1 395.551 3.455 20 0 GGADMP COCCc1nc(C)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)s1 ZINC000246466426 1433616977 /nfs/dbraw/zinc/61/69/77/1433616977.db2.gz QFQSKYLHVJGUDZ-BMGDILEWSA-N 2 1 381.586 3.059 20 0 GGADMP CN(C(=O)NCCc1ccccc1)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000246467339 1433617015 /nfs/dbraw/zinc/61/70/15/1433617015.db2.gz JIXLRLVUNGCHAG-FCHUYYIVSA-N 2 1 386.584 3.208 20 0 GGADMP CN(C1CC[NH+](C)CC1)[C@@H]1CCCC[C@H]1N(C)S(=O)(=O)CCC(C)(C)C ZINC000246467709 1433617039 /nfs/dbraw/zinc/61/70/39/1433617039.db2.gz JJKHAWPVZRRSNM-RTBURBONSA-N 2 1 387.634 3.021 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2CNC(=O)[C@@H]2CCCCCC[C@H]2[NH3+])C[C@H](C)O1 ZINC000246504766 1433622631 /nfs/dbraw/zinc/62/26/31/1433622631.db2.gz QCISIILWRCMJMY-GMQQQROESA-N 2 1 387.568 3.210 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2CNC(=O)[C@@H]2CCCCCC[C@H]2[NH3+])C[C@H](C)O1 ZINC000246504766 1433622632 /nfs/dbraw/zinc/62/26/32/1433622632.db2.gz QCISIILWRCMJMY-GMQQQROESA-N 2 1 387.568 3.210 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CCC[C@H]2C[NH+]2CCCCC2)C1 ZINC000246514414 1433623860 /nfs/dbraw/zinc/62/38/60/1433623860.db2.gz VARPKKFCXRSMPM-HBMCJLEFSA-N 2 1 378.605 3.404 20 0 GGADMP CCSCC[C@H](C)NC(=O)N(C)[C@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000246528336 1433625660 /nfs/dbraw/zinc/62/56/60/1433625660.db2.gz KXYLJIVANWYABW-SXLOBPIMSA-N 2 1 398.661 3.497 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000246529679 1433625896 /nfs/dbraw/zinc/62/58/96/1433625896.db2.gz WJJNPNLCOPUBJS-MOPGFXCFSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000246529679 1433625897 /nfs/dbraw/zinc/62/58/97/1433625897.db2.gz WJJNPNLCOPUBJS-MOPGFXCFSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000246529679 1433625898 /nfs/dbraw/zinc/62/58/98/1433625898.db2.gz WJJNPNLCOPUBJS-MOPGFXCFSA-N 2 1 392.613 3.380 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000246564448 1433631768 /nfs/dbraw/zinc/63/17/68/1433631768.db2.gz YFQZVCKKRDOWEC-GHTZIAJQSA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000246564448 1433631773 /nfs/dbraw/zinc/63/17/73/1433631773.db2.gz YFQZVCKKRDOWEC-GHTZIAJQSA-N 2 1 383.540 3.276 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CC[C@@H](C[NH+]3CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000246572796 1433633202 /nfs/dbraw/zinc/63/32/02/1433633202.db2.gz STNZSXQEGHTJMS-HJNYFJLDSA-N 2 1 384.568 3.167 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@H]1C[C@H](C)[N@@H+](C2CC2)C1 ZINC000246578454 1433634026 /nfs/dbraw/zinc/63/40/26/1433634026.db2.gz WPKOZZNRQADKBL-TYPHKJRUSA-N 2 1 384.568 3.165 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000246578454 1433634027 /nfs/dbraw/zinc/63/40/27/1433634027.db2.gz WPKOZZNRQADKBL-TYPHKJRUSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589429 1433635444 /nfs/dbraw/zinc/63/54/44/1433635444.db2.gz AZXMUHMGMBBZDO-AABGKKOBSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589429 1433635447 /nfs/dbraw/zinc/63/54/47/1433635447.db2.gz AZXMUHMGMBBZDO-AABGKKOBSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589429 1433635448 /nfs/dbraw/zinc/63/54/48/1433635448.db2.gz AZXMUHMGMBBZDO-AABGKKOBSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589429 1433635450 /nfs/dbraw/zinc/63/54/50/1433635450.db2.gz AZXMUHMGMBBZDO-AABGKKOBSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+][C@H]2CCN(CC(F)(F)F)C2=O)C1 ZINC000246696387 1433651192 /nfs/dbraw/zinc/65/11/92/1433651192.db2.gz JEPHLZYGPJKGAI-FCEWJHQRSA-N 2 1 397.485 3.417 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NC[C@H](c3cccs3)[NH+]3CCCC3)CC[C@H]21 ZINC000246710689 1433653654 /nfs/dbraw/zinc/65/36/54/1433653654.db2.gz FFDYWEHTGVGFNE-KZNAEPCWSA-N 2 1 376.570 3.011 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@]2([NH+](C)C)CCC[C@@H](C)C2)C1 ZINC000246712249 1433653674 /nfs/dbraw/zinc/65/36/74/1433653674.db2.gz HFMQZSSJMRBNGA-OPYAIIAOSA-N 2 1 375.561 3.303 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)CC1 ZINC000246755822 1433660863 /nfs/dbraw/zinc/66/08/63/1433660863.db2.gz ZTVFPEXFNHJMDL-KNQAVFIVSA-N 2 1 386.584 3.400 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246760675 1433661824 /nfs/dbraw/zinc/66/18/24/1433661824.db2.gz YCPNHNYCVPBRML-GMAHTHKFSA-N 2 1 396.579 3.093 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246760675 1433661826 /nfs/dbraw/zinc/66/18/26/1433661826.db2.gz YCPNHNYCVPBRML-GMAHTHKFSA-N 2 1 396.579 3.093 20 0 GGADMP Cn1ccnc1[C@H](O)[C@H]1CCC[N@@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)C1 ZINC000246766526 1433662754 /nfs/dbraw/zinc/66/27/54/1433662754.db2.gz PRLHEZIZJPKOSZ-LEWJYISDSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@H](O)[C@H]1CCC[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)C1 ZINC000246766526 1433662758 /nfs/dbraw/zinc/66/27/58/1433662758.db2.gz PRLHEZIZJPKOSZ-LEWJYISDSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@H](O)[C@H]1CCC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC000246766526 1433662763 /nfs/dbraw/zinc/66/27/63/1433662763.db2.gz PRLHEZIZJPKOSZ-LEWJYISDSA-N 2 1 384.568 3.324 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCN(CC(F)(F)F)C2=O)C1 ZINC000246766091 1433662801 /nfs/dbraw/zinc/66/28/01/1433662801.db2.gz OAWZEENNSAPBMA-YJBOKZPZSA-N 2 1 383.458 3.171 20 0 GGADMP C[N@@H+](CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)Cc1ccccc1 ZINC000246781017 1433665653 /nfs/dbraw/zinc/66/56/53/1433665653.db2.gz ZHMXOXPITRXBSA-RBBKRZOGSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)Cc1ccccc1 ZINC000246781017 1433665654 /nfs/dbraw/zinc/66/56/54/1433665654.db2.gz ZHMXOXPITRXBSA-RBBKRZOGSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)Cc1ccccc1 ZINC000246781017 1433665655 /nfs/dbraw/zinc/66/56/55/1433665655.db2.gz ZHMXOXPITRXBSA-RBBKRZOGSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N(CC)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000246791397 1433667801 /nfs/dbraw/zinc/66/78/01/1433667801.db2.gz JCBVULBAAAQMKP-VXKWHMMOSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N(CC)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000246791397 1433667806 /nfs/dbraw/zinc/66/78/06/1433667806.db2.gz JCBVULBAAAQMKP-VXKWHMMOSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N(CC)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000246791397 1433667810 /nfs/dbraw/zinc/66/78/10/1433667810.db2.gz JCBVULBAAAQMKP-VXKWHMMOSA-N 2 1 386.584 3.272 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@@H](C)[N@@H+]2CCC[C@H](C)C2)c1 ZINC000246835657 1433676271 /nfs/dbraw/zinc/67/62/71/1433676271.db2.gz BWSBKKBHOKGYGK-YESZJQIVSA-N 2 1 377.529 3.131 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC000246835657 1433676275 /nfs/dbraw/zinc/67/62/75/1433676275.db2.gz BWSBKKBHOKGYGK-YESZJQIVSA-N 2 1 377.529 3.131 20 0 GGADMP CN(C)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)c1ccccc1Cl ZINC000246844474 1433677139 /nfs/dbraw/zinc/67/71/39/1433677139.db2.gz KONDJOZCRMBFRG-ATZDWAIDSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1)c1ccccc1Cl ZINC000246844474 1433677142 /nfs/dbraw/zinc/67/71/42/1433677142.db2.gz KONDJOZCRMBFRG-ATZDWAIDSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)c1ccccc1Cl ZINC000246844474 1433677144 /nfs/dbraw/zinc/67/71/44/1433677144.db2.gz KONDJOZCRMBFRG-ATZDWAIDSA-N 2 1 378.948 3.068 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000246873790 1433680940 /nfs/dbraw/zinc/68/09/40/1433680940.db2.gz DOSXJKIPSMNZDW-HYBUGGRVSA-N 2 1 378.564 3.330 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000246873790 1433680941 /nfs/dbraw/zinc/68/09/41/1433680941.db2.gz DOSXJKIPSMNZDW-HYBUGGRVSA-N 2 1 378.564 3.330 20 0 GGADMP O=C(COc1ccccc1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)N1CCCC1 ZINC000246883305 1433682372 /nfs/dbraw/zinc/68/23/72/1433682372.db2.gz TUYVMWLAWLTZBF-SIKLNZKXSA-N 2 1 397.563 3.137 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NC[C@H]3CCC[NH+](Cc4cccs4)C3)CC[C@H]21 ZINC000246895017 1433684143 /nfs/dbraw/zinc/68/41/43/1433684143.db2.gz MDJNCUSCWVZLBW-QWFCFKBJSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CCC[C@@H]2CN(C(=O)NC[C@H]3CCC[N@H+](Cc4cccs4)C3)CC[C@H]21 ZINC000246895017 1433684146 /nfs/dbraw/zinc/68/41/46/1433684146.db2.gz MDJNCUSCWVZLBW-QWFCFKBJSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CCC[C@@H]2CN(C(=O)NC[C@H]3CCC[N@@H+](Cc4cccs4)C3)CC[C@H]21 ZINC000246895017 1433684148 /nfs/dbraw/zinc/68/41/48/1433684148.db2.gz MDJNCUSCWVZLBW-QWFCFKBJSA-N 2 1 390.597 3.086 20 0 GGADMP C[C@@H](C(=O)Nc1cccc2ncccc21)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000246901721 1433684922 /nfs/dbraw/zinc/68/49/22/1433684922.db2.gz JTFHTRRXKUOELO-IRXDYDNUSA-N 2 1 377.492 3.250 20 0 GGADMP C[C@@H](C(=O)Nc1cccc2ncccc21)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000246901721 1433684925 /nfs/dbraw/zinc/68/49/25/1433684925.db2.gz JTFHTRRXKUOELO-IRXDYDNUSA-N 2 1 377.492 3.250 20 0 GGADMP C[N@@H+]1CCC[C@H]2C[NH+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@H]21 ZINC000246903927 1433685027 /nfs/dbraw/zinc/68/50/27/1433685027.db2.gz GAEXGASHAYNGFB-WMLDXEAASA-N 2 1 390.325 3.138 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@H]21 ZINC000246903927 1433685031 /nfs/dbraw/zinc/68/50/31/1433685031.db2.gz GAEXGASHAYNGFB-WMLDXEAASA-N 2 1 390.325 3.138 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@H]21 ZINC000246903927 1433685034 /nfs/dbraw/zinc/68/50/34/1433685034.db2.gz GAEXGASHAYNGFB-WMLDXEAASA-N 2 1 390.325 3.138 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@H]21 ZINC000246903927 1433685036 /nfs/dbraw/zinc/68/50/36/1433685036.db2.gz GAEXGASHAYNGFB-WMLDXEAASA-N 2 1 390.325 3.138 20 0 GGADMP C[N@@H+]1CCC[C@@H]2C[NH+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@H]21 ZINC000246903889 1433685108 /nfs/dbraw/zinc/68/51/08/1433685108.db2.gz GAEXGASHAYNGFB-RHSMWYFYSA-N 2 1 390.325 3.138 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@H]21 ZINC000246903889 1433685112 /nfs/dbraw/zinc/68/51/12/1433685112.db2.gz GAEXGASHAYNGFB-RHSMWYFYSA-N 2 1 390.325 3.138 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@H]21 ZINC000246903889 1433685117 /nfs/dbraw/zinc/68/51/17/1433685117.db2.gz GAEXGASHAYNGFB-RHSMWYFYSA-N 2 1 390.325 3.138 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@H]21 ZINC000246903889 1433685120 /nfs/dbraw/zinc/68/51/20/1433685120.db2.gz GAEXGASHAYNGFB-RHSMWYFYSA-N 2 1 390.325 3.138 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1)Cc1ccccc1 ZINC000247266555 1433697957 /nfs/dbraw/zinc/69/79/57/1433697957.db2.gz RYCYZCUXZORAHA-FDFHNCONSA-N 2 1 386.584 3.065 20 0 GGADMP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+]([C@@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000247301791 1433702148 /nfs/dbraw/zinc/70/21/48/1433702148.db2.gz PDGZVPLXJFKYHP-SIKLNZKXSA-N 2 1 380.536 3.428 20 0 GGADMP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+]([C@@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000247301791 1433702152 /nfs/dbraw/zinc/70/21/52/1433702152.db2.gz PDGZVPLXJFKYHP-SIKLNZKXSA-N 2 1 380.536 3.428 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@@H](Cc2nccn2C)C1)c1ccc2c(c1)CCCC2 ZINC000247329469 1433707612 /nfs/dbraw/zinc/70/76/12/1433707612.db2.gz URGTVMBFYKKORW-OALUTQOASA-N 2 1 394.563 3.431 20 0 GGADMP C[C@H](NC(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)c1ccc2c(c1)CCCC2 ZINC000247329469 1433707619 /nfs/dbraw/zinc/70/76/19/1433707619.db2.gz URGTVMBFYKKORW-OALUTQOASA-N 2 1 394.563 3.431 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247346061 1433710696 /nfs/dbraw/zinc/71/06/96/1433710696.db2.gz XVFGTFDPJJYXAD-RNJSZURPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000247346061 1433710701 /nfs/dbraw/zinc/71/07/01/1433710701.db2.gz XVFGTFDPJJYXAD-RNJSZURPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000247346061 1433710705 /nfs/dbraw/zinc/71/07/05/1433710705.db2.gz XVFGTFDPJJYXAD-RNJSZURPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000247359241 1433712448 /nfs/dbraw/zinc/71/24/48/1433712448.db2.gz QFRRFQLFUUEDHE-QZTJIDSGSA-N 2 1 381.586 3.100 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000247359260 1433712559 /nfs/dbraw/zinc/71/25/59/1433712559.db2.gz QFRRFQLFUUEDHE-ZWKOTPCHSA-N 2 1 381.586 3.100 20 0 GGADMP CC[N@H+]1CCCC[C@H]1CNC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000247369452 1433713993 /nfs/dbraw/zinc/71/39/93/1433713993.db2.gz DWOVWULKAOEVFL-MSOLQXFVSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCCC[C@H]1CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000247369452 1433713998 /nfs/dbraw/zinc/71/39/98/1433713998.db2.gz DWOVWULKAOEVFL-MSOLQXFVSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCCC[C@H]1CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000247369452 1433714005 /nfs/dbraw/zinc/71/40/05/1433714005.db2.gz DWOVWULKAOEVFL-MSOLQXFVSA-N 2 1 378.586 3.134 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC2CC[NH+]([C@H](C)c3ccccc3)CC2)C1 ZINC000247376662 1433714869 /nfs/dbraw/zinc/71/48/69/1433714869.db2.gz PMXKPCBADFVZFO-UXHICEINSA-N 2 1 386.584 3.489 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000247379422 1433715284 /nfs/dbraw/zinc/71/52/84/1433715284.db2.gz LBIXZWIXOAMTQN-NGRWLJPCSA-N 2 1 386.584 3.315 20 0 GGADMP CC1CC[NH+](CCNC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000247415921 1433719554 /nfs/dbraw/zinc/71/95/54/1433719554.db2.gz UAKUWUTXKKRGJZ-RBBKRZOGSA-N 2 1 386.584 3.413 20 0 GGADMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CCC[C@@H](Cc3nccn3C)C2)C1 ZINC000247425545 1433721152 /nfs/dbraw/zinc/72/11/52/1433721152.db2.gz ZKVSLUDPNOFFEX-MOPGFXCFSA-N 2 1 389.588 3.285 20 0 GGADMP O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247432184 1433721358 /nfs/dbraw/zinc/72/13/58/1433721358.db2.gz WOWMRZDZTQQHJO-FCHUYYIVSA-N 2 1 384.568 3.311 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247460217 1433725072 /nfs/dbraw/zinc/72/50/72/1433725072.db2.gz UIKHWUZJHWTASA-FCEUIQTBSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247460217 1433725078 /nfs/dbraw/zinc/72/50/78/1433725078.db2.gz UIKHWUZJHWTASA-FCEUIQTBSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247460217 1433725084 /nfs/dbraw/zinc/72/50/84/1433725084.db2.gz UIKHWUZJHWTASA-FCEUIQTBSA-N 2 1 386.584 3.317 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000247471085 1433726321 /nfs/dbraw/zinc/72/63/21/1433726321.db2.gz RRJAXXSVUIZNAD-PMACEKPBSA-N 2 1 386.584 3.413 20 0 GGADMP C[NH+](C)C1(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCN2C(=O)OC(C)(C)C)CCOCC1 ZINC000247878283 1433754827 /nfs/dbraw/zinc/75/48/27/1433754827.db2.gz ZGGWOGTVWTWSDM-GUDVDZBRSA-N 2 1 395.588 3.255 20 0 GGADMP Cc1nc2c(s1)[C@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c1)CCC2 ZINC000247947634 1433758279 /nfs/dbraw/zinc/75/82/79/1433758279.db2.gz DRMXFKNOFUGEIA-RTBURBONSA-N 2 1 398.576 3.316 20 0 GGADMP CC[N@H+]1CC[C@@H](NCc2cccc(NC(=O)NCc3ccncc3)c2)[C@@H](C)C1 ZINC000247961431 1433759007 /nfs/dbraw/zinc/75/90/07/1433759007.db2.gz GHGWYXOJGHEKEY-LAUBAEHRSA-N 2 1 381.524 3.223 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2cccc(NC(=O)NCc3ccncc3)c2)[C@@H](C)C1 ZINC000247961431 1433759009 /nfs/dbraw/zinc/75/90/09/1433759009.db2.gz GHGWYXOJGHEKEY-LAUBAEHRSA-N 2 1 381.524 3.223 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3cccc(F)c3)C2=O)[C@@H](C)C1 ZINC000247963861 1433759639 /nfs/dbraw/zinc/75/96/39/1433759639.db2.gz GORMIXZGSLVEBF-YYWHXJBOSA-N 2 1 391.531 3.048 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3cccc(F)c3)C2=O)[C@@H](C)C1 ZINC000247963861 1433759646 /nfs/dbraw/zinc/75/96/46/1433759646.db2.gz GORMIXZGSLVEBF-YYWHXJBOSA-N 2 1 391.531 3.048 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC(CC[NH+]3CCCC[C@H]3C)CC2)C[N@H+]1C1CC1 ZINC000248035652 1433765090 /nfs/dbraw/zinc/76/50/90/1433765090.db2.gz RLRFSHKJOPMZBW-GGPKGHCWSA-N 2 1 376.589 3.298 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C[NH+]1C1CC1 ZINC000248035652 1433765097 /nfs/dbraw/zinc/76/50/97/1433765097.db2.gz RLRFSHKJOPMZBW-GGPKGHCWSA-N 2 1 376.589 3.298 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C[NH+]1C1CC1 ZINC000248035652 1433765102 /nfs/dbraw/zinc/76/51/02/1433765102.db2.gz RLRFSHKJOPMZBW-GGPKGHCWSA-N 2 1 376.589 3.298 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)CC[C@H]21 ZINC000248123546 1433771514 /nfs/dbraw/zinc/77/15/14/1433771514.db2.gz NRKOLQNYQBQTSG-LZQZEXGQSA-N 2 1 393.478 3.200 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H](Cc3ccccc3)C3CC3)c2)C1 ZINC000248128184 1433772367 /nfs/dbraw/zinc/77/23/67/1433772367.db2.gz ODMHNXQHLRSAKT-RPWUZVMVSA-N 2 1 391.559 3.495 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H](Cc3ccccc3)C3CC3)c2)C1 ZINC000248128183 1433772440 /nfs/dbraw/zinc/77/24/40/1433772440.db2.gz ODMHNXQHLRSAKT-DNQXCXABSA-N 2 1 391.559 3.495 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1F ZINC000248133507 1433772655 /nfs/dbraw/zinc/77/26/55/1433772655.db2.gz OTAHMXLMVZJFFK-OXJNMPFZSA-N 2 1 399.510 3.382 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1)C[NH+]1CCCC1 ZINC000248145919 1433774490 /nfs/dbraw/zinc/77/44/90/1433774490.db2.gz QDEODDGWYFNWRY-PUHATCMVSA-N 2 1 398.595 3.414 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1)[NH+](C)C1CC1 ZINC000248162680 1433776267 /nfs/dbraw/zinc/77/62/67/1433776267.db2.gz SKLQJYCYWXSXNR-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)[N@H+](C)C1CC1 ZINC000248162680 1433776268 /nfs/dbraw/zinc/77/62/68/1433776268.db2.gz SKLQJYCYWXSXNR-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)[N@@H+](C)C1CC1 ZINC000248162680 1433776269 /nfs/dbraw/zinc/77/62/69/1433776269.db2.gz SKLQJYCYWXSXNR-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248162692 1433776398 /nfs/dbraw/zinc/77/63/98/1433776398.db2.gz SKWLXUJTMAKPKK-XZOQPEGZSA-N 2 1 399.579 3.002 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000248162692 1433776403 /nfs/dbraw/zinc/77/64/03/1433776403.db2.gz SKWLXUJTMAKPKK-XZOQPEGZSA-N 2 1 399.579 3.002 20 0 GGADMP OC[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000248181430 1433778551 /nfs/dbraw/zinc/77/85/51/1433778551.db2.gz WMVWPBFRPKLSOW-UKILVPOCSA-N 2 1 393.575 3.124 20 0 GGADMP OC[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000248181430 1433778559 /nfs/dbraw/zinc/77/85/59/1433778559.db2.gz WMVWPBFRPKLSOW-UKILVPOCSA-N 2 1 393.575 3.124 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCCOc4ccccc43)c2)C1 ZINC000248202877 1433780152 /nfs/dbraw/zinc/78/01/52/1433780152.db2.gz ZFZWHEXJTSKSBC-IFMALSPDSA-N 2 1 393.531 3.387 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CCC(CC[NH+]3CCCC[C@H]3C)CC2)C1 ZINC000248230219 1433781105 /nfs/dbraw/zinc/78/11/05/1433781105.db2.gz QYCXSYDQURJWAB-TZIWHRDSSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C1 ZINC000248230219 1433781110 /nfs/dbraw/zinc/78/11/10/1433781110.db2.gz QYCXSYDQURJWAB-TZIWHRDSSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C1 ZINC000248230219 1433781115 /nfs/dbraw/zinc/78/11/15/1433781115.db2.gz QYCXSYDQURJWAB-TZIWHRDSSA-N 2 1 378.605 3.404 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@H]1CC[NH+](C2CCCCC2)C1 ZINC000248344206 1433787540 /nfs/dbraw/zinc/78/75/40/1433787540.db2.gz LHCJAISWTGHNKE-VXKWHMMOSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000248344206 1433787545 /nfs/dbraw/zinc/78/75/45/1433787545.db2.gz LHCJAISWTGHNKE-VXKWHMMOSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000248344206 1433787551 /nfs/dbraw/zinc/78/75/51/1433787551.db2.gz LHCJAISWTGHNKE-VXKWHMMOSA-N 2 1 383.580 3.322 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@H]21 ZINC000248386690 1433792348 /nfs/dbraw/zinc/79/23/48/1433792348.db2.gz NMIIGCHMYOJYOV-WIYYLYMNSA-N 2 1 383.536 3.259 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@H]21 ZINC000248386690 1433792354 /nfs/dbraw/zinc/79/23/54/1433792354.db2.gz NMIIGCHMYOJYOV-WIYYLYMNSA-N 2 1 383.536 3.259 20 0 GGADMP NC(=O)c1cccc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000248388859 1433793197 /nfs/dbraw/zinc/79/31/97/1433793197.db2.gz AGICXKDLKSHTFQ-XPWALMASSA-N 2 1 377.532 3.218 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248393247 1433794449 /nfs/dbraw/zinc/79/44/49/1433794449.db2.gz DRYPZUBVQCTVNF-SCTDSRPQSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248393247 1433794450 /nfs/dbraw/zinc/79/44/50/1433794450.db2.gz DRYPZUBVQCTVNF-SCTDSRPQSA-N 2 1 393.597 3.241 20 0 GGADMP COc1ccc(NC(=O)C[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000248396158 1433795483 /nfs/dbraw/zinc/79/54/83/1433795483.db2.gz JYGSUSNTIFIUIK-CYGODWOOSA-N 2 1 381.520 3.380 20 0 GGADMP COc1ccc(NC(=O)C[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000248396158 1433795484 /nfs/dbraw/zinc/79/54/84/1433795484.db2.gz JYGSUSNTIFIUIK-CYGODWOOSA-N 2 1 381.520 3.380 20 0 GGADMP Cc1nc2c(s1)[C@@H]([N@@H+](C)CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)CCC2 ZINC000248398317 1433796711 /nfs/dbraw/zinc/79/67/11/1433796711.db2.gz NFBBDXLDYFPIFX-RBUKOAKNSA-N 2 1 386.565 3.180 20 0 GGADMP Cc1nc2c(s1)[C@@H]([N@H+](C)CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)CCC2 ZINC000248398317 1433796718 /nfs/dbraw/zinc/79/67/18/1433796718.db2.gz NFBBDXLDYFPIFX-RBUKOAKNSA-N 2 1 386.565 3.180 20 0 GGADMP Cc1ccccc1CNC(=O)C[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000248399664 1433797079 /nfs/dbraw/zinc/79/70/79/1433797079.db2.gz PCPBLRIXEDFCGW-GZOXUSKESA-N 2 1 379.548 3.357 20 0 GGADMP Cc1ccccc1CNC(=O)C[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000248399664 1433797088 /nfs/dbraw/zinc/79/70/88/1433797088.db2.gz PCPBLRIXEDFCGW-GZOXUSKESA-N 2 1 379.548 3.357 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248399415 1433797121 /nfs/dbraw/zinc/79/71/21/1433797121.db2.gz JUXWGAOLWHMVRL-SXLOBPIMSA-N 2 1 376.589 3.203 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[NH+](CC2CCCC2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248399415 1433797123 /nfs/dbraw/zinc/79/71/23/1433797123.db2.gz JUXWGAOLWHMVRL-SXLOBPIMSA-N 2 1 376.589 3.203 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[NH+](CC2CCCC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248399415 1433797130 /nfs/dbraw/zinc/79/71/30/1433797130.db2.gz JUXWGAOLWHMVRL-SXLOBPIMSA-N 2 1 376.589 3.203 20 0 GGADMP CN(C(=O)NC1Cc2ccccc2C1)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000248400627 1433797263 /nfs/dbraw/zinc/79/72/63/1433797263.db2.gz QNILRIVDDHHPMI-XZOQPEGZSA-N 2 1 398.595 3.132 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)N1CC[NH+](C)CC1 ZINC000248402337 1433797943 /nfs/dbraw/zinc/79/79/43/1433797943.db2.gz NEWKLNRIMJIGQE-RCTAOEEJSA-N 3 1 398.639 3.149 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)N1CCN(C)CC1 ZINC000248402337 1433797946 /nfs/dbraw/zinc/79/79/46/1433797946.db2.gz NEWKLNRIMJIGQE-RCTAOEEJSA-N 2 1 398.639 3.149 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)N1CCN(C)CC1 ZINC000248402337 1433797948 /nfs/dbraw/zinc/79/79/48/1433797948.db2.gz NEWKLNRIMJIGQE-RCTAOEEJSA-N 2 1 398.639 3.149 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccc(F)cc1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248404054 1433799141 /nfs/dbraw/zinc/79/91/41/1433799141.db2.gz PORBOAVREVCTPW-DJPFJPOOSA-N 2 1 390.547 3.381 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248406880 1433799975 /nfs/dbraw/zinc/79/99/75/1433799975.db2.gz SVYJDZDBRVXSLN-IRFCIJBXSA-N 2 1 376.589 3.299 20 0 GGADMP OCCOc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248408320 1433800113 /nfs/dbraw/zinc/80/01/13/1433800113.db2.gz VKBXVYYEZYCPIP-DNVJHFABSA-N 2 1 380.532 3.448 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000248411114 1433800384 /nfs/dbraw/zinc/80/03/84/1433800384.db2.gz YTOCVRUREQPYNL-LNLFQRSKSA-N 2 1 393.597 3.241 20 0 GGADMP CO[C@]1(C)C[C@H]([NH+](C)CC2(C[N@H+](C)[C@@H]3C[C@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000248417680 1433801027 /nfs/dbraw/zinc/80/10/27/1433801027.db2.gz JSMLUQMHMHVNHK-MTIDIVMFSA-N 2 1 396.616 3.274 20 0 GGADMP CO[C@]1(C)C[C@H]([N@@H+](C)CC2(C[NH+](C)[C@@H]3C[C@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000248417680 1433801028 /nfs/dbraw/zinc/80/10/28/1433801028.db2.gz JSMLUQMHMHVNHK-MTIDIVMFSA-N 2 1 396.616 3.274 20 0 GGADMP CO[C@]1(C)C[C@H]([N@H+](C)CC2(C[NH+](C)[C@@H]3C[C@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000248417680 1433801029 /nfs/dbraw/zinc/80/10/29/1433801029.db2.gz JSMLUQMHMHVNHK-MTIDIVMFSA-N 2 1 396.616 3.274 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc2c(c1)OCCCO2 ZINC000248430238 1433802065 /nfs/dbraw/zinc/80/20/65/1433802065.db2.gz BNJZKCNXLAWCRQ-DYESRHJHSA-N 2 1 382.504 3.265 20 0 GGADMP CCO[C@@H]1C[C@@H]([N@@H+](C)CC2(C[NH+](C)[C@H]3C[C@@H](OCC)C3(C)C)COC2)C1(C)C ZINC000248450576 1433803630 /nfs/dbraw/zinc/80/36/30/1433803630.db2.gz YCWJVJTZZDJGQY-IYWMVGAKSA-N 2 1 396.616 3.274 20 0 GGADMP CCO[C@@H]1C[C@@H]([NH+](C)CC2(C[N@H+](C)[C@H]3C[C@@H](OCC)C3(C)C)COC2)C1(C)C ZINC000248450576 1433803632 /nfs/dbraw/zinc/80/36/32/1433803632.db2.gz YCWJVJTZZDJGQY-IYWMVGAKSA-N 2 1 396.616 3.274 20 0 GGADMP CCO[C@@H]1C[C@@H]([NH+](C)CC2(C[N@@H+](C)[C@H]3C[C@@H](OCC)C3(C)C)COC2)C1(C)C ZINC000248450576 1433803633 /nfs/dbraw/zinc/80/36/33/1433803633.db2.gz YCWJVJTZZDJGQY-IYWMVGAKSA-N 2 1 396.616 3.274 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(-n2ccnc2)cc1 ZINC000248453048 1433803934 /nfs/dbraw/zinc/80/39/34/1433803934.db2.gz QGLUALXMFYLDRM-WZONZLPQSA-N 2 1 376.504 3.290 20 0 GGADMP COc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1OC ZINC000248457325 1433804266 /nfs/dbraw/zinc/80/42/66/1433804266.db2.gz SXIPFLQPDNZNDH-FXAWDEMLSA-N 2 1 384.520 3.430 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000248471012 1433805268 /nfs/dbraw/zinc/80/52/68/1433805268.db2.gz VMQMKTVBIYIECV-IEZWGBDMSA-N 2 1 398.469 3.394 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000248471012 1433805269 /nfs/dbraw/zinc/80/52/69/1433805269.db2.gz VMQMKTVBIYIECV-IEZWGBDMSA-N 2 1 398.469 3.394 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000248471012 1433805272 /nfs/dbraw/zinc/80/52/72/1433805272.db2.gz VMQMKTVBIYIECV-IEZWGBDMSA-N 2 1 398.469 3.394 20 0 GGADMP CS(=O)(=O)CCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248582396 1433809620 /nfs/dbraw/zinc/80/96/20/1433809620.db2.gz WHDGZAYVKWPSPA-NJDAHSKKSA-N 2 1 378.582 3.092 20 0 GGADMP CS(=O)(=O)CCCCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248582401 1433809736 /nfs/dbraw/zinc/80/97/36/1433809736.db2.gz WHDGZAYVKWPSPA-PWRODBHTSA-N 2 1 378.582 3.092 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000248592024 1433810166 /nfs/dbraw/zinc/81/01/66/1433810166.db2.gz YZTVOGMCENJSLZ-HNAYVOBHSA-N 2 1 396.938 3.208 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NC[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000248592024 1433810167 /nfs/dbraw/zinc/81/01/67/1433810167.db2.gz YZTVOGMCENJSLZ-HNAYVOBHSA-N 2 1 396.938 3.208 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000248592024 1433810168 /nfs/dbraw/zinc/81/01/68/1433810168.db2.gz YZTVOGMCENJSLZ-HNAYVOBHSA-N 2 1 396.938 3.208 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248595488 1433810233 /nfs/dbraw/zinc/81/02/33/1433810233.db2.gz SQLBZNULBPBDNJ-AABGKKOBSA-N 2 1 387.568 3.121 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000248595488 1433810234 /nfs/dbraw/zinc/81/02/34/1433810234.db2.gz SQLBZNULBPBDNJ-AABGKKOBSA-N 2 1 387.568 3.121 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248595488 1433810235 /nfs/dbraw/zinc/81/02/35/1433810235.db2.gz SQLBZNULBPBDNJ-AABGKKOBSA-N 2 1 387.568 3.121 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@H]1CCCc2sccc21 ZINC000248697706 1433815911 /nfs/dbraw/zinc/81/59/11/1433815911.db2.gz DWHPLMGEFJTLFD-AEFFLSMTSA-N 2 1 378.586 3.183 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 ZINC000248707759 1433816366 /nfs/dbraw/zinc/81/63/66/1433816366.db2.gz IBTPXJLTSRPOOM-DEICHXMPSA-N 2 1 383.458 3.125 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000248722597 1433817620 /nfs/dbraw/zinc/81/76/20/1433817620.db2.gz CMDCDSRXKPBIQC-FCEUIQTBSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000248722585 1433817745 /nfs/dbraw/zinc/81/77/45/1433817745.db2.gz CMDCDSRXKPBIQC-BAGYTPMASA-N 2 1 384.568 3.167 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000248726775 1433817909 /nfs/dbraw/zinc/81/79/09/1433817909.db2.gz IINXCDVZRAPBAX-YADHBBJMSA-N 2 1 384.568 3.168 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC[C@@H]21 ZINC000248735178 1433818625 /nfs/dbraw/zinc/81/86/25/1433818625.db2.gz QPYVFGDBPOMXSA-HFTRVMKXSA-N 2 1 381.442 3.227 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000248742438 1433819249 /nfs/dbraw/zinc/81/92/49/1433819249.db2.gz RJPVOMSOMYBZJA-YSGRDPCXSA-N 2 1 376.932 3.143 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248773467 1433821729 /nfs/dbraw/zinc/82/17/29/1433821729.db2.gz TYUSMPZDYXCXCP-NHCUHLMSSA-N 2 1 396.535 3.238 20 0 GGADMP C[C@H](NC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248791607 1433822808 /nfs/dbraw/zinc/82/28/08/1433822808.db2.gz XTZYYOYXBKROAK-NNWRFLSQSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248791607 1433822810 /nfs/dbraw/zinc/82/28/10/1433822810.db2.gz XTZYYOYXBKROAK-NNWRFLSQSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248791607 1433822811 /nfs/dbraw/zinc/82/28/11/1433822811.db2.gz XTZYYOYXBKROAK-NNWRFLSQSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248826559 1433824362 /nfs/dbraw/zinc/82/43/62/1433824362.db2.gz MAMXYBSDHDYKRR-SQVLJLFZSA-N 2 1 398.595 3.459 20 0 GGADMP C[C@H](NC(=O)N[C@H]1C[NH+](Cc2ccccc2)C[C@H]1C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248826559 1433824364 /nfs/dbraw/zinc/82/43/64/1433824364.db2.gz MAMXYBSDHDYKRR-SQVLJLFZSA-N 2 1 398.595 3.459 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248826566 1433824380 /nfs/dbraw/zinc/82/43/80/1433824380.db2.gz MAMXYBSDHDYKRR-URLVKDPJSA-N 2 1 398.595 3.459 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1C[NH+](Cc2ccccc2)C[C@H]1C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248826566 1433824382 /nfs/dbraw/zinc/82/43/82/1433824382.db2.gz MAMXYBSDHDYKRR-URLVKDPJSA-N 2 1 398.595 3.459 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NC[C@H]1C[NH+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000248830717 1433824559 /nfs/dbraw/zinc/82/45/59/1433824559.db2.gz LMMXCNJJAMRMSU-XZOQPEGZSA-N 2 1 395.547 3.087 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000248830717 1433824560 /nfs/dbraw/zinc/82/45/60/1433824560.db2.gz LMMXCNJJAMRMSU-XZOQPEGZSA-N 2 1 395.547 3.087 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000248830717 1433824562 /nfs/dbraw/zinc/82/45/62/1433824562.db2.gz LMMXCNJJAMRMSU-XZOQPEGZSA-N 2 1 395.547 3.087 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248829354 1433824598 /nfs/dbraw/zinc/82/45/98/1433824598.db2.gz DTQOMZKAPRVFAQ-KIFXHHALSA-N 2 1 378.564 3.404 20 0 GGADMP CCOC(=O)C1CCC(O)(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)CC1 ZINC000248833032 1433824785 /nfs/dbraw/zinc/82/47/85/1433824785.db2.gz MJLODTVIBUGZMX-KQLGTBKOSA-N 2 1 380.573 3.057 20 0 GGADMP CCOC(=O)C1CCC(O)(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)CC1 ZINC000248833032 1433824786 /nfs/dbraw/zinc/82/47/86/1433824786.db2.gz MJLODTVIBUGZMX-KQLGTBKOSA-N 2 1 380.573 3.057 20 0 GGADMP CCOC(=O)C1CCC(O)(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)CC1 ZINC000248833032 1433824789 /nfs/dbraw/zinc/82/47/89/1433824789.db2.gz MJLODTVIBUGZMX-KQLGTBKOSA-N 2 1 380.573 3.057 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000248932734 1433829742 /nfs/dbraw/zinc/82/97/42/1433829742.db2.gz XZXMNKVCDZTIAM-XMSQKQJNSA-N 2 1 380.536 3.068 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCn1cnc2ccccc2c1=O ZINC000248940555 1433829953 /nfs/dbraw/zinc/82/99/53/1433829953.db2.gz COJAFZDZUPBNAQ-MOJGAOKDSA-N 2 1 390.531 3.143 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[C@@H](C)C1 ZINC000248944964 1433830183 /nfs/dbraw/zinc/83/01/83/1433830183.db2.gz DHDHMFYNKQJYMP-HUUJSLGLSA-N 2 1 387.568 3.079 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[C@@H](C)C1 ZINC000248944964 1433830184 /nfs/dbraw/zinc/83/01/84/1433830184.db2.gz DHDHMFYNKQJYMP-HUUJSLGLSA-N 2 1 387.568 3.079 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccccc2CC)[C@H](C)C1 ZINC000248957003 1433830636 /nfs/dbraw/zinc/83/06/36/1433830636.db2.gz FYCZMQRYCFHFGU-GGPKGHCWSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccccc2CC)[C@H](C)C1 ZINC000248957003 1433830637 /nfs/dbraw/zinc/83/06/37/1433830637.db2.gz FYCZMQRYCFHFGU-GGPKGHCWSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(=O)oc3cc(OC)ccc23)[C@@H](C)C1 ZINC000248965085 1433830948 /nfs/dbraw/zinc/83/09/48/1433830948.db2.gz HBSWMUQLZFFHQC-JXFKEZNVSA-N 2 1 388.508 3.028 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(=O)oc3cc(OC)ccc23)[C@@H](C)C1 ZINC000248965085 1433830949 /nfs/dbraw/zinc/83/09/49/1433830949.db2.gz HBSWMUQLZFFHQC-JXFKEZNVSA-N 2 1 388.508 3.028 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000249013744 1433832209 /nfs/dbraw/zinc/83/22/09/1433832209.db2.gz PCLYHVPACWTUNX-FSSWDIPSSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000249013744 1433832210 /nfs/dbraw/zinc/83/22/10/1433832210.db2.gz PCLYHVPACWTUNX-FSSWDIPSSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000249013744 1433832211 /nfs/dbraw/zinc/83/22/11/1433832211.db2.gz PCLYHVPACWTUNX-FSSWDIPSSA-N 2 1 386.584 3.269 20 0 GGADMP Cc1cc(C)c(N2CC[C@@H]([N@@H+]3CCC[C@@H](Cc4[nH+]ccn4C)C3)C2=O)c(C)c1 ZINC000249059122 1433833565 /nfs/dbraw/zinc/83/35/65/1433833565.db2.gz JGNOSLMWTSWSJE-VQTJNVASSA-N 2 1 380.536 3.405 20 0 GGADMP Cc1cc(C)c(N2CC[C@@H]([N@H+]3CCC[C@@H](Cc4[nH+]ccn4C)C3)C2=O)c(C)c1 ZINC000249059122 1433833567 /nfs/dbraw/zinc/83/35/67/1433833567.db2.gz JGNOSLMWTSWSJE-VQTJNVASSA-N 2 1 380.536 3.405 20 0 GGADMP C[C@@H](C[N@@H+]1CCC[C@H](C)C1)[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000249181889 1433838338 /nfs/dbraw/zinc/83/83/38/1433838338.db2.gz INFBWLKACDACCB-YXWAVELNSA-N 2 1 383.536 3.304 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000249181889 1433838339 /nfs/dbraw/zinc/83/83/39/1433838339.db2.gz INFBWLKACDACCB-YXWAVELNSA-N 2 1 383.536 3.304 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)CC1([NH+](C)C)CCC1 ZINC000249196433 1433838665 /nfs/dbraw/zinc/83/86/65/1433838665.db2.gz RETVWOJPXDEKSK-KXTWHKPSSA-N 2 1 386.584 3.269 20 0 GGADMP CCN(C(=O)NC[C@H]1CCC[NH+](C(C)C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249373825 1433841831 /nfs/dbraw/zinc/84/18/31/1433841831.db2.gz XLPVVYYVVUICMS-FGZHOGPDSA-N 2 1 386.584 3.413 20 0 GGADMP CCN(C(=O)NC[C@H]1CCC[N@@H+](C(C)C)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000249373825 1433841833 /nfs/dbraw/zinc/84/18/33/1433841833.db2.gz XLPVVYYVVUICMS-FGZHOGPDSA-N 2 1 386.584 3.413 20 0 GGADMP CCN(C(=O)NC[C@H]1CCC[N@H+](C(C)C)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000249373825 1433841834 /nfs/dbraw/zinc/84/18/34/1433841834.db2.gz XLPVVYYVVUICMS-FGZHOGPDSA-N 2 1 386.584 3.413 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccc(C)c(C)c2)[C@H](C)C1 ZINC000249406993 1433842977 /nfs/dbraw/zinc/84/29/77/1433842977.db2.gz DJOBNRZJBGPCNU-SJBKTWHCSA-N 2 1 389.584 3.207 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccc(C)c(C)c2)[C@H](C)C1 ZINC000249406993 1433842978 /nfs/dbraw/zinc/84/29/78/1433842978.db2.gz DJOBNRZJBGPCNU-SJBKTWHCSA-N 2 1 389.584 3.207 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2c(C)cccc2C)[C@H](C)C1 ZINC000249419139 1433843416 /nfs/dbraw/zinc/84/34/16/1433843416.db2.gz HFOZFFUSFLZDPF-AQNXPRMDSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2c(C)cccc2C)[C@H](C)C1 ZINC000249419139 1433843417 /nfs/dbraw/zinc/84/34/17/1433843417.db2.gz HFOZFFUSFLZDPF-AQNXPRMDSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2c(C)cccc2C)[C@@H](C)C1 ZINC000249419145 1433843491 /nfs/dbraw/zinc/84/34/91/1433843491.db2.gz HFOZFFUSFLZDPF-ZCNNSNEGSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2c(C)cccc2C)[C@@H](C)C1 ZINC000249419145 1433843492 /nfs/dbraw/zinc/84/34/92/1433843492.db2.gz HFOZFFUSFLZDPF-ZCNNSNEGSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)c(F)c2)[C@@H](C)C1 ZINC000249458243 1433844204 /nfs/dbraw/zinc/84/42/04/1433844204.db2.gz QEEFNRNNUIUDEC-ZWOKBUDYSA-N 2 1 379.520 3.188 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)c(F)c2)[C@@H](C)C1 ZINC000249458243 1433844205 /nfs/dbraw/zinc/84/42/05/1433844205.db2.gz QEEFNRNNUIUDEC-ZWOKBUDYSA-N 2 1 379.520 3.188 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)cc2C)[C@@H](C)C1 ZINC000249479601 1433844724 /nfs/dbraw/zinc/84/47/24/1433844724.db2.gz WNXYUOILIWNNPG-ZVDOUQERSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)cc2C)[C@@H](C)C1 ZINC000249479601 1433844725 /nfs/dbraw/zinc/84/47/25/1433844725.db2.gz WNXYUOILIWNNPG-ZVDOUQERSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCC(=O)N[C@H](C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000249486536 1433844822 /nfs/dbraw/zinc/84/48/22/1433844822.db2.gz UNJXKVAVGONJTE-HLIPFELVSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000249486536 1433844823 /nfs/dbraw/zinc/84/48/23/1433844823.db2.gz UNJXKVAVGONJTE-HLIPFELVSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000249486536 1433844824 /nfs/dbraw/zinc/84/48/24/1433844824.db2.gz UNJXKVAVGONJTE-HLIPFELVSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(SC)cc2)[C@@H](C)C1 ZINC000249490516 1433844967 /nfs/dbraw/zinc/84/49/67/1433844967.db2.gz VCZXWKNVEMSBBS-QKLQHJQFSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(SC)cc2)[C@@H](C)C1 ZINC000249490516 1433844968 /nfs/dbraw/zinc/84/49/68/1433844968.db2.gz VCZXWKNVEMSBBS-QKLQHJQFSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H](C)c2ccccc2C)[C@@H](C)C1 ZINC000249493293 1433844993 /nfs/dbraw/zinc/84/49/93/1433844993.db2.gz VSBICHTVFQGCMJ-KEZQHZCBSA-N 2 1 389.584 3.287 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H](C)c2ccccc2C)[C@@H](C)C1 ZINC000249493293 1433844994 /nfs/dbraw/zinc/84/49/94/1433844994.db2.gz VSBICHTVFQGCMJ-KEZQHZCBSA-N 2 1 389.584 3.287 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(SC)cc2)[C@H](C)C1 ZINC000249490512 1433845040 /nfs/dbraw/zinc/84/50/40/1433845040.db2.gz VCZXWKNVEMSBBS-HLIPFELVSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(SC)cc2)[C@H](C)C1 ZINC000249490512 1433845041 /nfs/dbraw/zinc/84/50/41/1433845041.db2.gz VCZXWKNVEMSBBS-HLIPFELVSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H](C)c2ccccc2C)[C@H](C)C1 ZINC000249493288 1433845061 /nfs/dbraw/zinc/84/50/61/1433845061.db2.gz VSBICHTVFQGCMJ-DYQZNNLLSA-N 2 1 389.584 3.287 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H](C)c2ccccc2C)[C@H](C)C1 ZINC000249493288 1433845062 /nfs/dbraw/zinc/84/50/62/1433845062.db2.gz VSBICHTVFQGCMJ-DYQZNNLLSA-N 2 1 389.584 3.287 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@H](C)c2ccccc2C)[C@H](C)C1 ZINC000249493295 1433845075 /nfs/dbraw/zinc/84/50/75/1433845075.db2.gz VSBICHTVFQGCMJ-VMBXEPDQSA-N 2 1 389.584 3.287 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@H](C)c2ccccc2C)[C@H](C)C1 ZINC000249493295 1433845076 /nfs/dbraw/zinc/84/50/76/1433845076.db2.gz VSBICHTVFQGCMJ-VMBXEPDQSA-N 2 1 389.584 3.287 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)C1CCS(=O)(=O)CC1 ZINC000249527618 1433846429 /nfs/dbraw/zinc/84/64/29/1433846429.db2.gz ADVAKCONGOINCR-ZWKOTPCHSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)C1CCS(=O)(=O)CC1 ZINC000249527616 1433846468 /nfs/dbraw/zinc/84/64/68/1433846468.db2.gz ADVAKCONGOINCR-QZTJIDSGSA-N 2 1 378.582 3.364 20 0 GGADMP CCn1nccc1N1CCC[C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)C1=O ZINC000249655044 1433848631 /nfs/dbraw/zinc/84/86/31/1433848631.db2.gz VEGIQPPRTINBLU-HOJAQTOUSA-N 2 1 387.572 3.031 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)C1 ZINC000249742123 1433850714 /nfs/dbraw/zinc/85/07/14/1433850714.db2.gz JPNAMZPVVOAQAW-GUDVDZBRSA-N 2 1 388.556 3.149 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)C(=O)NC(=O)NC(C)(C)C ZINC000249747027 1433850834 /nfs/dbraw/zinc/85/08/34/1433850834.db2.gz DEWDWVOXLQNHOS-IAGOWNOFSA-N 2 1 388.556 3.021 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000249755385 1433851129 /nfs/dbraw/zinc/85/11/29/1433851129.db2.gz CTBOBKKOLOMHEL-ROUUACIJSA-N 2 1 376.545 3.006 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)C(=O)NCC(F)(F)F ZINC000249763264 1433851395 /nfs/dbraw/zinc/85/13/95/1433851395.db2.gz OHYGJWHRKISWQB-OWCLPIDISA-N 2 1 385.474 3.321 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@@H](C)C2)C1 ZINC000249760436 1433851447 /nfs/dbraw/zinc/85/14/47/1433851447.db2.gz XMWFWASRSKPACX-WOJBJXKFSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000249760436 1433851448 /nfs/dbraw/zinc/85/14/48/1433851448.db2.gz XMWFWASRSKPACX-WOJBJXKFSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000249760436 1433851449 /nfs/dbraw/zinc/85/14/49/1433851449.db2.gz XMWFWASRSKPACX-WOJBJXKFSA-N 2 1 386.584 3.450 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)C1CCS(=O)(=O)CC1 ZINC000249784977 1433852097 /nfs/dbraw/zinc/85/20/97/1433852097.db2.gz DIIQLTRNTISGQI-QZTJIDSGSA-N 2 1 378.582 3.221 20 0 GGADMP CC(C)[C@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000249802181 1433852318 /nfs/dbraw/zinc/85/23/18/1433852318.db2.gz DFRZOJLNLMRAQZ-WOIUINJBSA-N 2 1 387.568 3.032 20 0 GGADMP CC(C)[C@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000249802192 1433852325 /nfs/dbraw/zinc/85/23/25/1433852325.db2.gz DFRZOJLNLMRAQZ-XQBPLPMBSA-N 2 1 387.568 3.032 20 0 GGADMP CC(C)[C@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000249802192 1433852327 /nfs/dbraw/zinc/85/23/27/1433852327.db2.gz DFRZOJLNLMRAQZ-XQBPLPMBSA-N 2 1 387.568 3.032 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@@H](c2nccs2)C1 ZINC000249902384 1433853589 /nfs/dbraw/zinc/85/35/89/1433853589.db2.gz UBYZFMMKLYUOFJ-RLLQIKCJSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@H](c2nccs2)C1 ZINC000249902384 1433853590 /nfs/dbraw/zinc/85/35/90/1433853590.db2.gz UBYZFMMKLYUOFJ-RLLQIKCJSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000249902384 1433853591 /nfs/dbraw/zinc/85/35/91/1433853591.db2.gz UBYZFMMKLYUOFJ-RLLQIKCJSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@H](c2nccs2)C1 ZINC000249902384 1433853592 /nfs/dbraw/zinc/85/35/92/1433853592.db2.gz UBYZFMMKLYUOFJ-RLLQIKCJSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)C1CCSCC1 ZINC000250084362 1433854314 /nfs/dbraw/zinc/85/43/14/1433854314.db2.gz PMSGVHBNTZJYFB-OXJNMPFZSA-N 2 1 375.582 3.005 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)C1CCS(=O)(=O)CC1 ZINC000250120877 1433854602 /nfs/dbraw/zinc/85/46/02/1433854602.db2.gz VGESIBAHMISDCQ-QZTJIDSGSA-N 2 1 378.582 3.221 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000250282137 1433855435 /nfs/dbraw/zinc/85/54/35/1433855435.db2.gz GNXLLESVOBTQCL-IFMALSPDSA-N 2 1 390.568 3.017 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[N@@H+]1CCC[C@H](C)C1 ZINC000250575636 1433856893 /nfs/dbraw/zinc/85/68/93/1433856893.db2.gz ZHTAVFZFSKKHPQ-ZWKOTPCHSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[N@H+]1CCC[C@H](C)C1 ZINC000250575636 1433856895 /nfs/dbraw/zinc/85/68/95/1433856895.db2.gz ZHTAVFZFSKKHPQ-ZWKOTPCHSA-N 2 1 390.597 3.477 20 0 GGADMP O=C(N[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000250658157 1433857110 /nfs/dbraw/zinc/85/71/10/1433857110.db2.gz XJUXHTDWBKZYLH-GMAHTHKFSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(N[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000250658157 1433857112 /nfs/dbraw/zinc/85/71/12/1433857112.db2.gz XJUXHTDWBKZYLH-GMAHTHKFSA-N 2 1 395.522 3.428 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)N1CCC[C@H]2C[NH+](C)CC[C@H]21)C1CC1 ZINC000251496107 1433858394 /nfs/dbraw/zinc/85/83/94/1433858394.db2.gz DLNKWTBPDROILM-BDTNDASRSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21)C1CC1 ZINC000251496107 1433858395 /nfs/dbraw/zinc/85/83/95/1433858395.db2.gz DLNKWTBPDROILM-BDTNDASRSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21)C1CC1 ZINC000251496107 1433858397 /nfs/dbraw/zinc/85/83/97/1433858397.db2.gz DLNKWTBPDROILM-BDTNDASRSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](C)C[C@@H]1CCN(C(=O)NC[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)C1 ZINC000251545744 1433858808 /nfs/dbraw/zinc/85/88/08/1433858808.db2.gz GURZXWGTIDHHJU-ZSZQSSIHSA-N 2 1 396.938 3.065 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000251573966 1433859129 /nfs/dbraw/zinc/85/91/29/1433859129.db2.gz VDWVQZYKVMACDS-WTIAFYNJSA-N 2 1 392.547 3.396 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@@H](NC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000251573966 1433859130 /nfs/dbraw/zinc/85/91/30/1433859130.db2.gz VDWVQZYKVMACDS-WTIAFYNJSA-N 2 1 392.547 3.396 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@@H](NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000251573966 1433859131 /nfs/dbraw/zinc/85/91/31/1433859131.db2.gz VDWVQZYKVMACDS-WTIAFYNJSA-N 2 1 392.547 3.396 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000251770415 1433860358 /nfs/dbraw/zinc/86/03/58/1433860358.db2.gz FAEOBWNZRWUXKB-HSALFYBXSA-N 2 1 390.572 3.474 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)C1 ZINC000252209550 1433862858 /nfs/dbraw/zinc/86/28/58/1433862858.db2.gz XUPFXQPNAVFHTK-SJBKTWHCSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC000252209550 1433862859 /nfs/dbraw/zinc/86/28/59/1433862859.db2.gz XUPFXQPNAVFHTK-SJBKTWHCSA-N 2 1 386.584 3.443 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653565 1433863876 /nfs/dbraw/zinc/86/38/76/1433863876.db2.gz ZLQDCYGNJFTEIX-AUSIDOKSSA-N 2 1 392.547 3.200 20 0 GGADMP C[N@@H+]1CCC[C@@H]2C[NH+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653565 1433863877 /nfs/dbraw/zinc/86/38/77/1433863877.db2.gz ZLQDCYGNJFTEIX-AUSIDOKSSA-N 2 1 392.547 3.200 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653565 1433863878 /nfs/dbraw/zinc/86/38/78/1433863878.db2.gz ZLQDCYGNJFTEIX-AUSIDOKSSA-N 2 1 392.547 3.200 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653565 1433863879 /nfs/dbraw/zinc/86/38/79/1433863879.db2.gz ZLQDCYGNJFTEIX-AUSIDOKSSA-N 2 1 392.547 3.200 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653565 1433863881 /nfs/dbraw/zinc/86/38/81/1433863881.db2.gz ZLQDCYGNJFTEIX-AUSIDOKSSA-N 2 1 392.547 3.200 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653566 1433863922 /nfs/dbraw/zinc/86/39/22/1433863922.db2.gz ZLQDCYGNJFTEIX-WMZHIEFXSA-N 2 1 392.547 3.200 20 0 GGADMP C[N@@H+]1CCC[C@H]2C[NH+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653566 1433863923 /nfs/dbraw/zinc/86/39/23/1433863923.db2.gz ZLQDCYGNJFTEIX-WMZHIEFXSA-N 2 1 392.547 3.200 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653566 1433863925 /nfs/dbraw/zinc/86/39/25/1433863925.db2.gz ZLQDCYGNJFTEIX-WMZHIEFXSA-N 2 1 392.547 3.200 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653566 1433863926 /nfs/dbraw/zinc/86/39/26/1433863926.db2.gz ZLQDCYGNJFTEIX-WMZHIEFXSA-N 2 1 392.547 3.200 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@H]21 ZINC000252653566 1433863928 /nfs/dbraw/zinc/86/39/28/1433863928.db2.gz ZLQDCYGNJFTEIX-WMZHIEFXSA-N 2 1 392.547 3.200 20 0 GGADMP COc1ccc([C@H](NC(=O)CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C2CC2)cc1 ZINC000252692330 1433864177 /nfs/dbraw/zinc/86/41/77/1433864177.db2.gz BERGFCZHMSMTTQ-WNOPAQSVSA-N 2 1 397.563 3.211 20 0 GGADMP COc1ccc([C@H](NC(=O)CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C2CC2)cc1 ZINC000252692329 1433864189 /nfs/dbraw/zinc/86/41/89/1433864189.db2.gz BERGFCZHMSMTTQ-NGYIFUPDSA-N 2 1 397.563 3.211 20 0 GGADMP C[C@H](Nc1cccc(C[N@H+]2CCC[C@H]2C(N)=O)c1)c1ccc(-n2ccnc2)cc1 ZINC000252734312 1433864419 /nfs/dbraw/zinc/86/44/19/1433864419.db2.gz GTDZLJHQWHOPHZ-JTSKRJEESA-N 2 1 389.503 3.495 20 0 GGADMP C[C@H](Nc1cccc(CN2CCC[C@H]2C(N)=O)c1)c1ccc(-n2ccnc2)cc1 ZINC000252734312 1433864421 /nfs/dbraw/zinc/86/44/21/1433864421.db2.gz GTDZLJHQWHOPHZ-JTSKRJEESA-N 2 1 389.503 3.495 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cccc(C)c2C)[C@H](C)C1 ZINC000253296059 1433865583 /nfs/dbraw/zinc/86/55/83/1433865583.db2.gz NXLTYZDSJUQFTR-RLLQIKCJSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cccc(C)c2C)[C@H](C)C1 ZINC000253296059 1433865584 /nfs/dbraw/zinc/86/55/84/1433865584.db2.gz NXLTYZDSJUQFTR-RLLQIKCJSA-N 2 1 375.557 3.357 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[NH+](C)C/C=C\C[N@H+](C)[C@@H]1CCCc2c1cnn2C ZINC000255207397 1433878447 /nfs/dbraw/zinc/87/84/47/1433878447.db2.gz WGQRGNZXPRNQHK-SBUVDCAVSA-N 2 1 382.556 3.028 20 0 GGADMP C[NH+]1CCN(C/C=C\CN2CC[N@H+](C)CC23CCCCC3)C2(CCCCC2)C1 ZINC000255815621 1433889792 /nfs/dbraw/zinc/88/97/92/1433889792.db2.gz SSPYSMRXBVUJTQ-KTKRTIGZSA-N 2 1 388.644 3.443 20 0 GGADMP CC[C@H](CNC(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1)[NH+]1CCc2ccccc2C1 ZINC000261479708 1433896804 /nfs/dbraw/zinc/89/68/04/1433896804.db2.gz ZXVYQMWRAZYYNP-NHCUHLMSSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@H](CNC(=O)N[C@@H]1CC[NH+](C2CCCC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000261479708 1433896805 /nfs/dbraw/zinc/89/68/05/1433896805.db2.gz ZXVYQMWRAZYYNP-NHCUHLMSSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@H](CNC(=O)N[C@@H]1CC[NH+](C2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000261479708 1433896806 /nfs/dbraw/zinc/89/68/06/1433896806.db2.gz ZXVYQMWRAZYYNP-NHCUHLMSSA-N 2 1 384.568 3.139 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1)[C@H]1CCC[NH2+]1 ZINC000261649447 1433898157 /nfs/dbraw/zinc/89/81/57/1433898157.db2.gz ALFJVIKHNRWAFG-NFBKMPQASA-N 2 1 377.532 3.434 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1)[C@H]1CCC[NH2+]1 ZINC000261649452 1433898217 /nfs/dbraw/zinc/89/82/17/1433898217.db2.gz ALFJVIKHNRWAFG-NZQKXSOJSA-N 2 1 377.532 3.434 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+](Cc2csc(C3CCCCC3)n2)C1)[C@@H]1CCC[NH2+]1 ZINC000261651444 1433898279 /nfs/dbraw/zinc/89/82/79/1433898279.db2.gz ALIANANPSCHRST-APWZRJJASA-N 2 1 390.597 3.271 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2csc(C3CCCCC3)n2)C1)[C@@H]1CCC[NH2+]1 ZINC000261651444 1433898281 /nfs/dbraw/zinc/89/82/81/1433898281.db2.gz ALIANANPSCHRST-APWZRJJASA-N 2 1 390.597 3.271 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+](Cc2csc(C3CCCCC3)n2)C1)[C@H]1CCC[NH2+]1 ZINC000261651456 1433898376 /nfs/dbraw/zinc/89/83/76/1433898376.db2.gz ALIANANPSCHRST-VQIMIIECSA-N 2 1 390.597 3.271 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2csc(C3CCCCC3)n2)C1)[C@H]1CCC[NH2+]1 ZINC000261651456 1433898377 /nfs/dbraw/zinc/89/83/77/1433898377.db2.gz ALIANANPSCHRST-VQIMIIECSA-N 2 1 390.597 3.271 20 0 GGADMP CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000261743216 1433901004 /nfs/dbraw/zinc/90/10/04/1433901004.db2.gz PIHVZFMQAHTIPE-DEOSSOPVSA-N 2 1 395.547 3.285 20 0 GGADMP CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)C[N@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000261743216 1433901012 /nfs/dbraw/zinc/90/10/12/1433901012.db2.gz PIHVZFMQAHTIPE-DEOSSOPVSA-N 2 1 395.547 3.285 20 0 GGADMP O=C(CC[C@@H]1CC[NH2+]C1)NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000261779001 1433903306 /nfs/dbraw/zinc/90/33/06/1433903306.db2.gz AUYOGRGMPQZZDP-YLJYHZDGSA-N 2 1 383.561 3.353 20 0 GGADMP O=C(CC[C@@H]1CC[NH2+]C1)NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000261779001 1433903312 /nfs/dbraw/zinc/90/33/12/1433903312.db2.gz AUYOGRGMPQZZDP-YLJYHZDGSA-N 2 1 383.561 3.353 20 0 GGADMP Cc1cc(OCC[N@H+]2CCC[C@H](CNC(=O)[C@H]3CCC[NH2+]3)C2)ccc1C(C)C ZINC000261794639 1433904472 /nfs/dbraw/zinc/90/44/72/1433904472.db2.gz ILWVOICRHXMTCN-DENIHFKCSA-N 2 1 387.568 3.077 20 0 GGADMP O=C(CC[C@@H]1CC[NH2+]C1)N1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000261877557 1433909109 /nfs/dbraw/zinc/90/91/09/1433909109.db2.gz SLBSGMVHCARWNN-MRXNPFEDSA-N 2 1 383.458 3.129 20 0 GGADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000261880037 1433909489 /nfs/dbraw/zinc/90/94/89/1433909489.db2.gz PAYJAYBBDAIQEG-VKJFTORMSA-N 2 1 383.458 3.347 20 0 GGADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000261880034 1433909691 /nfs/dbraw/zinc/90/96/91/1433909691.db2.gz PAYJAYBBDAIQEG-RVKKMQEKSA-N 2 1 383.458 3.347 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2ccccc2OC)cc1)C1CC1 ZINC000261974881 1433918161 /nfs/dbraw/zinc/91/81/61/1433918161.db2.gz NNKYAMFIOUZVPT-JOCHJYFZSA-N 2 1 393.531 3.466 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2ccccc2OC)cc1)C1CC1 ZINC000261974881 1433918165 /nfs/dbraw/zinc/91/81/65/1433918165.db2.gz NNKYAMFIOUZVPT-JOCHJYFZSA-N 2 1 393.531 3.466 20 0 GGADMP [NH3+]CCC(=O)NC[C@H]1CCCC[N@@H+]1Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000261998067 1433920812 /nfs/dbraw/zinc/92/08/12/1433920812.db2.gz KZEKJJPQIOCSSJ-OAHLLOKOSA-N 2 1 398.532 3.376 20 0 GGADMP [NH3+]CCC(=O)NC[C@H]1CCCC[N@H+]1Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000261998067 1433920813 /nfs/dbraw/zinc/92/08/13/1433920813.db2.gz KZEKJJPQIOCSSJ-OAHLLOKOSA-N 2 1 398.532 3.376 20 0 GGADMP Brc1cccc(-c2c[nH]c(C[N@H+]3CCC4(C3)CC[NH2+]CC4)n2)c1 ZINC000262040980 1433924148 /nfs/dbraw/zinc/92/41/48/1433924148.db2.gz PBPAYEWQJXIGJJ-UHFFFAOYSA-N 2 1 375.314 3.415 20 0 GGADMP Cc1cc(C[N@H+]2CCCC[C@H]2CNC(=O)CC[NH3+])ccc1Oc1cccnc1 ZINC000262043242 1433924213 /nfs/dbraw/zinc/92/42/13/1433924213.db2.gz PJPFURHKKWPUPP-IBGZPJMESA-N 2 1 382.508 3.002 20 0 GGADMP CCOc1cc(C[N@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)ccc1OCc1ccccc1 ZINC000262117768 1433927594 /nfs/dbraw/zinc/92/75/94/1433927594.db2.gz LPALATUONXVYEV-JOCHJYFZSA-N 2 1 395.547 3.144 20 0 GGADMP CCOc1cc(C[N@H+]2CC[C@H](N3CC[NH2+]CC3)C2)ccc1OCc1ccccc1 ZINC000262117771 1433927600 /nfs/dbraw/zinc/92/76/00/1433927600.db2.gz LPALATUONXVYEV-QFIPXVFZSA-N 2 1 395.547 3.144 20 0 GGADMP O=C(Nc1cccc(C[N@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)c1)c1ccc(Cl)cc1 ZINC000262136792 1433928268 /nfs/dbraw/zinc/92/82/68/1433928268.db2.gz OTZLQYCYZAXSGH-OAQYLSRUSA-N 2 1 398.938 3.072 20 0 GGADMP [NH3+]C[C@@H]1CN(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C[C@H]1c1ccccc1 ZINC000262212117 1433930840 /nfs/dbraw/zinc/93/08/40/1433930840.db2.gz LSBBPSXLWUSSHC-XPNTWCBSSA-N 2 1 395.522 3.239 20 0 GGADMP [NH3+]C[C@@H]1CN(C(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C[C@H]1c1ccccc1 ZINC000262212116 1433930910 /nfs/dbraw/zinc/93/09/10/1433930910.db2.gz LSBBPSXLWUSSHC-XJUOHMSHSA-N 2 1 395.522 3.239 20 0 GGADMP [NH3+][C@@H]1CN(C(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000262223718 1433931431 /nfs/dbraw/zinc/93/14/31/1433931431.db2.gz MZEAXKRUKOSRAZ-BHDDXSALSA-N 2 1 381.495 3.134 20 0 GGADMP [NH3+][C@@H]1CN(C(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000262223718 1433931436 /nfs/dbraw/zinc/93/14/36/1433931436.db2.gz MZEAXKRUKOSRAZ-BHDDXSALSA-N 2 1 381.495 3.134 20 0 GGADMP CC1(C)C[N@H+](C2(CNC(=O)C3C[C@H]4CCC[C@@H](C3)C4[NH3+])CCCCC2)CCO1 ZINC000262291181 1433933736 /nfs/dbraw/zinc/93/37/36/1433933736.db2.gz MYUYTHBQOUTVOL-VCWRXUFXSA-N 2 1 391.600 3.070 20 0 GGADMP C[C@H]1C[C@@H](C(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CC[NH2+]1 ZINC000262328675 1433935407 /nfs/dbraw/zinc/93/54/07/1433935407.db2.gz DPEFOLFYFFXIAD-RDJZCZTQSA-N 2 1 383.458 3.128 20 0 GGADMP COCC1(C(=O)NCc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH2+]CC1 ZINC000262421065 1433938430 /nfs/dbraw/zinc/93/84/30/1433938430.db2.gz VAGVUIWWGBWKBE-UHFFFAOYSA-N 2 1 387.568 3.084 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N(CCC[NH3+])Cc3ccccc3)cc2)C[C@@H](C)O1 ZINC000262492343 1433941372 /nfs/dbraw/zinc/94/13/72/1433941372.db2.gz VIDVBQJYVALHPC-WOJBJXKFSA-N 2 1 395.547 3.287 20 0 GGADMP [NH3+][C@H](CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000262585101 1433944780 /nfs/dbraw/zinc/94/47/80/1433944780.db2.gz OEKQPZIVZZAXLI-QUCCMNQESA-N 2 1 391.437 3.257 20 0 GGADMP O=C(CC1C[C@H]2CC[C@@H](C1)[NH2+]2)N[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000262658103 1433948572 /nfs/dbraw/zinc/94/85/72/1433948572.db2.gz DIBWTKDAURQULH-DQXYTYHJSA-N 2 1 395.469 3.317 20 0 GGADMP [NH3+]C1(C(=O)Nc2ccc(C[NH+]3CCN(Cc4ccccc4)CC3)cc2)CCCC1 ZINC000262688434 1433950176 /nfs/dbraw/zinc/95/01/76/1433950176.db2.gz ZHHBVADBQYOUHU-UHFFFAOYSA-N 2 1 392.547 3.214 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1(C)C ZINC000262762679 1433954282 /nfs/dbraw/zinc/95/42/82/1433954282.db2.gz DSGHPKFOJDVBST-LLBVYWAGSA-N 2 1 387.568 3.067 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1(C)C ZINC000262762683 1433954347 /nfs/dbraw/zinc/95/43/47/1433954347.db2.gz DSGHPKFOJDVBST-XTQVGHSUSA-N 2 1 387.568 3.067 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1(C)C ZINC000262761805 1433954452 /nfs/dbraw/zinc/95/44/52/1433954452.db2.gz DNEIPCUEABEYTG-YPIYEQTHSA-N 2 1 387.568 3.030 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)NCc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)C1(C)C ZINC000262816465 1433958531 /nfs/dbraw/zinc/95/85/31/1433958531.db2.gz WWJKYRHKIMRFMD-WGGBDISSSA-N 2 1 387.568 3.210 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)NCc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)C1(C)C ZINC000262816458 1433958620 /nfs/dbraw/zinc/95/86/20/1433958620.db2.gz WWJKYRHKIMRFMD-HCLVMJGWSA-N 2 1 387.568 3.210 20 0 GGADMP Cc1ccc(NC(=O)[C@H]2CCCC[C@@]2(C)[NH3+])cc1NC(=O)C[NH+]1CCCCC1 ZINC000263246699 1433998111 /nfs/dbraw/zinc/99/81/11/1433998111.db2.gz PJZDXAUYRBBELI-XMSQKQJNSA-N 2 1 386.540 3.266 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC([NH+]2CCCCC2)CC1 ZINC000264217284 1434083348 /nfs/dbraw/zinc/08/33/48/1434083348.db2.gz STLQBDUYEVGUFX-QFIPXVFZSA-N 2 1 398.595 3.211 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCSCC1)N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000264447121 1434113933 /nfs/dbraw/zinc/11/39/33/1434113933.db2.gz FVSHUGATOVLUNU-LJQANCHMSA-N 2 1 388.581 3.328 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)cc1F ZINC000264623418 1434136015 /nfs/dbraw/zinc/13/60/15/1434136015.db2.gz SASAWQCMQMVJEY-GOSISDBHSA-N 2 1 385.487 3.090 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)NCCCC[NH+]2CCN(CC)CC2)cc1 ZINC000265147026 1434190417 /nfs/dbraw/zinc/19/04/17/1434190417.db2.gz XNVLLLJJHUUBOY-UHFFFAOYSA-N 2 1 388.600 3.066 20 0 GGADMP CCC[N@H+](CC)Cc1ccc(C(=O)NCCCCN2CC[NH+](CC)CC2)cc1 ZINC000265147026 1434190418 /nfs/dbraw/zinc/19/04/18/1434190418.db2.gz XNVLLLJJHUUBOY-UHFFFAOYSA-N 2 1 388.600 3.066 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)NCCCCN2CC[NH+](CC)CC2)cc1 ZINC000265147026 1434190419 /nfs/dbraw/zinc/19/04/19/1434190419.db2.gz XNVLLLJJHUUBOY-UHFFFAOYSA-N 2 1 388.600 3.066 20 0 GGADMP COCC[N@H+]1CC[C@H](NC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)C1 ZINC000265428214 1434233352 /nfs/dbraw/zinc/23/33/52/1434233352.db2.gz UGWCCQLKMVNPRI-IBGZPJMESA-N 2 1 388.556 3.293 20 0 GGADMP COCC[NH+]1CC[C@H](NC(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)C1 ZINC000265428214 1434233356 /nfs/dbraw/zinc/23/33/56/1434233356.db2.gz UGWCCQLKMVNPRI-IBGZPJMESA-N 2 1 388.556 3.293 20 0 GGADMP COCC[NH+]1CC[C@H](NC(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)C1 ZINC000265428214 1434233358 /nfs/dbraw/zinc/23/33/58/1434233358.db2.gz UGWCCQLKMVNPRI-IBGZPJMESA-N 2 1 388.556 3.293 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCCCCC[NH+]2CCCC2)cn1 ZINC000267053365 1434403449 /nfs/dbraw/zinc/40/34/49/1434403449.db2.gz BUNOTXOPBRLNAC-UHFFFAOYSA-N 2 1 398.555 3.421 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4c3cccc4F)c2)C1 ZINC000267078593 1434406036 /nfs/dbraw/zinc/40/60/36/1434406036.db2.gz UNPPQRIRBSDWRF-PGRDOPGGSA-N 2 1 381.495 3.300 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CCC(OCCC[NH+](C)C)CC2)cc1)C(C)C ZINC000267270356 1434418263 /nfs/dbraw/zinc/41/82/63/1434418263.db2.gz PSZCYKJZJBLMKZ-UHFFFAOYSA-N 2 1 389.584 3.490 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)N2CCC(OCCC[NH+](C)C)CC2)cc1 ZINC000267302645 1434421017 /nfs/dbraw/zinc/42/10/17/1434421017.db2.gz YBYRBZKDNGTIGZ-UHFFFAOYSA-N 2 1 389.584 3.491 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000267308590 1434421428 /nfs/dbraw/zinc/42/14/28/1434421428.db2.gz BSPHVOOSTRSVKO-NQIIRXRSSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000267308590 1434421430 /nfs/dbraw/zinc/42/14/30/1434421430.db2.gz BSPHVOOSTRSVKO-NQIIRXRSSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000267308587 1434421490 /nfs/dbraw/zinc/42/14/90/1434421490.db2.gz BSPHVOOSTRSVKO-GHTZIAJQSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000267308587 1434421492 /nfs/dbraw/zinc/42/14/92/1434421492.db2.gz BSPHVOOSTRSVKO-GHTZIAJQSA-N 2 1 383.540 3.182 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NC2CCN(c3cc(C)[nH+]c(C)n3)CC2)cc1 ZINC000267342631 1434424182 /nfs/dbraw/zinc/42/41/82/1434424182.db2.gz IKDMQAGVJLUKNH-UHFFFAOYSA-N 2 1 395.551 3.334 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000267426053 1434431558 /nfs/dbraw/zinc/43/15/58/1434431558.db2.gz QLPOHZMHMXLVGP-BAGYTPMASA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000267426053 1434431560 /nfs/dbraw/zinc/43/15/60/1434431560.db2.gz QLPOHZMHMXLVGP-BAGYTPMASA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000267426053 1434431563 /nfs/dbraw/zinc/43/15/63/1434431563.db2.gz QLPOHZMHMXLVGP-BAGYTPMASA-N 2 1 386.584 3.270 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000267426054 1434431600 /nfs/dbraw/zinc/43/16/00/1434431600.db2.gz QLPOHZMHMXLVGP-BVSLBCMMSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000267426054 1434431602 /nfs/dbraw/zinc/43/16/02/1434431602.db2.gz QLPOHZMHMXLVGP-BVSLBCMMSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000267426054 1434431604 /nfs/dbraw/zinc/43/16/04/1434431604.db2.gz QLPOHZMHMXLVGP-BVSLBCMMSA-N 2 1 386.584 3.270 20 0 GGADMP CCc1ncc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)s1 ZINC000267653531 1434453069 /nfs/dbraw/zinc/45/30/69/1434453069.db2.gz VFTBUKDMIFZVLC-UHFFFAOYSA-N 2 1 389.565 3.485 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(NS(C)(=O)=O)cc2)cc1 ZINC000267965987 1434481974 /nfs/dbraw/zinc/48/19/74/1434481974.db2.gz YVBGXKAFDKMSIN-HNNXBMFYSA-N 2 1 384.505 3.403 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)[C@H](C)C3)cn2)CCO1 ZINC000268761548 1434554009 /nfs/dbraw/zinc/55/40/09/1434554009.db2.gz HMEDEIIUMSAQMP-VIZSFHNOSA-N 2 1 394.563 3.449 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+][C@H]3CC[N@@H+](Cc4ccccc4)[C@H](C)C3)cn2)CCO1 ZINC000268761548 1434554011 /nfs/dbraw/zinc/55/40/11/1434554011.db2.gz HMEDEIIUMSAQMP-VIZSFHNOSA-N 2 1 394.563 3.449 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000268770896 1434555345 /nfs/dbraw/zinc/55/53/45/1434555345.db2.gz SLCGIONEMPONKH-ZPMCFJSWSA-N 2 1 384.520 3.237 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Cn3cncn3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000268775916 1434555882 /nfs/dbraw/zinc/55/58/82/1434555882.db2.gz VVJFGFBGSGUKAL-CVDCTZTESA-N 2 1 375.520 3.469 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Cn3cncn3)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268775916 1434555887 /nfs/dbraw/zinc/55/58/87/1434555887.db2.gz VVJFGFBGSGUKAL-CVDCTZTESA-N 2 1 375.520 3.469 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(CS(C)(=O)=O)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000268808196 1434559572 /nfs/dbraw/zinc/55/95/72/1434559572.db2.gz SOYPJNAJKSEPDP-AVRDEDQJSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(CS(C)(=O)=O)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268808196 1434559577 /nfs/dbraw/zinc/55/95/77/1434559577.db2.gz SOYPJNAJKSEPDP-AVRDEDQJSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000268808433 1434559810 /nfs/dbraw/zinc/55/98/10/1434559810.db2.gz LMMSHKOKQOVHQC-NZQKXSOJSA-N 3 1 384.612 3.188 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000268808433 1434559812 /nfs/dbraw/zinc/55/98/12/1434559812.db2.gz LMMSHKOKQOVHQC-NZQKXSOJSA-N 3 1 384.612 3.188 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2ccc(OC)c(Cn3cccn3)c2)CC1 ZINC000268826586 1434561624 /nfs/dbraw/zinc/56/16/24/1434561624.db2.gz PRLPIOWRHIWTNL-HXUWFJFHSA-N 2 1 399.583 3.008 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(NS(C)(=O)=O)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268839550 1434563138 /nfs/dbraw/zinc/56/31/38/1434563138.db2.gz QMSRHMPWNJLMAT-DYESRHJHSA-N 2 1 387.549 3.201 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc(CS(C)(=O)=O)c2)CC[N@@H+]1Cc1ccccc1 ZINC000268850761 1434564611 /nfs/dbraw/zinc/56/46/11/1434564611.db2.gz XVWGBTCKFZSICC-XMSQKQJNSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc(CS(C)(=O)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000268850761 1434564614 /nfs/dbraw/zinc/56/46/14/1434564614.db2.gz XVWGBTCKFZSICC-XMSQKQJNSA-N 2 1 386.561 3.374 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000268899336 1434569028 /nfs/dbraw/zinc/56/90/28/1434569028.db2.gz OJCLOFZCWXHHRO-KRWDZBQOSA-N 2 1 392.569 3.353 20 0 GGADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3ccnc(OC4CCOCC4)c3)CC2)cc1 ZINC000268910695 1434570345 /nfs/dbraw/zinc/57/03/45/1434570345.db2.gz SLZFNBDTJUOZEI-UHFFFAOYSA-N 2 1 395.547 3.436 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)cc1 ZINC000268921074 1434571274 /nfs/dbraw/zinc/57/12/74/1434571274.db2.gz QEIJHDLSKDYIDW-GOSISDBHSA-N 2 1 389.588 3.141 20 0 GGADMP CN(C)C(=O)[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000268959305 1434575753 /nfs/dbraw/zinc/57/57/53/1434575753.db2.gz XFSRRBINUZQYRA-GHTZIAJQSA-N 2 1 375.532 3.069 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000268997135 1434579611 /nfs/dbraw/zinc/57/96/11/1434579611.db2.gz KTIZEMKIOPLXFU-KRWDZBQOSA-N 2 1 393.597 3.385 20 0 GGADMP OC[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000268997066 1434579688 /nfs/dbraw/zinc/57/96/88/1434579688.db2.gz NWOYNMRBKNQJNZ-ZJSXRUAMSA-N 2 1 379.548 3.128 20 0 GGADMP OC[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000268997066 1434579691 /nfs/dbraw/zinc/57/96/91/1434579691.db2.gz NWOYNMRBKNQJNZ-ZJSXRUAMSA-N 2 1 379.548 3.128 20 0 GGADMP Cc1ccc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000269230319 1434610531 /nfs/dbraw/zinc/61/05/31/1434610531.db2.gz CJWRCVDNFISCDT-DSKINZAPSA-N 2 1 398.551 3.279 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C[NH3+])c2ccccc2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000269265748 1434615403 /nfs/dbraw/zinc/61/54/03/1434615403.db2.gz ZDEGZABCQJOQHG-HXUWFJFHSA-N 2 1 394.519 3.100 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2ccc3c(ccn3CCC[NH3+])c2)C1 ZINC000269269033 1434615822 /nfs/dbraw/zinc/61/58/22/1434615822.db2.gz QUTRWAZLWSPTTK-IBGZPJMESA-N 2 1 379.508 3.226 20 0 GGADMP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000269704636 1434670863 /nfs/dbraw/zinc/67/08/63/1434670863.db2.gz QJYSRBCGWRDHGF-GMAHTHKFSA-N 2 1 381.564 3.374 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1 ZINC000269713541 1434671364 /nfs/dbraw/zinc/67/13/64/1434671364.db2.gz QXLJFEKEILEKTH-ZWKOTPCHSA-N 2 1 380.492 3.169 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H]3CCc4c3c(F)ccc4F)c2)C1 ZINC000269884648 1434684173 /nfs/dbraw/zinc/68/41/73/1434684173.db2.gz ZVTGHAMHOLDKRD-DYESRHJHSA-N 2 1 399.485 3.439 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4c3c(F)ccc4F)c2)C1 ZINC000269884648 1434684175 /nfs/dbraw/zinc/68/41/75/1434684175.db2.gz ZVTGHAMHOLDKRD-DYESRHJHSA-N 2 1 399.485 3.439 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000270218335 1434714133 /nfs/dbraw/zinc/71/41/33/1434714133.db2.gz MILVXRMHOKWMJA-UEVCKROQSA-N 2 1 398.595 3.270 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000270246449 1434716165 /nfs/dbraw/zinc/71/61/65/1434716165.db2.gz PWOVBONSOKNCRI-WTIAFYNJSA-N 2 1 398.595 3.413 20 0 GGADMP CC[N@H+](Cc1ccncc1)[C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000270963656 1434791450 /nfs/dbraw/zinc/79/14/50/1434791450.db2.gz ARVDPWBUFLLGLT-LJQANCHMSA-N 2 1 380.536 3.073 20 0 GGADMP CC[N@@H+](Cc1ccncc1)[C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000270963656 1434791452 /nfs/dbraw/zinc/79/14/52/1434791452.db2.gz ARVDPWBUFLLGLT-LJQANCHMSA-N 2 1 380.536 3.073 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cscn1 ZINC000271184646 1434806831 /nfs/dbraw/zinc/80/68/31/1434806831.db2.gz WMWJFDBOHFTZHW-INIZCTEOSA-N 2 1 375.538 3.484 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1cscn1 ZINC000271184646 1434806832 /nfs/dbraw/zinc/80/68/32/1434806832.db2.gz WMWJFDBOHFTZHW-INIZCTEOSA-N 2 1 375.538 3.484 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000271476207 1434827979 /nfs/dbraw/zinc/82/79/79/1434827979.db2.gz MRKGRZAMXLCWPW-XLIONFOSSA-N 2 1 383.561 3.133 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000271476207 1434827982 /nfs/dbraw/zinc/82/79/82/1434827982.db2.gz MRKGRZAMXLCWPW-XLIONFOSSA-N 2 1 383.561 3.133 20 0 GGADMP Cc1c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cnn1-c1ccc(F)cc1 ZINC000271503971 1434830075 /nfs/dbraw/zinc/83/00/75/1434830075.db2.gz MKTZCFZZOZPMFY-UZQPLGKSSA-N 2 1 386.515 3.348 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc(C(=O)OC)o2)cc1OC ZINC000271800870 1434851499 /nfs/dbraw/zinc/85/14/99/1434851499.db2.gz BWRZFWFRXCSLBJ-UHFFFAOYSA-N 2 1 390.480 3.085 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)NCC2=CC[NH+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000271869186 1434855930 /nfs/dbraw/zinc/85/59/30/1434855930.db2.gz JRGJDCALBQMGMB-VQIMIIECSA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)NCC2=CC[N@H+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000271869186 1434855932 /nfs/dbraw/zinc/85/59/32/1434855932.db2.gz JRGJDCALBQMGMB-VQIMIIECSA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)NCC2=CC[N@@H+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000271869186 1434855933 /nfs/dbraw/zinc/85/59/33/1434855933.db2.gz JRGJDCALBQMGMB-VQIMIIECSA-N 2 1 394.922 3.033 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)NCC2=CC[NH+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000271869183 1434855969 /nfs/dbraw/zinc/85/59/69/1434855969.db2.gz JRGJDCALBQMGMB-QFBILLFUSA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+]1CC[C@@H](CNC(=O)NCC2=CC[N@H+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000271869183 1434855972 /nfs/dbraw/zinc/85/59/72/1434855972.db2.gz JRGJDCALBQMGMB-QFBILLFUSA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+]1CC[C@@H](CNC(=O)NCC2=CC[N@@H+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000271869183 1434855973 /nfs/dbraw/zinc/85/59/73/1434855973.db2.gz JRGJDCALBQMGMB-QFBILLFUSA-N 2 1 394.922 3.033 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)NCC2=CC[NH+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000271869180 1434856024 /nfs/dbraw/zinc/85/60/24/1434856024.db2.gz JRGJDCALBQMGMB-LPHOPBHVSA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+]1CC[C@@H](CNC(=O)NCC2=CC[N@H+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000271869180 1434856026 /nfs/dbraw/zinc/85/60/26/1434856026.db2.gz JRGJDCALBQMGMB-LPHOPBHVSA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+]1CC[C@@H](CNC(=O)NCC2=CC[N@@H+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000271869180 1434856027 /nfs/dbraw/zinc/85/60/27/1434856027.db2.gz JRGJDCALBQMGMB-LPHOPBHVSA-N 2 1 394.922 3.033 20 0 GGADMP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NCC2=CC[N@@H+](C)CC2)cc1 ZINC000272126162 1434873800 /nfs/dbraw/zinc/87/38/00/1434873800.db2.gz VDOSRTBCROLXLG-UHFFFAOYSA-N 2 1 392.547 3.476 20 0 GGADMP C[C@H]([NH2+][C@H]1CCCN(CC(F)(F)F)C1=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272160667 1434875508 /nfs/dbraw/zinc/87/55/08/1434875508.db2.gz DMBSQJVDVIMLFY-JQHSSLGASA-N 2 1 383.458 3.040 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H]([NH+]2CCCCC2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272305630 1434885762 /nfs/dbraw/zinc/88/57/62/1434885762.db2.gz JTFAGWACWDNWID-BVSLBCMMSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H]([NH2+]C1CCN(C(=O)c2ccoc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272307550 1434885874 /nfs/dbraw/zinc/88/58/74/1434885874.db2.gz IDQGIOIDJWCVLW-QUCCMNQESA-N 2 1 381.520 3.384 20 0 GGADMP C[C@@H]([NH2+]C1CCN(C(=O)c2ccoc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272307553 1434885931 /nfs/dbraw/zinc/88/59/31/1434885931.db2.gz IDQGIOIDJWCVLW-UYAOXDASSA-N 2 1 381.520 3.384 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1ccco1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272341706 1434888578 /nfs/dbraw/zinc/88/85/78/1434888578.db2.gz BWTFKUSJKVNJHX-CTNGQTDRSA-N 2 1 398.551 3.263 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272394415 1434893394 /nfs/dbraw/zinc/89/33/94/1434893394.db2.gz WMELEKPTZBBDGO-DBXWQHBBSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272394415 1434893395 /nfs/dbraw/zinc/89/33/95/1434893395.db2.gz WMELEKPTZBBDGO-DBXWQHBBSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272394429 1434893427 /nfs/dbraw/zinc/89/34/27/1434893427.db2.gz WMELEKPTZBBDGO-OPYAIIAOSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272394429 1434893428 /nfs/dbraw/zinc/89/34/28/1434893428.db2.gz WMELEKPTZBBDGO-OPYAIIAOSA-N 2 1 383.540 3.037 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H]2C[C@@H](NC(=O)OC(C)(C)C)c3ccccc32)CC1 ZINC000272508462 1434901921 /nfs/dbraw/zinc/90/19/21/1434901921.db2.gz FWEYALOVFFIKFP-VQTJNVASSA-N 2 1 389.540 3.398 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000272553212 1434906965 /nfs/dbraw/zinc/90/69/65/1434906965.db2.gz SWTQIEULIJWCBK-LQBOVUBWSA-N 2 1 384.520 3.237 20 0 GGADMP C[C@H](c1ccc(NC(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)cc1)[NH+]1CCOCC1 ZINC000272564738 1434908336 /nfs/dbraw/zinc/90/83/36/1434908336.db2.gz KHBGWIYSMHSEGE-QZTJIDSGSA-N 2 1 388.556 3.274 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[NH+](C)C[C@H]21 ZINC000272610117 1434914803 /nfs/dbraw/zinc/91/48/03/1434914803.db2.gz RPDDLYXGGRGKBJ-XMSQKQJNSA-N 2 1 396.535 3.147 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[NH+](C)C[C@H]21 ZINC000272610117 1434914806 /nfs/dbraw/zinc/91/48/06/1434914806.db2.gz RPDDLYXGGRGKBJ-XMSQKQJNSA-N 2 1 396.535 3.147 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[N@H+](C)C[C@H]21 ZINC000272610117 1434914809 /nfs/dbraw/zinc/91/48/09/1434914809.db2.gz RPDDLYXGGRGKBJ-XMSQKQJNSA-N 2 1 396.535 3.147 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[N@@H+](C)C[C@H]21 ZINC000272610117 1434914812 /nfs/dbraw/zinc/91/48/12/1434914812.db2.gz RPDDLYXGGRGKBJ-XMSQKQJNSA-N 2 1 396.535 3.147 20 0 GGADMP C[C@@H](NC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1)C1=CC[NH+](C)CC1 ZINC000272650662 1434919630 /nfs/dbraw/zinc/91/96/30/1434919630.db2.gz AOULGMCKRWWWAB-LJQANCHMSA-N 2 1 384.568 3.190 20 0 GGADMP C[C@@H](NC(=O)N1CCC(C[NH+](C)Cc2ccccc2)CC1)C1=CC[N@H+](C)CC1 ZINC000272650662 1434919631 /nfs/dbraw/zinc/91/96/31/1434919631.db2.gz AOULGMCKRWWWAB-LJQANCHMSA-N 2 1 384.568 3.190 20 0 GGADMP C[C@@H](NC(=O)N1CCC(C[NH+](C)Cc2ccccc2)CC1)C1=CC[N@@H+](C)CC1 ZINC000272650662 1434919632 /nfs/dbraw/zinc/91/96/32/1434919632.db2.gz AOULGMCKRWWWAB-LJQANCHMSA-N 2 1 384.568 3.190 20 0 GGADMP C[C@H]([NH2+]C1CCN(C(=O)c2ccncc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272659471 1434920390 /nfs/dbraw/zinc/92/03/90/1434920390.db2.gz MPKDFGIKIDMJAL-SIKLNZKXSA-N 2 1 392.547 3.186 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(Cn2cncn2)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272668507 1434921226 /nfs/dbraw/zinc/92/12/26/1434921226.db2.gz OSHQSZFYVHHGTR-AUSIDOKSSA-N 2 1 375.520 3.327 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCN(c4nccs4)CC3)c2)CCO1 ZINC000272739099 1434927193 /nfs/dbraw/zinc/92/71/93/1434927193.db2.gz QMCSAFFNTCTXEO-KRWDZBQOSA-N 2 1 386.565 3.122 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCN(c4nccs4)CC3)c2)CCO1 ZINC000272739099 1434927195 /nfs/dbraw/zinc/92/71/95/1434927195.db2.gz QMCSAFFNTCTXEO-KRWDZBQOSA-N 2 1 386.565 3.122 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(-n2cccn2)cc1 ZINC000272794025 1434931477 /nfs/dbraw/zinc/93/14/77/1434931477.db2.gz YAEIIKGCTRRMOR-FDDCHVKYSA-N 2 1 376.504 3.290 20 0 GGADMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]C1CCN(c2ccccc2)CC1 ZINC000272794232 1434931489 /nfs/dbraw/zinc/93/14/89/1434931489.db2.gz YICIHTWMAIFITJ-XMMPIXPASA-N 2 1 379.548 3.402 20 0 GGADMP C[C@H](NC1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272837631 1434935063 /nfs/dbraw/zinc/93/50/63/1434935063.db2.gz QUKWBPMHLISRJB-IVGWJTKZSA-N 2 1 385.596 3.255 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272837631 1434935066 /nfs/dbraw/zinc/93/50/66/1434935066.db2.gz QUKWBPMHLISRJB-IVGWJTKZSA-N 3 1 385.596 3.255 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272837631 1434935069 /nfs/dbraw/zinc/93/50/69/1434935069.db2.gz QUKWBPMHLISRJB-IVGWJTKZSA-N 3 1 385.596 3.255 20 0 GGADMP CC(C)[NH+]1CCN(C2CC[NH+](Cc3cc(Cl)cc4c3OCC4)CC2)CC1 ZINC000272841849 1434935285 /nfs/dbraw/zinc/93/52/85/1434935285.db2.gz JPOHCJISCOQFGQ-UHFFFAOYSA-N 2 1 377.960 3.265 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272846137 1434935649 /nfs/dbraw/zinc/93/56/49/1434935649.db2.gz SWOBNNIWAXVZIA-LPHOPBHVSA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000272846137 1434935650 /nfs/dbraw/zinc/93/56/50/1434935650.db2.gz SWOBNNIWAXVZIA-LPHOPBHVSA-N 2 1 396.539 3.028 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]C3CCN(c4nccs4)CC3)CC2)oc1C ZINC000272910498 1434940410 /nfs/dbraw/zinc/94/04/10/1434940410.db2.gz QPZXQNVKXIXERO-UHFFFAOYSA-N 2 1 389.569 3.219 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H](Cc1ccc(F)cc1)C(N)=O ZINC000272943977 1434942798 /nfs/dbraw/zinc/94/27/98/1434942798.db2.gz CMQAJZPXJLWIPF-JOCHJYFZSA-N 2 1 395.478 3.237 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1)C1=CC[NH+](C)CC1 ZINC000272963371 1434944808 /nfs/dbraw/zinc/94/48/08/1434944808.db2.gz NRGXXKXVEKXJSB-PMOQBDJRSA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)C1=CC[N@H+](C)CC1 ZINC000272963371 1434944809 /nfs/dbraw/zinc/94/48/09/1434944809.db2.gz NRGXXKXVEKXJSB-PMOQBDJRSA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)C1=CC[N@@H+](C)CC1 ZINC000272963371 1434944811 /nfs/dbraw/zinc/94/48/11/1434944811.db2.gz NRGXXKXVEKXJSB-PMOQBDJRSA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)C1=CC[NH+](C)CC1 ZINC000273000283 1434948529 /nfs/dbraw/zinc/94/85/29/1434948529.db2.gz RDGMFJMIANUKDP-JXFKEZNVSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@H](NC(=O)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)C1=CC[N@H+](C)CC1 ZINC000273000283 1434948532 /nfs/dbraw/zinc/94/85/32/1434948532.db2.gz RDGMFJMIANUKDP-JXFKEZNVSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@H](NC(=O)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)C1=CC[N@@H+](C)CC1 ZINC000273000283 1434948533 /nfs/dbraw/zinc/94/85/33/1434948533.db2.gz RDGMFJMIANUKDP-JXFKEZNVSA-N 2 1 395.469 3.208 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)cc1C ZINC000273088858 1434959632 /nfs/dbraw/zinc/95/96/32/1434959632.db2.gz RANUKDQKJBUMRS-SFHVURJKSA-N 2 1 381.520 3.242 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)cc1C ZINC000273088853 1434959749 /nfs/dbraw/zinc/95/97/49/1434959749.db2.gz RANUKDQKJBUMRS-GOSISDBHSA-N 2 1 381.520 3.242 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCN(Cc3ccccn3)C2=O)cc1 ZINC000273322970 1434980851 /nfs/dbraw/zinc/98/08/51/1434980851.db2.gz ZPCDAXCAPCYADU-HTAPYJJXSA-N 2 1 389.503 3.418 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCC[C@@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000273368893 1434983741 /nfs/dbraw/zinc/98/37/41/1434983741.db2.gz FROOIUXNJQMSLJ-PMACEKPBSA-N 2 1 375.538 3.265 20 0 GGADMP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000273407910 1434986826 /nfs/dbraw/zinc/98/68/26/1434986826.db2.gz IDTKAEWLYQCSPD-JQVVWYNYSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000273418949 1434987706 /nfs/dbraw/zinc/98/77/06/1434987706.db2.gz KKWRSAUCMWYLLG-KNKQGSTJSA-N 2 1 386.584 3.269 20 0 GGADMP Cc1ccc(NC(=O)[C@H]2CCC[N@H+]2C2CCCC2)cc1NC(=O)CC[NH+](C)C ZINC000274425733 1435070215 /nfs/dbraw/zinc/07/02/15/1435070215.db2.gz PHRPGJNXOIMZMO-HXUWFJFHSA-N 2 1 386.540 3.231 20 0 GGADMP C[C@H]([NH2+][C@H]1CCCN(Cc2ccccn2)C1=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274741651 1435088877 /nfs/dbraw/zinc/08/88/77/1435088877.db2.gz FIXLQNALLOWVGG-RRPUWOKSSA-N 2 1 392.547 3.073 20 0 GGADMP C[C@H]([NH2+]C1CCN(C2CC[NH+](C)CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274820774 1435095415 /nfs/dbraw/zinc/09/54/15/1435095415.db2.gz BOLZZOUFCNIXAK-RBBKRZOGSA-N 3 1 384.612 3.045 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NC[C@@H](C)c2ccccc2)[C@H](C)C1 ZINC000274821180 1435095520 /nfs/dbraw/zinc/09/55/20/1435095520.db2.gz GXTBTBKFUKNMCY-VMBXEPDQSA-N 2 1 389.584 3.021 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NC[C@@H](C)c2ccccc2)[C@H](C)C1 ZINC000274821180 1435095522 /nfs/dbraw/zinc/09/55/22/1435095522.db2.gz GXTBTBKFUKNMCY-VMBXEPDQSA-N 2 1 389.584 3.021 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCCc2nc(-c3ccccc3)no2)[C@H](C)C1 ZINC000274830425 1435096285 /nfs/dbraw/zinc/09/62/85/1435096285.db2.gz JKXQRXYUWTUIIH-UYAOXDASSA-N 2 1 386.540 3.396 20 0 GGADMP CC(C)[NH+]1CCN(C2CC[NH+](C[C@H](O)c3ccc(F)cc3Cl)CC2)CC1 ZINC000274844521 1435097414 /nfs/dbraw/zinc/09/74/14/1435097414.db2.gz PHFIGSGNXHYCPV-FQEVSTJZSA-N 2 1 383.939 3.003 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N(C)[C@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000274865927 1435099147 /nfs/dbraw/zinc/09/91/47/1435099147.db2.gz UFWWNZNNOQZOQK-OPYAIIAOSA-N 2 1 393.547 3.072 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N(C)[C@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000274865927 1435099149 /nfs/dbraw/zinc/09/91/49/1435099149.db2.gz UFWWNZNNOQZOQK-OPYAIIAOSA-N 2 1 393.547 3.072 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N(C)[C@@H](C)c2ccc(F)cc2)[C@@H](C)C1 ZINC000274865932 1435099257 /nfs/dbraw/zinc/09/92/57/1435099257.db2.gz UFWWNZNNOQZOQK-WFXMLNOXSA-N 2 1 393.547 3.072 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N(C)[C@@H](C)c2ccc(F)cc2)[C@@H](C)C1 ZINC000274865932 1435099258 /nfs/dbraw/zinc/09/92/58/1435099258.db2.gz UFWWNZNNOQZOQK-WFXMLNOXSA-N 2 1 393.547 3.072 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(CS(C)(=O)=O)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274872577 1435100064 /nfs/dbraw/zinc/10/00/64/1435100064.db2.gz GAQFUJFSMGCHGW-GCJKJVERSA-N 2 1 386.561 3.231 20 0 GGADMP C[C@H]([NH2+]CCCNC(=O)c1cccc(O)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274879272 1435100457 /nfs/dbraw/zinc/10/04/57/1435100457.db2.gz HGNACYXJIQRQMX-GHTZIAJQSA-N 2 1 381.520 3.012 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000274927830 1435104105 /nfs/dbraw/zinc/10/41/05/1435104105.db2.gz QFMRSGQCVFQHMV-LYHRCORUSA-N 2 1 384.520 3.237 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000274927827 1435104125 /nfs/dbraw/zinc/10/41/25/1435104125.db2.gz QFMRSGQCVFQHMV-HFJQGTKSSA-N 2 1 384.520 3.237 20 0 GGADMP CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000275532393 1435146190 /nfs/dbraw/zinc/14/61/90/1435146190.db2.gz LYUIFJZCXPHMQF-YWCCWUOUSA-N 2 1 394.563 3.481 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C[C@H]1CCc2[nH+]ccn2C1 ZINC000275577309 1435149920 /nfs/dbraw/zinc/14/99/20/1435149920.db2.gz OSZIFJSEAGJHDR-UONOGXRCSA-N 2 1 396.413 3.351 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)Nc2ccccc2CC[NH+](C)C)CC1 ZINC000275592522 1435151228 /nfs/dbraw/zinc/15/12/28/1435151228.db2.gz FTUMDOQCCQNWHM-UHFFFAOYSA-N 2 1 380.536 3.449 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)Nc2ccccc2CC[NH+](C)C)cn1 ZINC000275602089 1435151927 /nfs/dbraw/zinc/15/19/27/1435151927.db2.gz HAPOFYIKMCPMRG-UHFFFAOYSA-N 2 1 378.480 3.002 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)Nc1ccccc1CC[NH+](C)C ZINC000275666405 1435157968 /nfs/dbraw/zinc/15/79/68/1435157968.db2.gz OLWQUIJFUOQELU-UHFFFAOYSA-N 2 1 378.480 3.002 20 0 GGADMP Cn1cc([C@H]2OCCC[C@@H]2[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)cn1 ZINC000275669117 1435158383 /nfs/dbraw/zinc/15/83/83/1435158383.db2.gz VLGRRAVJIFOVNM-FCHUYYIVSA-N 2 1 386.515 3.076 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC(=O)Nc2ccccc2CC[NH+](C)C)[C@H](C)C1 ZINC000275716915 1435162496 /nfs/dbraw/zinc/16/24/96/1435162496.db2.gz VKSXNZVBLPGPOM-QUCCMNQESA-N 2 1 390.572 3.049 20 0 GGADMP C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]C[C@@H]1CCc2[nH+]ccn2C1 ZINC000275723301 1435162862 /nfs/dbraw/zinc/16/28/62/1435162862.db2.gz ZEFWVEKHNROJFD-KBPBESRZSA-N 2 1 380.414 3.471 20 0 GGADMP C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]C[C@@H]1CCc2[nH+]ccn2C1 ZINC000275723306 1435162874 /nfs/dbraw/zinc/16/28/74/1435162874.db2.gz ZEFWVEKHNROJFD-KGLIPLIRSA-N 2 1 380.414 3.471 20 0 GGADMP CCC[NH+](CCC)CCCNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000276355953 1435206705 /nfs/dbraw/zinc/20/67/05/1435206705.db2.gz IAOYHASGZODKNU-NRFANRHFSA-N 2 1 389.588 3.057 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)c1ccc2c(c1)CC[NH2+]CC2 ZINC000276640289 1435222123 /nfs/dbraw/zinc/22/21/23/1435222123.db2.gz OTJJLRLMZJTRMI-UHFFFAOYSA-N 2 1 399.485 3.047 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)CC[NH2+]CC3)CC[N@H+]1Cc1ccccc1 ZINC000276728384 1435228264 /nfs/dbraw/zinc/22/82/64/1435228264.db2.gz YHQRJLSKILIFED-DVECYGJZSA-N 2 1 391.559 3.500 20 0 GGADMP C[C@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)CC[NH2+]CC3)CC[N@H+]1Cc1ccccc1 ZINC000276728389 1435228307 /nfs/dbraw/zinc/22/83/07/1435228307.db2.gz YHQRJLSKILIFED-YADARESESA-N 2 1 391.559 3.500 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccn([C@H]3CCC[NH2+]C3)n2)cc1 ZINC000276737752 1435228983 /nfs/dbraw/zinc/22/89/83/1435228983.db2.gz AKWNZCPJFIKJIR-PXNSSMCTSA-N 2 1 381.524 3.434 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[NH+]2CCC[C@@H]2C(N)=O)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000276932071 1435244544 /nfs/dbraw/zinc/24/45/44/1435244544.db2.gz OIKMEQCYCREVPC-YYAJDYIMSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[NH+]2CCC[C@@H]2C(N)=O)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276932071 1435244545 /nfs/dbraw/zinc/24/45/45/1435244545.db2.gz OIKMEQCYCREVPC-YYAJDYIMSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[N@@H+]2CCC[C@@H]2C(N)=O)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276932071 1435244547 /nfs/dbraw/zinc/24/45/47/1435244547.db2.gz OIKMEQCYCREVPC-YYAJDYIMSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[N@H+]2CCC[C@@H]2C(N)=O)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276932071 1435244549 /nfs/dbraw/zinc/24/45/49/1435244549.db2.gz OIKMEQCYCREVPC-YYAJDYIMSA-N 2 1 397.523 3.120 20 0 GGADMP COc1cc2c(cc1OC)C[N@H+](Cc1ccccc1NC(=O)CC[C@@H](C)[NH3+])CC2 ZINC000277430236 1435304135 /nfs/dbraw/zinc/30/41/35/1435304135.db2.gz CDYXIMLOXJGYRR-MRXNPFEDSA-N 2 1 397.519 3.328 20 0 GGADMP COc1cc2c(cc1OC)C[N@@H+](Cc1ccccc1NC(=O)CC[C@@H](C)[NH3+])CC2 ZINC000277430236 1435304137 /nfs/dbraw/zinc/30/41/37/1435304137.db2.gz CDYXIMLOXJGYRR-MRXNPFEDSA-N 2 1 397.519 3.328 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NCC1CC[NH+](C2CC2)CC1 ZINC000278031555 1435351965 /nfs/dbraw/zinc/35/19/65/1435351965.db2.gz KCRRPKLQQPCBMH-XMSQKQJNSA-N 2 1 384.568 3.071 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC1CC[NH+](C2CC2)CC1 ZINC000278105136 1435359875 /nfs/dbraw/zinc/35/98/75/1435359875.db2.gz JSVSIJARDAVNQT-JOCHJYFZSA-N 2 1 398.595 3.414 20 0 GGADMP C[C@@H](NC(=O)NCC1CC[NH+](C2CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000278289486 1435376687 /nfs/dbraw/zinc/37/66/87/1435376687.db2.gz ZPGQHJCAFXBHFZ-WIYYLYMNSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@H](NC(=O)NCC1CC[NH+](C2CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000278289473 1435376831 /nfs/dbraw/zinc/37/68/31/1435376831.db2.gz ZPGQHJCAFXBHFZ-GHTZIAJQSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(OCc2nccn2C)cc1 ZINC000278363130 1435384001 /nfs/dbraw/zinc/38/40/01/1435384001.db2.gz BMDUAHMERJCHLX-OALUTQOASA-N 2 1 386.540 3.151 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1Cn1cccn1 ZINC000278371584 1435384826 /nfs/dbraw/zinc/38/48/26/1435384826.db2.gz BZGHCNPNMKHCLI-MOPGFXCFSA-N 2 1 386.540 3.092 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1Cn1cccn1 ZINC000278373408 1435385124 /nfs/dbraw/zinc/38/51/24/1435385124.db2.gz BZGHCNPNMKHCLI-RTBURBONSA-N 2 1 386.540 3.092 20 0 GGADMP O=C1O[C@H](C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)CN1c1ccccc1 ZINC000278792920 1435424041 /nfs/dbraw/zinc/42/40/41/1435424041.db2.gz FCKBEPVIZVZNON-HXUWFJFHSA-N 2 1 380.492 3.424 20 0 GGADMP O=C(CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)NC(=O)Nc1ccccc1 ZINC000278835588 1435428871 /nfs/dbraw/zinc/42/88/71/1435428871.db2.gz ITBXXPYQZSUIPG-UHFFFAOYSA-N 2 1 395.507 3.137 20 0 GGADMP C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000278896642 1435437235 /nfs/dbraw/zinc/43/72/35/1435437235.db2.gz RAHXPGDBXICRQO-FQEVSTJZSA-N 2 1 399.579 3.000 20 0 GGADMP O[C@H](COc1cccc2[nH]ccc21)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278933202 1435441922 /nfs/dbraw/zinc/44/19/22/1435441922.db2.gz SWOGXTAERGHMPE-IBGZPJMESA-N 2 1 394.519 3.320 20 0 GGADMP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2[NH2+]C[C@H]2CCc3[nH+]ccn3C2)cc1 ZINC000278943232 1435443189 /nfs/dbraw/zinc/44/31/89/1435443189.db2.gz KLTZIXKTILLHEV-MISYRCLQSA-N 2 1 387.549 3.129 20 0 GGADMP CCCN(C(=O)c1cc([C@H]2CC[NH2+]C2)n[nH]1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000279104960 1435460850 /nfs/dbraw/zinc/46/08/50/1435460850.db2.gz XRIXHNPNOULYBH-VQTJNVASSA-N 2 1 395.551 3.003 20 0 GGADMP c1[nH+]c(C2CC[NH+](Cc3ccccc3N3CCOCC3)CC2)n2c1CCCC2 ZINC000279166708 1435466841 /nfs/dbraw/zinc/46/68/41/1435466841.db2.gz BIAYSKUFESITAA-UHFFFAOYSA-N 2 1 380.536 3.436 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)C23CCC[NH+]2CCC3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000279533823 1435510471 /nfs/dbraw/zinc/51/04/71/1435510471.db2.gz UWQLBTBONCJXDR-QAPCUYQASA-N 2 1 379.907 3.217 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)[C@@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000279907294 1435561216 /nfs/dbraw/zinc/56/12/16/1435561216.db2.gz LPLKNVOKYAYWTA-MOPGFXCFSA-N 2 1 377.573 3.203 20 0 GGADMP COc1cc2c(cc1OC)[C@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)CC2 ZINC000280256107 1435619552 /nfs/dbraw/zinc/61/95/52/1435619552.db2.gz WWDDCNIXYVUAHP-OAQYLSRUSA-N 2 1 382.504 3.313 20 0 GGADMP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cn1 ZINC000280542976 1435676853 /nfs/dbraw/zinc/67/68/53/1435676853.db2.gz DBDHXBCVGCWWOV-VXKWHMMOSA-N 2 1 380.536 3.317 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(N(C)c4ccccc4)nc3)C2)CC1 ZINC000280619229 1435690363 /nfs/dbraw/zinc/69/03/63/1435690363.db2.gz BKYLDNHMYMRQJV-JOCHJYFZSA-N 2 1 379.552 3.061 20 0 GGADMP COc1ccc([C@@H](C)[C@H](C)[NH2+]CC2([NH+]3CCCC3)CCOCC2)cc1OC ZINC000280752072 1435714485 /nfs/dbraw/zinc/71/44/85/1435714485.db2.gz CTFFEBHDGDNAGF-ROUUACIJSA-N 2 1 376.541 3.430 20 0 GGADMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280908489 1435740287 /nfs/dbraw/zinc/74/02/87/1435740287.db2.gz QGEHWCQEBPGVPY-GUYCJALGSA-N 2 1 398.960 3.130 20 0 GGADMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280908481 1435740540 /nfs/dbraw/zinc/74/05/40/1435740540.db2.gz QGEHWCQEBPGVPY-CXAGYDPISA-N 2 1 398.960 3.130 20 0 GGADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280945193 1435745674 /nfs/dbraw/zinc/74/56/74/1435745674.db2.gz SSUNPAAMTDHDGU-KRWDZBQOSA-N 2 1 398.960 3.274 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000281978386 1435829435 /nfs/dbraw/zinc/82/94/35/1435829435.db2.gz OLKCQCOFWDLZLJ-UHFFFAOYSA-N 2 1 395.494 3.261 20 0 GGADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000282149944 1435836531 /nfs/dbraw/zinc/83/65/31/1435836531.db2.gz LBWQBPHGTAXGJZ-REWPJTCUSA-N 2 1 390.568 3.471 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]CCN3CC[N@@H+](C)C(C)(C)C3)cs2)cc1 ZINC000282464199 1435848122 /nfs/dbraw/zinc/84/81/22/1435848122.db2.gz UEDCTSXWDPLAPN-UHFFFAOYSA-N 2 1 388.581 3.146 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]CCN3CC[N@H+](C)C(C)(C)C3)cs2)cc1 ZINC000282464199 1435848123 /nfs/dbraw/zinc/84/81/23/1435848123.db2.gz UEDCTSXWDPLAPN-UHFFFAOYSA-N 2 1 388.581 3.146 20 0 GGADMP COCCCn1nccc1CNc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000282531090 1435850364 /nfs/dbraw/zinc/85/03/64/1435850364.db2.gz AZBADFFLDCQVIZ-UHFFFAOYSA-N 2 1 385.556 3.310 20 0 GGADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000282557314 1435851473 /nfs/dbraw/zinc/85/14/73/1435851473.db2.gz XRAVQXIKNMZPRB-NRFANRHFSA-N 2 1 384.568 3.213 20 0 GGADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)c(-c2cnn(C)c2)c1 ZINC000282655314 1435855284 /nfs/dbraw/zinc/85/52/84/1435855284.db2.gz MHZZSHKUOUAHML-QHCPKHFHSA-N 2 1 390.531 3.252 20 0 GGADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@@H]1CC[NH+](C2CC2)C1 ZINC000282668519 1435855757 /nfs/dbraw/zinc/85/57/57/1435855757.db2.gz GTWPNJIBLSFGQE-FPOVZHCZSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000282668519 1435855758 /nfs/dbraw/zinc/85/57/58/1435855758.db2.gz GTWPNJIBLSFGQE-FPOVZHCZSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000282668519 1435855759 /nfs/dbraw/zinc/85/57/59/1435855759.db2.gz GTWPNJIBLSFGQE-FPOVZHCZSA-N 2 1 384.568 3.071 20 0 GGADMP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000282716110 1435857601 /nfs/dbraw/zinc/85/76/01/1435857601.db2.gz RGJONFSFPUDETK-UHFFFAOYSA-N 2 1 391.523 3.050 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825286 1435861855 /nfs/dbraw/zinc/86/18/55/1435861855.db2.gz JGVMXJCKXNWRSU-LEWJYISDSA-N 2 1 386.584 3.270 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825286 1435861856 /nfs/dbraw/zinc/86/18/56/1435861856.db2.gz JGVMXJCKXNWRSU-LEWJYISDSA-N 2 1 386.584 3.270 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825286 1435861857 /nfs/dbraw/zinc/86/18/57/1435861857.db2.gz JGVMXJCKXNWRSU-LEWJYISDSA-N 2 1 386.584 3.270 20 0 GGADMP CN(CC1CC[NH+](C)CC1)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282837352 1435862374 /nfs/dbraw/zinc/86/23/74/1435862374.db2.gz STUOQJBKRSRQTJ-NRFANRHFSA-N 2 1 386.584 3.270 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]CCCCN2CC[NH+](CC)CC2)c2ccccc21 ZINC000283167104 1435877545 /nfs/dbraw/zinc/87/75/45/1435877545.db2.gz IXNXUQPMDIGDBX-YADHBBJMSA-N 2 1 387.568 3.176 20 0 GGADMP CCOC(=O)[C@H]1CC[C@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)c2ccccc21 ZINC000283189478 1435878540 /nfs/dbraw/zinc/87/85/40/1435878540.db2.gz KLKHDXBMGSRYEZ-SFTDATJTSA-N 2 1 386.536 3.403 20 0 GGADMP O[C@@H]1[C@H](C[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CCC12CCOCC2 ZINC000283468535 1435891200 /nfs/dbraw/zinc/89/12/00/1435891200.db2.gz WAVSNMQABCCXSI-IACLWVNRSA-N 2 1 384.564 3.054 20 0 GGADMP C[NH+](C)CCOc1cc(C[NH2+]Cc2cnn(Cc3ccccc3)c2Cl)ccn1 ZINC000283837520 1435933385 /nfs/dbraw/zinc/93/33/85/1435933385.db2.gz HCWMXZGXRBHDQZ-UHFFFAOYSA-N 2 1 399.926 3.210 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+]Cc2cnn(Cc3ccccc3)c2Cl)CC1 ZINC000283873995 1435941971 /nfs/dbraw/zinc/94/19/71/1435941971.db2.gz IUMFWBCCVLZKJS-UHFFFAOYSA-N 2 1 389.975 3.092 20 0 GGADMP c1ccc(C[N@H+]2CCCO[C@H](CN3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)C2)cc1 ZINC000284104639 1435990472 /nfs/dbraw/zinc/99/04/72/1435990472.db2.gz MSIQCXNVTXSKLY-XWGVYQGASA-N 2 1 383.580 3.226 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000284293450 1436010651 /nfs/dbraw/zinc/01/06/51/1436010651.db2.gz YDGVYGDMIBRDLZ-ICSRJNTNSA-N 2 1 387.568 3.396 20 0 GGADMP C[NH+]1CCC(Oc2ccnc(N3CCC4(CC[NH2+]CC4)[C@@H]3C(F)(F)F)c2)CC1 ZINC001164388264 718815825 /nfs/dbraw/zinc/81/58/25/718815825.db2.gz OCXJZXWXVZLEJA-GOSISDBHSA-N 2 1 398.473 3.065 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@@H]4[NH2+]CC[C@H]42)n1)CCCC3)[NH+]1CCCCC1 ZINC001164411259 718875652 /nfs/dbraw/zinc/87/56/52/718875652.db2.gz OZBJAJFHJOTZCQ-DLBZAZTESA-N 2 1 397.592 3.497 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@@H]4[NH2+]CC[C@H]42)n1)CCCC3)[NH+]1CCCC1 ZINC001164412820 718876150 /nfs/dbraw/zinc/87/61/50/718876150.db2.gz ZSFUZWRSXZDVOD-JKSUJKDBSA-N 2 1 383.565 3.107 20 0 GGADMP [NH3+][C@]12C[C@H]1CN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164419130 718888123 /nfs/dbraw/zinc/88/81/23/718888123.db2.gz PYVWUPLOVOBGER-QKKBWIMNSA-N 2 1 383.565 3.093 20 0 GGADMP [NH3+][C@]12C[C@H]1CCN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCC4)C2 ZINC001164422605 718896351 /nfs/dbraw/zinc/89/63/51/718896351.db2.gz XAMVOZGWAZEFNI-SZNDQCEHSA-N 2 1 383.565 3.093 20 0 GGADMP [NH3+][C@@]12C[C@@H]1CCN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCC4)C2 ZINC001164422602 718896381 /nfs/dbraw/zinc/89/63/81/718896381.db2.gz XAMVOZGWAZEFNI-LHSJRXKWSA-N 2 1 383.565 3.093 20 0 GGADMP [NH3+][C@]12C[C@H]1CCN(c1nc(C[NH+]3CCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164420167 718896505 /nfs/dbraw/zinc/89/65/05/718896505.db2.gz KQZHRNMYNACUJK-SZNDQCEHSA-N 2 1 383.565 3.093 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CC[C@H]3C[C@@]3([NH3+])C2)n1 ZINC001164422433 718896694 /nfs/dbraw/zinc/89/66/94/718896694.db2.gz VDCXGQDKKBDERP-YCRPNKLZSA-N 2 1 379.533 3.347 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CCC[C@@H]5[NH2+]C[C@@H]53)n2)CCC4)CC1 ZINC001164448732 719000331 /nfs/dbraw/zinc/00/03/31/719000331.db2.gz IXZJRVUGWREGDU-IRXDYDNUSA-N 2 1 397.592 3.353 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@H]4[NH2+]C[C@H]42)n1)CCCC3)[NH+]1CCCC1 ZINC001164447148 719000364 /nfs/dbraw/zinc/00/03/64/719000364.db2.gz AWWIGJJSUCBVLK-HZPDHXFCSA-N 2 1 383.565 3.107 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CCC[C@H]5[NH2+]C[C@@H]53)n2)CCC4)CC1 ZINC001164448737 719000495 /nfs/dbraw/zinc/00/04/95/719000495.db2.gz IXZJRVUGWREGDU-SJORKVTESA-N 2 1 397.592 3.353 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CCC[C@@H]5[NH2+]C[C@@H]54)c32)C1 ZINC001164447954 719000615 /nfs/dbraw/zinc/00/06/15/719000615.db2.gz DHTZPADZNORVAE-PVAVHDDUSA-N 2 1 397.592 3.353 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CCC[C@H]3[NH2+]C[C@@H]32)n1 ZINC001164448267 719001718 /nfs/dbraw/zinc/00/17/18/719001718.db2.gz GQNTVUHDTUNOQP-SJORKVTESA-N 2 1 379.533 3.361 20 0 GGADMP CCOC(=O)C1CC[NH+](C2CCN(c3cc(OC)c4ccccc4[nH+]3)CC2)CC1 ZINC001164618450 719029497 /nfs/dbraw/zinc/02/94/97/719029497.db2.gz WYZQBWUEBJSHFI-UHFFFAOYSA-N 2 1 397.519 3.487 20 0 GGADMP Cc1nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc(N2CCCC2)[nH+]1 ZINC001164629171 719058240 /nfs/dbraw/zinc/05/82/40/719058240.db2.gz WHKLCWHORMEUSB-RTWAWAEBSA-N 2 1 377.536 3.486 20 0 GGADMP Cc1nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc(N2CCCC2)[nH+]1 ZINC001164629172 719058458 /nfs/dbraw/zinc/05/84/58/719058458.db2.gz WHKLCWHORMEUSB-SFTDATJTSA-N 2 1 377.536 3.486 20 0 GGADMP c1ccc(C[N@H+]2C[C@H]3CCCN(c4nccc(C5CC[NH2+]CC5)n4)[C@H]3C2)cc1 ZINC001164628798 719088911 /nfs/dbraw/zinc/08/89/11/719088911.db2.gz OIPOAXXVQQFWJO-IRLDBZIGSA-N 2 1 377.536 3.044 20 0 GGADMP Clc1cc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c2c(n1)C[NH2+]CC2 ZINC001164629897 719093875 /nfs/dbraw/zinc/09/38/75/719093875.db2.gz UCNHHZGWWCFZSM-UTKZUKDTSA-N 2 1 382.939 3.482 20 0 GGADMP CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ccc(C[NH+]3CCCC3)cn1)CC2 ZINC001164652171 719314950 /nfs/dbraw/zinc/31/49/50/719314950.db2.gz OVVXSUFBQDPFQZ-UHFFFAOYSA-N 2 1 382.556 3.079 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nc(Cl)nc3cccc(F)c32)c2c1CC[NH2+]C2 ZINC001164685195 719615142 /nfs/dbraw/zinc/61/51/42/719615142.db2.gz SLZDUXDFHBGVMB-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nc(Cl)nc3cccc(F)c32)c2c1CC[NH2+]C2 ZINC001164685195 719615154 /nfs/dbraw/zinc/61/51/54/719615154.db2.gz SLZDUXDFHBGVMB-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP COc1ccc(C(F)(F)n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)c(Cl)n1 ZINC001164682000 719620841 /nfs/dbraw/zinc/62/08/41/719620841.db2.gz KTJBOHWJZADOBK-UHFFFAOYSA-N 2 1 399.873 3.024 20 0 GGADMP COc1ccc(C(F)(F)n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)c(Cl)n1 ZINC001164682000 719620848 /nfs/dbraw/zinc/62/08/48/719620848.db2.gz KTJBOHWJZADOBK-UHFFFAOYSA-N 2 1 399.873 3.024 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)c2cc(Cl)ncc2F)c2c1CC[NH2+]C2 ZINC001164683484 719621710 /nfs/dbraw/zinc/62/17/10/719621710.db2.gz SOAQXWLKQHVFLV-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)c2cc(Cl)ncc2F)c2c1CC[NH2+]C2 ZINC001164683484 719621715 /nfs/dbraw/zinc/62/17/15/719621715.db2.gz SOAQXWLKQHVFLV-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)c2nc(Cl)ccc2F)c2c1CC[NH2+]C2 ZINC001164683690 719622082 /nfs/dbraw/zinc/62/20/82/719622082.db2.gz UWTRWLMIFMKQAW-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)c2nc(Cl)ccc2F)c2c1CC[NH2+]C2 ZINC001164683690 719622085 /nfs/dbraw/zinc/62/20/85/719622085.db2.gz UWTRWLMIFMKQAW-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP Cc1c(Cl)nc(C(C)(C)C)nc1-n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164680180 719638443 /nfs/dbraw/zinc/63/84/43/719638443.db2.gz RMZUFKZAFKKLMB-UHFFFAOYSA-N 2 1 390.963 3.408 20 0 GGADMP Cc1c(Cl)nc(C(C)(C)C)nc1-n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164680180 719638454 /nfs/dbraw/zinc/63/84/54/719638454.db2.gz RMZUFKZAFKKLMB-UHFFFAOYSA-N 2 1 390.963 3.408 20 0 GGADMP Cc1ccc(C)c(-c2ccc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)nn2)c1 ZINC001164680161 719642262 /nfs/dbraw/zinc/64/22/62/719642262.db2.gz QQCNKZTYMVCWGN-UHFFFAOYSA-N 2 1 390.535 3.432 20 0 GGADMP Cc1ccc(C)c(-c2ccc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)nn2)c1 ZINC001164680161 719642271 /nfs/dbraw/zinc/64/22/71/719642271.db2.gz QQCNKZTYMVCWGN-UHFFFAOYSA-N 2 1 390.535 3.432 20 0 GGADMP Cc1c(Cl)nc(C2CCC2)nc1-n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164681424 719648787 /nfs/dbraw/zinc/64/87/87/719648787.db2.gz OIWLXHLFTPWRKL-UHFFFAOYSA-N 2 1 388.947 3.378 20 0 GGADMP Cc1c(Cl)nc(C2CCC2)nc1-n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164681424 719648796 /nfs/dbraw/zinc/64/87/96/719648796.db2.gz OIWLXHLFTPWRKL-UHFFFAOYSA-N 2 1 388.947 3.378 20 0 GGADMP Cc1cc(-c2ccccc2F)nnc1-n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164680125 719649448 /nfs/dbraw/zinc/64/94/48/719649448.db2.gz OXRCHXCDDIRIHM-UHFFFAOYSA-N 2 1 394.498 3.263 20 0 GGADMP Cc1cc(-c2ccccc2F)nnc1-n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164680125 719649453 /nfs/dbraw/zinc/64/94/53/719649453.db2.gz OXRCHXCDDIRIHM-UHFFFAOYSA-N 2 1 394.498 3.263 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)Oc2ccnc(Cl)c2)c2c1CC[NH2+]C2 ZINC001164679998 719649487 /nfs/dbraw/zinc/64/94/87/719649487.db2.gz BWFDYBKTZCYDJD-UHFFFAOYSA-N 2 1 385.846 3.003 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)Oc2ccnc(Cl)c2)c2c1CC[NH2+]C2 ZINC001164679998 719649491 /nfs/dbraw/zinc/64/94/91/719649491.db2.gz BWFDYBKTZCYDJD-UHFFFAOYSA-N 2 1 385.846 3.003 20 0 GGADMP Cc1cnc(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1-c1ccccc1F ZINC001164680764 719649776 /nfs/dbraw/zinc/64/97/76/719649776.db2.gz IRMXUPWDFZFSKC-UHFFFAOYSA-N 2 1 394.498 3.263 20 0 GGADMP Cc1cnc(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1-c1ccccc1F ZINC001164680764 719649782 /nfs/dbraw/zinc/64/97/82/719649782.db2.gz IRMXUPWDFZFSKC-UHFFFAOYSA-N 2 1 394.498 3.263 20 0 GGADMP CC[N@H+]1CCCC[C@H]1c1ccc(-n2nc(CN(C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679762 719649980 /nfs/dbraw/zinc/64/99/80/719649980.db2.gz MKWSAQBVXOIXMO-NRFANRHFSA-N 2 1 396.583 3.300 20 0 GGADMP CC[N@@H+]1CCCC[C@H]1c1ccc(-n2nc(C[NH+](C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679762 719649990 /nfs/dbraw/zinc/64/99/90/719649990.db2.gz MKWSAQBVXOIXMO-NRFANRHFSA-N 3 1 396.583 3.300 20 0 GGADMP CC[N@H+]1CCCC[C@H]1c1ccc(-n2nc(C[NH+](C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679762 719650004 /nfs/dbraw/zinc/65/00/04/719650004.db2.gz MKWSAQBVXOIXMO-NRFANRHFSA-N 3 1 396.583 3.300 20 0 GGADMP CC[NH+]1CCCC[C@H]1c1ccc(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679762 719650011 /nfs/dbraw/zinc/65/00/11/719650011.db2.gz MKWSAQBVXOIXMO-NRFANRHFSA-N 3 1 396.583 3.300 20 0 GGADMP CC[NH+]1CCCC[C@H]1c1ccc(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679762 719650027 /nfs/dbraw/zinc/65/00/27/719650027.db2.gz MKWSAQBVXOIXMO-NRFANRHFSA-N 3 1 396.583 3.300 20 0 GGADMP CSc1ccc2ncnc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)c2c1 ZINC001164679498 719650295 /nfs/dbraw/zinc/65/02/95/719650295.db2.gz CYBVGNAGJQMGGH-UHFFFAOYSA-N 2 1 382.537 3.023 20 0 GGADMP CSc1ccc2ncnc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)c2c1 ZINC001164679498 719650296 /nfs/dbraw/zinc/65/02/96/719650296.db2.gz CYBVGNAGJQMGGH-UHFFFAOYSA-N 2 1 382.537 3.023 20 0 GGADMP CNC(=O)C[N@@H+]1CCCC12CCN(c1cc(C)c3ccc(C)c(C)c3[nH+]1)CC2 ZINC001164690224 719744840 /nfs/dbraw/zinc/74/48/40/719744840.db2.gz VVFCTSQTHUCLPD-UHFFFAOYSA-N 2 1 380.536 3.341 20 0 GGADMP CNC(=O)C[N@H+]1CCCC12CCN(c1cc(C)c3ccc(C)c(C)c3[nH+]1)CC2 ZINC001164690224 719744847 /nfs/dbraw/zinc/74/48/47/719744847.db2.gz VVFCTSQTHUCLPD-UHFFFAOYSA-N 2 1 380.536 3.341 20 0 GGADMP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1[nH+]ccc3cc(OC)ccc31)C2 ZINC001164809801 720089582 /nfs/dbraw/zinc/08/95/82/720089582.db2.gz KMVUIESNRXIXRG-AUSIDOKSSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1[nH+]ccc3cc(OC)ccc31)C2 ZINC001164809801 720089590 /nfs/dbraw/zinc/08/95/90/720089590.db2.gz KMVUIESNRXIXRG-AUSIDOKSSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1[nH+]ccc3[nH]ccc31)CC2 ZINC001164712710 720098644 /nfs/dbraw/zinc/09/86/44/720098644.db2.gz YLJQYUAMYBGTQR-IBGZPJMESA-N 2 1 391.519 3.465 20 0 GGADMP COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(N(C)C)cc[nH+]1)CC2 ZINC001164717481 720116966 /nfs/dbraw/zinc/11/69/66/720116966.db2.gz PIARAWRPIYUFEM-OAQYLSRUSA-N 2 1 395.551 3.050 20 0 GGADMP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1cc(OC)c3ccccc3[nH+]1)C2 ZINC001164809049 720145962 /nfs/dbraw/zinc/14/59/62/720145962.db2.gz GJBGCZITGCVECV-FDDCHVKYSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(OC)c3ccccc3[nH+]1)C2 ZINC001164809049 720145965 /nfs/dbraw/zinc/14/59/65/720145965.db2.gz GJBGCZITGCVECV-FDDCHVKYSA-N 2 1 381.520 3.428 20 0 GGADMP Cc1ccc2cc[nH+]c(N3CC[C@H]4[C@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c2c1 ZINC001164832417 720317011 /nfs/dbraw/zinc/31/70/11/720317011.db2.gz SWUJBVFYEIUDQR-YADHBBJMSA-N 2 1 392.547 3.455 20 0 GGADMP Cc1ccc2cc[nH+]c(N3CC[C@@H]4[C@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c2c1 ZINC001164832413 720317034 /nfs/dbraw/zinc/31/70/34/720317034.db2.gz SWUJBVFYEIUDQR-FGZHOGPDSA-N 2 1 392.547 3.455 20 0 GGADMP Cc1ccc2cc[nH+]c(N3CC[C@H]4[C@@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c2c1 ZINC001164832415 720317246 /nfs/dbraw/zinc/31/72/46/720317246.db2.gz SWUJBVFYEIUDQR-VXKWHMMOSA-N 2 1 392.547 3.455 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3nccn3C[C@@H](C[NH+](C)C)C2)nc1 ZINC001164735011 720532566 /nfs/dbraw/zinc/53/25/66/720532566.db2.gz MPBGMTOURNUCEH-CTNGQTDRSA-N 2 1 396.583 3.413 20 0 GGADMP CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cc(N4CCCC4)cc[nH+]3)CC[C@@H]21 ZINC001164842454 720570018 /nfs/dbraw/zinc/57/00/18/720570018.db2.gz XMZSLXHNGPXTIF-BVSLBCMMSA-N 2 1 394.567 3.256 20 0 GGADMP CC(C)[N@@H+]1[C@@H]2CCN(c3cc(N4CCCC4)cc[nH+]3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164842452 720571132 /nfs/dbraw/zinc/57/11/32/720571132.db2.gz XMZSLXHNGPXTIF-BAGYTPMASA-N 2 1 394.567 3.256 20 0 GGADMP CN(C)c1cccc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)[nH+]1 ZINC001164842764 720666490 /nfs/dbraw/zinc/66/64/90/720666490.db2.gz UBKWJGZKKPTAFG-HXUWFJFHSA-N 2 1 380.536 3.408 20 0 GGADMP Cc1cnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c(C[NH3+])c1 ZINC001164842881 720704588 /nfs/dbraw/zinc/70/45/88/720704588.db2.gz ZQSOCMDIXSRRPA-OAQYLSRUSA-N 2 1 380.536 3.109 20 0 GGADMP COCC[N@@H+]1CCO[C@@H]2CN(c3cc(C)c4ccc(C)c(C)c4[nH+]3)CC[C@H]2C1 ZINC001164853833 720878494 /nfs/dbraw/zinc/87/84/94/720878494.db2.gz CXGYQSLMEZJRQZ-PZJWPPBQSA-N 2 1 383.536 3.334 20 0 GGADMP COCC[N@H+]1CCO[C@@H]2CN(c3cc(C)c4ccc(C)c(C)c4[nH+]3)CC[C@H]2C1 ZINC001164853833 720878496 /nfs/dbraw/zinc/87/84/96/720878496.db2.gz CXGYQSLMEZJRQZ-PZJWPPBQSA-N 2 1 383.536 3.334 20 0 GGADMP CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncccc1C[NH+]1CCCC1)[C@H]2C ZINC001164864806 721019581 /nfs/dbraw/zinc/01/95/81/721019581.db2.gz ZOIPPXGECIEQIE-SFHVURJKSA-N 2 1 382.556 3.295 20 0 GGADMP COCC[N@@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc3c([nH+]1)CCC3)CC2 ZINC001164790058 721456371 /nfs/dbraw/zinc/45/63/71/721456371.db2.gz ZIDSLCAWLSGEAD-NRFANRHFSA-N 2 1 399.579 3.304 20 0 GGADMP COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc3c([nH+]1)CCC3)CC2 ZINC001164790058 721456373 /nfs/dbraw/zinc/45/63/73/721456373.db2.gz ZIDSLCAWLSGEAD-NRFANRHFSA-N 2 1 399.579 3.304 20 0 GGADMP COCC[N@@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1[nH+]cc(C)cc1C)CC2 ZINC001164789875 721459665 /nfs/dbraw/zinc/45/96/65/721459665.db2.gz YBEWZNBGJHKYNA-OAQYLSRUSA-N 2 1 387.568 3.432 20 0 GGADMP COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1[nH+]cc(C)cc1C)CC2 ZINC001164789875 721459667 /nfs/dbraw/zinc/45/96/67/721459667.db2.gz YBEWZNBGJHKYNA-OAQYLSRUSA-N 2 1 387.568 3.432 20 0 GGADMP COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(C)c(C)c[nH+]1)CC2 ZINC001164791244 721468895 /nfs/dbraw/zinc/46/88/95/721468895.db2.gz VYKFUTLJBMRKNK-OAQYLSRUSA-N 2 1 387.568 3.432 20 0 GGADMP C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1ccc3c(n1)CC[NH2+]C3)CC2 ZINC001164793800 721490969 /nfs/dbraw/zinc/49/09/69/721490969.db2.gz WVUNCGKKQWAPCD-UHFFFAOYSA-N 2 1 377.536 3.003 20 0 GGADMP Fc1cccc(O[C@H]2C[C@@H]3CN(c4ccc(C[NH+]5CCCC5)cn4)CC[N@H+]3C2)c1 ZINC001164904829 721552947 /nfs/dbraw/zinc/55/29/47/721552947.db2.gz FZJKEXCNBJTOMI-IRLDBZIGSA-N 2 1 396.510 3.158 20 0 GGADMP C[N@@H+](Cc1ccc(N2CC[NH+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1)C1CC1 ZINC001164908716 721557781 /nfs/dbraw/zinc/55/77/81/721557781.db2.gz RTIWCLSPQQSVHJ-IRLDBZIGSA-N 2 1 396.510 3.157 20 0 GGADMP C[NH+](Cc1ccc(N2CC[N@@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1)C1CC1 ZINC001164908716 721557784 /nfs/dbraw/zinc/55/77/84/721557784.db2.gz RTIWCLSPQQSVHJ-IRLDBZIGSA-N 2 1 396.510 3.157 20 0 GGADMP C[NH+](Cc1ccc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1)C1CC1 ZINC001164908716 721557790 /nfs/dbraw/zinc/55/77/90/721557790.db2.gz RTIWCLSPQQSVHJ-IRLDBZIGSA-N 2 1 396.510 3.157 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC(F)(F)[C@]2(CC[N@H+](Cc3ccccn3)C2)C1 ZINC001164904925 721692074 /nfs/dbraw/zinc/69/20/74/721692074.db2.gz HQHFFCDAPADMMF-FQEVSTJZSA-N 2 1 398.461 3.101 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164904925 721692077 /nfs/dbraw/zinc/69/20/77/721692077.db2.gz HQHFFCDAPADMMF-FQEVSTJZSA-N 2 1 398.461 3.101 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2CCC(F)(F)[C@]3(CC[N@H+](Cc4ccccn4)C3)C2)[nH]1 ZINC001164907983 721696958 /nfs/dbraw/zinc/69/69/58/721696958.db2.gz XSIIEHSIMZVHQK-FQEVSTJZSA-N 2 1 398.461 3.399 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)[nH]1 ZINC001164907983 721696961 /nfs/dbraw/zinc/69/69/61/721696961.db2.gz XSIIEHSIMZVHQK-FQEVSTJZSA-N 2 1 398.461 3.399 20 0 GGADMP Cc1c[nH]c2nc[nH+]c(N3C[C@@H]4CCC[C@@H]([N@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165021361 721798467 /nfs/dbraw/zinc/79/84/67/721798467.db2.gz GNCILNQNCXEMOM-QXAKKESOSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1c[nH]c2nc[nH+]c(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165021361 721798469 /nfs/dbraw/zinc/79/84/69/721798469.db2.gz GNCILNQNCXEMOM-QXAKKESOSA-N 2 1 376.508 3.398 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165017781 721804372 /nfs/dbraw/zinc/80/43/72/721804372.db2.gz APJLCWFPQZLHEV-PWIZWCRZSA-N 2 1 376.508 3.100 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165017781 721804373 /nfs/dbraw/zinc/80/43/73/721804373.db2.gz APJLCWFPQZLHEV-PWIZWCRZSA-N 2 1 376.508 3.100 20 0 GGADMP C[NH+](C)Cc1ccnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1 ZINC001165027564 721827614 /nfs/dbraw/zinc/82/76/14/721827614.db2.gz SQTJEPJGKZLPJF-ILWGZMRPSA-N 2 1 379.552 3.275 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cc(-n4ccnc4)cc[nH+]3)C[C@@H]21 ZINC001165030228 721828190 /nfs/dbraw/zinc/82/81/90/721828190.db2.gz ZCABJOJTVPAOFL-BVYCBKJFSA-N 2 1 388.519 3.399 20 0 GGADMP CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001164925200 721867549 /nfs/dbraw/zinc/86/75/49/721867549.db2.gz MXGXBVOWZMLJID-DHIUTWEWSA-N 2 1 389.547 3.299 20 0 GGADMP C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001164925200 721867551 /nfs/dbraw/zinc/86/75/51/721867551.db2.gz MXGXBVOWZMLJID-DHIUTWEWSA-N 2 1 389.547 3.299 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CC[NH+]3CCN(C)C)nc1 ZINC001164930927 721887373 /nfs/dbraw/zinc/88/73/73/721887373.db2.gz DKFFTFBTBAZMQZ-FSSWDIPSSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)nc1 ZINC001164930927 721887375 /nfs/dbraw/zinc/88/73/75/721887375.db2.gz DKFFTFBTBAZMQZ-FSSWDIPSSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CC[N@H+]3CCN(C)C)nc1 ZINC001164930927 721887376 /nfs/dbraw/zinc/88/73/76/721887376.db2.gz DKFFTFBTBAZMQZ-FSSWDIPSSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CCN3CC[NH+](C)C)nc1 ZINC001164930927 721887377 /nfs/dbraw/zinc/88/73/77/721887377.db2.gz DKFFTFBTBAZMQZ-FSSWDIPSSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CCN3CC[NH+](C)C)nc1 ZINC001164930927 721887379 /nfs/dbraw/zinc/88/73/79/721887379.db2.gz DKFFTFBTBAZMQZ-FSSWDIPSSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CC[NH+]3CCN(C)C)nc1 ZINC001164930926 721887626 /nfs/dbraw/zinc/88/76/26/721887626.db2.gz DKFFTFBTBAZMQZ-BHIFYINESA-N 2 1 385.600 3.233 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)nc1 ZINC001164930926 721887627 /nfs/dbraw/zinc/88/76/27/721887627.db2.gz DKFFTFBTBAZMQZ-BHIFYINESA-N 2 1 385.600 3.233 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CC[N@H+]3CCN(C)C)nc1 ZINC001164930926 721887629 /nfs/dbraw/zinc/88/76/29/721887629.db2.gz DKFFTFBTBAZMQZ-BHIFYINESA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CCN3CC[NH+](C)C)nc1 ZINC001164930926 721887630 /nfs/dbraw/zinc/88/76/30/721887630.db2.gz DKFFTFBTBAZMQZ-BHIFYINESA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CCN3CC[NH+](C)C)nc1 ZINC001164930926 721887631 /nfs/dbraw/zinc/88/76/31/721887631.db2.gz DKFFTFBTBAZMQZ-BHIFYINESA-N 2 1 385.600 3.233 20 0 GGADMP c1csc(C[N@@H+]2C[C@H]3CC[C@@H](C2)N3c2ccc(OCC3CC[NH2+]CC3)cn2)c1 ZINC001164937822 721914634 /nfs/dbraw/zinc/91/46/34/721914634.db2.gz RVOZSOZQVPVWFN-KDURUIRLSA-N 2 1 398.576 3.375 20 0 GGADMP Cc1ccc(C[N@H+]2CCOC3(CCN(c4cccc(N(C)C)[nH+]4)CC3)C2)cc1 ZINC001164937895 721922160 /nfs/dbraw/zinc/92/21/60/721922160.db2.gz GYAZZRLNKGGIFZ-UHFFFAOYSA-N 2 1 380.536 3.327 20 0 GGADMP Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncc(C)cc4C[NH3+])CC3)C2)cc1 ZINC001164939409 721929933 /nfs/dbraw/zinc/92/99/33/721929933.db2.gz KKFWHZNCOUHXFS-UHFFFAOYSA-N 2 1 380.536 3.029 20 0 GGADMP Cc1nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)cc(N2CCCC2)[nH+]1 ZINC001164955404 722013099 /nfs/dbraw/zinc/01/30/99/722013099.db2.gz VNEZLPZPHQUQMN-UHFFFAOYSA-N 2 1 392.551 3.273 20 0 GGADMP Cc1nc(N2CCCC2)cc(N2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)[nH+]1 ZINC001164955404 722013102 /nfs/dbraw/zinc/01/31/02/722013102.db2.gz VNEZLPZPHQUQMN-UHFFFAOYSA-N 2 1 392.551 3.273 20 0 GGADMP Cc1nc(N2CCCC2)cc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)[nH+]1 ZINC001164955404 722013105 /nfs/dbraw/zinc/01/31/05/722013105.db2.gz VNEZLPZPHQUQMN-UHFFFAOYSA-N 2 1 392.551 3.273 20 0 GGADMP c1cc(C[N@@H+]2CCOCC3(CCN(c4ccc5c([nH+]4)CCC5)CC3)C2)ccn1 ZINC001164964822 722054862 /nfs/dbraw/zinc/05/48/62/722054862.db2.gz YCTWXPKDPWDVJB-UHFFFAOYSA-N 2 1 378.520 3.084 20 0 GGADMP c1cc(C[N@H+]2CCOCC3(CCN(c4ccc5c([nH+]4)CCC5)CC3)C2)ccn1 ZINC001164964822 722054863 /nfs/dbraw/zinc/05/48/63/722054863.db2.gz YCTWXPKDPWDVJB-UHFFFAOYSA-N 2 1 378.520 3.084 20 0 GGADMP CC(C)Oc1cc[nH+]c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c1 ZINC001164962170 722056791 /nfs/dbraw/zinc/05/67/91/722056791.db2.gz AAAZPISZSCTRNL-UHFFFAOYSA-N 2 1 396.535 3.383 20 0 GGADMP CC(C)(C[NH2+]C1CC[NH+](Cc2ccc(-c3nn[nH]n3)cc2)CC1)[C@@H]1CCCCO1 ZINC000824158426 946605166 /nfs/dbraw/zinc/60/51/66/946605166.db2.gz WNNIQDFMSGVAKL-FQEVSTJZSA-N 2 1 398.555 3.016 20 0 GGADMP CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@H](O)[C@@H]([NH2+]Cc1cnc(-c3cccs3)s1)C2 ZINC001550421872 1126206243 /nfs/dbraw/zinc/20/62/43/1126206243.db2.gz HHTQXMAYAIPDQR-MRHSLFKSSA-N 2 1 377.579 3.441 20 0 GGADMP CC[N@H+]1C[C@]2(C[C@H](O)[C@@H]([NH2+]Cc3cnc(-c4ccco4)s3)C2)[C@H]1C(C)C ZINC001550423934 1126206624 /nfs/dbraw/zinc/20/66/24/1126206624.db2.gz URDQNMREEXZIEJ-YTXYEVPYSA-N 2 1 375.538 3.363 20 0 GGADMP CC[N@H+]1C[C@@]2(C[C@@H]([NH2+]Cc3cnc(-c4ccco4)s3)[C@@H](O)C2)[C@H]1C(C)C ZINC001550423932 1126206772 /nfs/dbraw/zinc/20/67/72/1126206772.db2.gz URDQNMREEXZIEJ-HNAWSFBYSA-N 2 1 375.538 3.363 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC[N@@H+]1C ZINC000127480523 564585387 /nfs/dbraw/zinc/58/53/87/564585387.db2.gz CWPUTIQYUZDUCO-HNAYVOBHSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC[N@H+]1C ZINC000127480523 564585389 /nfs/dbraw/zinc/58/53/89/564585389.db2.gz CWPUTIQYUZDUCO-HNAYVOBHSA-N 2 1 380.374 3.486 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](CCC[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000128122537 564607094 /nfs/dbraw/zinc/60/70/94/564607094.db2.gz KCTLDZCRPYJNPM-WMLDXEAASA-N 2 1 381.973 3.444 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000128122537 564607097 /nfs/dbraw/zinc/60/70/97/564607097.db2.gz KCTLDZCRPYJNPM-WMLDXEAASA-N 2 1 381.973 3.444 20 0 GGADMP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc(Br)cc1 ZINC000128205470 564610598 /nfs/dbraw/zinc/61/05/98/564610598.db2.gz GLFAYJKPBZQQRE-DOTOQJQBSA-N 2 1 382.346 3.077 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)NCCc1cccc(Cl)c1Cl ZINC000130444551 564681271 /nfs/dbraw/zinc/68/12/71/564681271.db2.gz HXWROWLAZVGYDS-UHFFFAOYSA-N 2 1 383.323 3.179 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)NCCc1cccc(Cl)c1Cl ZINC000130444551 564681275 /nfs/dbraw/zinc/68/12/75/564681275.db2.gz HXWROWLAZVGYDS-UHFFFAOYSA-N 2 1 383.323 3.179 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cc(Br)c2c(c1)OCCCO2 ZINC000065932393 564752762 /nfs/dbraw/zinc/75/27/62/564752762.db2.gz PKSFZGZGHZPCHQ-UHFFFAOYSA-N 2 1 380.286 3.295 20 0 GGADMP CC(C)[C@H](C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[NH+](C)C ZINC000133720891 564782743 /nfs/dbraw/zinc/78/27/43/564782743.db2.gz UIXKFQCPKXKXEO-GOSISDBHSA-N 2 1 396.373 3.116 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000134380829 564801072 /nfs/dbraw/zinc/80/10/72/564801072.db2.gz PRBLKKQSBBGYQB-SFHVURJKSA-N 2 1 398.364 3.439 20 0 GGADMP CSC[C@@H]1CCC[N@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000135424140 564831337 /nfs/dbraw/zinc/83/13/37/564831337.db2.gz VNJMBQMTPZSFCD-SFHVURJKSA-N 2 1 379.595 3.001 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](C[C@@H](C)c3cccc(Br)c3)C2)CC1 ZINC000093133306 564883900 /nfs/dbraw/zinc/88/39/00/564883900.db2.gz RSQYZQCFIDXMBV-VQIMIIECSA-N 2 1 380.374 3.264 20 0 GGADMP O=C(CC[N@H+]1CC[C@H](C[NH+]2CCCC2)C1)Nc1cccc(Br)c1 ZINC000150846173 564893784 /nfs/dbraw/zinc/89/37/84/564893784.db2.gz XZPAOMYYXJMIEI-OAHLLOKOSA-N 2 1 380.330 3.195 20 0 GGADMP C[C@H](CN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccc(Br)cc2)o1 ZINC000106484376 564983970 /nfs/dbraw/zinc/98/39/70/564983970.db2.gz GQRWKLVMRKXASK-OAHLLOKOSA-N 2 1 392.341 3.435 20 0 GGADMP CC[N@H+](C)CCNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000184970206 565169050 /nfs/dbraw/zinc/16/90/50/565169050.db2.gz SXNZGDXMSXTHAO-UHFFFAOYSA-N 2 1 387.355 3.209 20 0 GGADMP CC[N@@H+](C)CCNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000184970206 565169055 /nfs/dbraw/zinc/16/90/55/565169055.db2.gz SXNZGDXMSXTHAO-UHFFFAOYSA-N 2 1 387.355 3.209 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+]C1(Cc2ccc(F)cc2Br)CCOCC1 ZINC000293597999 565176256 /nfs/dbraw/zinc/17/62/56/565176256.db2.gz OSYZRIUVMONAKH-UHFFFAOYSA-N 2 1 396.304 3.475 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(Cc3nc(-c4cc(Br)cs4)no3)CC[C@@H]21 ZINC000158909360 565186093 /nfs/dbraw/zinc/18/60/93/565186093.db2.gz HAVXCJFZMZGFCP-YPMHNXCESA-N 2 1 397.342 3.477 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000295122603 565246760 /nfs/dbraw/zinc/24/67/60/565246760.db2.gz XLZVWLAQYIVVTG-FCLXEUQJSA-N 2 1 380.330 3.381 20 0 GGADMP C[C@@H](N[C@H]1CC[N@@H+](CCN2CCOCC2)C1)c1cc(Cl)sc1Cl ZINC000372780001 565254159 /nfs/dbraw/zinc/25/41/59/565254159.db2.gz JCDHGJICXANCBV-OLZOCXBDSA-N 2 1 378.369 3.112 20 0 GGADMP C[NH+]1CCC2(CCC[N@@H+](Cc3nnc(-c4ccc(Br)o4)o3)C2)CC1 ZINC000374075903 565318668 /nfs/dbraw/zinc/31/86/68/565318668.db2.gz XXZTZLMALBJMGM-UHFFFAOYSA-N 2 1 395.301 3.400 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3cccc(Br)c3)CC[C@@H]21 ZINC000162800445 565328046 /nfs/dbraw/zinc/32/80/46/565328046.db2.gz MESOBNYSSFOSNI-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CCC(=O)Nc3cccc(Br)c3)CC[C@@H]21 ZINC000162800445 565328050 /nfs/dbraw/zinc/32/80/50/565328050.db2.gz MESOBNYSSFOSNI-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCC(=O)Nc3cccc(Br)c3)CC[C@@H]21 ZINC000162800445 565328054 /nfs/dbraw/zinc/32/80/54/565328054.db2.gz MESOBNYSSFOSNI-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3ccc(Br)cc3)CC[C@@H]21 ZINC000162804452 565328736 /nfs/dbraw/zinc/32/87/36/565328736.db2.gz KFCYWEPURLXUAS-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CCC(=O)Nc3ccc(Br)cc3)CC[C@@H]21 ZINC000162804452 565328742 /nfs/dbraw/zinc/32/87/42/565328742.db2.gz KFCYWEPURLXUAS-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCC(=O)Nc3ccc(Br)cc3)CC[C@@H]21 ZINC000162804452 565328747 /nfs/dbraw/zinc/32/87/47/565328747.db2.gz KFCYWEPURLXUAS-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(Br)ncc1F ZINC000273831448 565339114 /nfs/dbraw/zinc/33/91/14/565339114.db2.gz FXYFPQXHAVGOHF-GFCCVEGCSA-N 2 1 397.292 3.169 20 0 GGADMP C[C@H](Cn1cc(Br)cn1)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165315627 565369072 /nfs/dbraw/zinc/36/90/72/565369072.db2.gz QKOAQPCUPAATDB-SJLPKXTDSA-N 2 1 391.357 3.188 20 0 GGADMP CN(Cc1ccccc1Br)C(=O)CC[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166565680 565375375 /nfs/dbraw/zinc/37/53/75/565375375.db2.gz YRHWXTBSSPJATF-DLBZAZTESA-N 2 1 394.357 3.014 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+]C1(Cc2ccc(F)cc2Br)CCOCC1 ZINC000298190127 565404180 /nfs/dbraw/zinc/40/41/80/565404180.db2.gz WUSQAKPGUKCTMZ-UHFFFAOYSA-N 2 1 396.304 3.246 20 0 GGADMP CN(Cc1ccccc1Br)C(=O)CC[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000298455538 565414595 /nfs/dbraw/zinc/41/45/95/565414595.db2.gz ODCMBXCWFLPWHE-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP Cn1cncc1CC[N@@H+](C)Cc1cccc(Br)c1OCC(C)(C)O ZINC000298556484 565420716 /nfs/dbraw/zinc/42/07/16/565420716.db2.gz VKRBZVRCMORMGP-UHFFFAOYSA-N 2 1 396.329 3.007 20 0 GGADMP Cc1nn(C)c(CNCC[C@H](C)[N@@H+](C)Cc2ccccc2)c1Br ZINC000379629237 565538923 /nfs/dbraw/zinc/53/89/23/565538923.db2.gz OOHLVSCFVFKGDD-AWEZNQCLSA-N 2 1 379.346 3.491 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2cc(Br)c(Cl)s2)CC1 ZINC000190961035 565572403 /nfs/dbraw/zinc/57/24/03/565572403.db2.gz ZRIDASVYWIMENB-UHFFFAOYSA-N 2 1 380.783 3.281 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+]Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000401659213 565580365 /nfs/dbraw/zinc/58/03/65/565580365.db2.gz CDRBRIBTKHCOTA-UHFFFAOYSA-N 2 1 378.192 3.414 20 0 GGADMP CCCOc1c(Br)cc(C[NH2+]CCc2c[nH+]cn2C)cc1OC ZINC000401702490 565581418 /nfs/dbraw/zinc/58/14/18/565581418.db2.gz POBHSZACFRXFDM-UHFFFAOYSA-N 2 1 382.302 3.312 20 0 GGADMP C[NH2+]CC1CC[NH+](Cc2cc(Cl)ccc2I)CC1 ZINC000405546740 565586671 /nfs/dbraw/zinc/58/66/71/565586671.db2.gz WTJGBMWTBGAEOB-UHFFFAOYSA-N 2 1 378.685 3.376 20 0 GGADMP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc(Br)o1 ZINC000191580820 565614518 /nfs/dbraw/zinc/61/45/18/565614518.db2.gz ZSSMAVOYZKOCMQ-INIZCTEOSA-N 2 1 379.298 3.289 20 0 GGADMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc(Br)o1 ZINC000191580820 565614522 /nfs/dbraw/zinc/61/45/22/565614522.db2.gz ZSSMAVOYZKOCMQ-INIZCTEOSA-N 2 1 379.298 3.289 20 0 GGADMP C[C@H](c1cccc(Br)c1)[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000325295712 565620395 /nfs/dbraw/zinc/62/03/95/565620395.db2.gz YJRABDRJXVIMNZ-IIDMSEBBSA-N 2 1 394.357 3.090 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000191696310 565621934 /nfs/dbraw/zinc/62/19/34/565621934.db2.gz KABATYGYVOBGPQ-INIZCTEOSA-N 2 1 396.373 3.059 20 0 GGADMP C[C@H](Cn1cc(Br)cn1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192935029 565719666 /nfs/dbraw/zinc/71/96/66/565719666.db2.gz KBJPNXHBDKMMQL-NVXWUHKLSA-N 2 1 377.330 3.146 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCC(=O)Nc1ccc(Br)cc1F ZINC000411398989 565729103 /nfs/dbraw/zinc/72/91/03/565729103.db2.gz KPEBSSUMVCDSAU-UHFFFAOYSA-N 2 1 397.292 3.444 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CCC(=O)Nc1ccc(Br)cc1F ZINC000411398989 565729106 /nfs/dbraw/zinc/72/91/06/565729106.db2.gz KPEBSSUMVCDSAU-UHFFFAOYSA-N 2 1 397.292 3.444 20 0 GGADMP C[N@@H+]1CCCC12CC[NH+](CCC(=O)Nc1cccc(Br)c1)CC2 ZINC000411450699 565731157 /nfs/dbraw/zinc/73/11/57/565731157.db2.gz UPUYMRMDKORYKL-UHFFFAOYSA-N 2 1 380.330 3.338 20 0 GGADMP C[N@H+]1CCCC12CC[NH+](CCC(=O)Nc1cccc(Br)c1)CC2 ZINC000411450699 565731160 /nfs/dbraw/zinc/73/11/60/565731160.db2.gz UPUYMRMDKORYKL-UHFFFAOYSA-N 2 1 380.330 3.338 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3sccc3Cl)c2)C1 ZINC000193095251 565732416 /nfs/dbraw/zinc/73/24/16/565732416.db2.gz NDOQRWNPEZJUTC-INIZCTEOSA-N 2 1 377.941 3.389 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3sccc3Cl)c2)C1 ZINC000193095251 565732422 /nfs/dbraw/zinc/73/24/22/565732422.db2.gz NDOQRWNPEZJUTC-INIZCTEOSA-N 2 1 377.941 3.389 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3sccc3Cl)c2)C1 ZINC000193095266 565732612 /nfs/dbraw/zinc/73/26/12/565732612.db2.gz NDOQRWNPEZJUTC-MRXNPFEDSA-N 2 1 377.941 3.389 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3sccc3Cl)c2)C1 ZINC000193095266 565732618 /nfs/dbraw/zinc/73/26/18/565732618.db2.gz NDOQRWNPEZJUTC-MRXNPFEDSA-N 2 1 377.941 3.389 20 0 GGADMP C[NH+](C)CCC1CC[NH+](Cc2nnc(-c3ccc(Br)o3)o2)CC1 ZINC000193434498 565751468 /nfs/dbraw/zinc/75/14/68/565751468.db2.gz RUNLVASIRDQUQF-UHFFFAOYSA-N 2 1 383.290 3.256 20 0 GGADMP CC[NH+](CC)CCC[NH+]1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000193474436 565754090 /nfs/dbraw/zinc/75/40/90/565754090.db2.gz RYPNYCWVZZVSLT-UHFFFAOYSA-N 2 1 397.361 3.227 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]Cc2ccc(Br)c3cccnc23)CC1(C)C ZINC000282493883 565783184 /nfs/dbraw/zinc/78/31/84/565783184.db2.gz WEUUQKBVJCRGMZ-UHFFFAOYSA-N 2 1 391.357 3.113 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@H]2CCc3ccc(Br)cc32)CC1 ZINC000193981782 565786932 /nfs/dbraw/zinc/78/69/32/565786932.db2.gz CKXCMKODDHBDBI-IBGZPJMESA-N 2 1 380.374 3.300 20 0 GGADMP COc1cc(Cl)c(Cl)cc1C(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1 ZINC000176664311 565792082 /nfs/dbraw/zinc/79/20/82/565792082.db2.gz BEOBTEQKKPULJH-UHFFFAOYSA-N 2 1 388.339 3.100 20 0 GGADMP COc1cc(Cl)c(Cl)cc1C(=O)N(C)CCN(C)C1CC[NH+](C)CC1 ZINC000176664311 565792083 /nfs/dbraw/zinc/79/20/83/565792083.db2.gz BEOBTEQKKPULJH-UHFFFAOYSA-N 2 1 388.339 3.100 20 0 GGADMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2nc3ccc(Br)cc3o2)CC1 ZINC000332335768 565829952 /nfs/dbraw/zinc/82/99/52/565829952.db2.gz QZGMIWQGTKSQLE-CYBMUJFWSA-N 2 1 396.329 3.115 20 0 GGADMP [NH3+]C1CCN(C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000332536126 565842924 /nfs/dbraw/zinc/84/29/24/565842924.db2.gz UMRDBYITQXMCMC-UHFFFAOYSA-N 2 1 385.339 3.091 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H](CO)Cc1cc(F)cc(Br)c1 ZINC000414170358 565900846 /nfs/dbraw/zinc/90/08/46/565900846.db2.gz BYNFMUKSACAMEK-GGKPKWOWSA-N 2 1 387.337 3.058 20 0 GGADMP CC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000414192572 565902978 /nfs/dbraw/zinc/90/29/78/565902978.db2.gz SLGRMIQANZERQR-YOEHRIQHSA-N 2 1 387.977 3.021 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC[N@@H+]1C ZINC000414356169 565915025 /nfs/dbraw/zinc/91/50/25/565915025.db2.gz YSHXXILUOWRZBU-KXBFYZLASA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC[N@H+]1C ZINC000414356169 565915030 /nfs/dbraw/zinc/91/50/30/565915030.db2.gz YSHXXILUOWRZBU-KXBFYZLASA-N 2 1 380.374 3.486 20 0 GGADMP NC(=O)C1CC[NH+](Cc2ccc(C[NH2+]Cc3ccsc3Cl)cc2)CC1 ZINC000414559708 565948396 /nfs/dbraw/zinc/94/83/96/565948396.db2.gz VQTHINIIWKXJTG-UHFFFAOYSA-N 2 1 377.941 3.389 20 0 GGADMP COc1ccc(Br)cc1C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000237130290 565952713 /nfs/dbraw/zinc/95/27/13/565952713.db2.gz AFBLLVRUAAQYEN-GASCZTMLSA-N 2 1 385.346 3.437 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)N[C@H]1CC[N@H+](C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000237329770 565956582 /nfs/dbraw/zinc/95/65/82/565956582.db2.gz LTGGEXUYBCZDTF-YESZJQIVSA-N 2 1 387.952 3.200 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)N[C@H]1CC[N@@H+](C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000237329770 565956586 /nfs/dbraw/zinc/95/65/86/565956586.db2.gz LTGGEXUYBCZDTF-YESZJQIVSA-N 2 1 387.952 3.200 20 0 GGADMP COC(=O)CC[N@H+](Cc1cccc(Br)c1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414751701 565958717 /nfs/dbraw/zinc/95/87/17/565958717.db2.gz AXSXRKKVXMCGQT-GDBMZVCRSA-N 2 1 383.330 3.202 20 0 GGADMP Cc1cc([C@H]2CCC[N@H+]2C[C@H]2CCCN(C(=O)C[NH3+])C2)ccc1Br ZINC000414755708 565959030 /nfs/dbraw/zinc/95/90/30/565959030.db2.gz PLAVOQKAVGSLDK-CRAIPNDOSA-N 2 1 394.357 3.092 20 0 GGADMP CCOc1cc(C[NH2+]CC2([NH3+])CCC2)cc(Br)c1OC(F)F ZINC000414891119 565963600 /nfs/dbraw/zinc/96/36/00/565963600.db2.gz VBHOWQCIEAMEFW-UHFFFAOYSA-N 2 1 379.245 3.420 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414915223 565965245 /nfs/dbraw/zinc/96/52/45/565965245.db2.gz ZEDNBCINZBDBCE-GOSISDBHSA-N 2 1 377.330 3.423 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000414955449 565966768 /nfs/dbraw/zinc/96/67/68/565966768.db2.gz UHSRUNHMJLAHLC-MLGOLLRUSA-N 2 1 377.330 3.482 20 0 GGADMP COc1cc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc(Br)c1OC(F)F ZINC000414946394 565966956 /nfs/dbraw/zinc/96/69/56/565966956.db2.gz JMJKCTPVRHDFRA-ONGXEEELSA-N 2 1 379.245 3.289 20 0 GGADMP C[C@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000415037494 565970699 /nfs/dbraw/zinc/97/06/99/565970699.db2.gz LHFIOXSYLLKNBB-AUUYWEPGSA-N 2 1 393.325 3.338 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cn2)cc1 ZINC000363016168 565987000 /nfs/dbraw/zinc/98/70/00/565987000.db2.gz RHAHWCDAAWUNCM-AEFFLSMTSA-N 2 1 375.314 3.351 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)cn2)cc1 ZINC000363016168 565987002 /nfs/dbraw/zinc/98/70/02/565987002.db2.gz RHAHWCDAAWUNCM-AEFFLSMTSA-N 2 1 375.314 3.351 20 0 GGADMP C[NH+](C)CCC1CC[NH+](Cc2cc(Br)c3c(c2)OCCO3)CC1 ZINC000179550932 565988597 /nfs/dbraw/zinc/98/85/97/565988597.db2.gz RXCXFIONFSMRES-UHFFFAOYSA-N 2 1 383.330 3.384 20 0 GGADMP Brc1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](c4ncc[nH]4)C3)o2)o1 ZINC000363566288 566011508 /nfs/dbraw/zinc/01/15/08/566011508.db2.gz PLBLEZJDCMATAX-SNVBAGLBSA-N 2 1 378.230 3.195 20 0 GGADMP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](CCCc3ccccc3Br)C2)CC1 ZINC000363670453 566015595 /nfs/dbraw/zinc/01/55/95/566015595.db2.gz JUWZHSZPUTXKEQ-LJQANCHMSA-N 2 1 394.401 3.482 20 0 GGADMP Brc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(N2CCOCC2)c1 ZINC000246376874 566026402 /nfs/dbraw/zinc/02/64/02/566026402.db2.gz JURVEHIWXFKLIR-MSOLQXFVSA-N 2 1 394.357 3.002 20 0 GGADMP Brc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c(N2CCOCC2)c1 ZINC000246376874 566026405 /nfs/dbraw/zinc/02/64/05/566026405.db2.gz JURVEHIWXFKLIR-MSOLQXFVSA-N 2 1 394.357 3.002 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@H]2CCCOc3cc(Br)ccc32)CC1 ZINC000246960137 566047202 /nfs/dbraw/zinc/04/72/02/566047202.db2.gz IUHFHXMBMPKLOJ-SFHVURJKSA-N 2 1 396.373 3.280 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(Cc3nnc(-c4ccc(Br)o4)o3)CC[C@H]21 ZINC000247942445 566067738 /nfs/dbraw/zinc/06/77/38/566067738.db2.gz DCNGSSMRVOXHNZ-NWDGAFQWSA-N 2 1 381.274 3.008 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCCOc2cc(Br)ccc21 ZINC000248002005 566070928 /nfs/dbraw/zinc/07/09/28/566070928.db2.gz KMJBFJMQNLCUHS-FUHWJXTLSA-N 2 1 397.357 3.489 20 0 GGADMP Cc1ccc(Br)cc1NC(=O)CC[NH2+][C@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000180829939 566093410 /nfs/dbraw/zinc/09/34/10/566093410.db2.gz QRMGUPHIGVOTFX-LZWOXQAQSA-N 2 1 382.346 3.404 20 0 GGADMP Cc1cc(NC(=O)C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)ccc1Br ZINC000252664125 566115817 /nfs/dbraw/zinc/11/58/17/566115817.db2.gz UVQJCYZROHYMLA-GUYCJALGSA-N 2 1 391.313 3.476 20 0 GGADMP CCOC(=O)C[N@H+](CC1CC[NH2+]CC1)[C@H](C)c1cccc(Br)c1 ZINC000261753677 566133163 /nfs/dbraw/zinc/13/31/63/566133163.db2.gz CJWDICMFGJAOIQ-CQSZACIVSA-N 2 1 383.330 3.375 20 0 GGADMP CCOC(=O)C[N@@H+](CC1CC[NH2+]CC1)[C@H](C)c1cccc(Br)c1 ZINC000261753677 566133165 /nfs/dbraw/zinc/13/31/65/566133165.db2.gz CJWDICMFGJAOIQ-CQSZACIVSA-N 2 1 383.330 3.375 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+](CCSc2ccc(Cl)cc2)C1)[C@@H]1CCC[NH2+]1 ZINC000261845759 566138068 /nfs/dbraw/zinc/13/80/68/566138068.db2.gz LYGFQDRQVTXANR-YJBOKZPZSA-N 2 1 381.973 3.012 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]1CC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000261907237 566140524 /nfs/dbraw/zinc/14/05/24/566140524.db2.gz WZWPXYYGGUDITJ-MAUKXSAKSA-N 2 1 394.357 3.047 20 0 GGADMP C[N@@H+](Cc1cccc(Br)c1OC[C@H]1CCCO1)C[C@@H]1CCC[NH2+]C1 ZINC000261944960 566141308 /nfs/dbraw/zinc/14/13/08/566141308.db2.gz NGJONLYVYVFBLD-NVXWUHKLSA-N 2 1 397.357 3.438 20 0 GGADMP C[N@H+](Cc1cccc(Br)c1OC[C@H]1CCCO1)C[C@@H]1CCC[NH2+]C1 ZINC000261944960 566141314 /nfs/dbraw/zinc/14/13/14/566141314.db2.gz NGJONLYVYVFBLD-NVXWUHKLSA-N 2 1 397.357 3.438 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3nc(-c4cccc(Br)c4)no3)C[C@H]21 ZINC000261969027 566142280 /nfs/dbraw/zinc/14/22/80/566142280.db2.gz YUBTZPRPTVIWQZ-NWANDNLSSA-N 2 1 377.286 3.058 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3nc(-c4cccc(Br)c4)no3)C[C@H]21 ZINC000261969027 566142283 /nfs/dbraw/zinc/14/22/83/566142283.db2.gz YUBTZPRPTVIWQZ-NWANDNLSSA-N 2 1 377.286 3.058 20 0 GGADMP CC(C)Sc1cc(Br)ccc1C[N@@H+]1CC[C@H](N2CC[NH2+]CC2)C1 ZINC000262069687 566145236 /nfs/dbraw/zinc/14/52/36/566145236.db2.gz BXPYQFMTAUOWMB-KRWDZBQOSA-N 2 1 398.414 3.429 20 0 GGADMP CC(C)Sc1cc(Br)ccc1C[N@H+]1CC[C@H](N2CC[NH2+]CC2)C1 ZINC000262069687 566145240 /nfs/dbraw/zinc/14/52/40/566145240.db2.gz BXPYQFMTAUOWMB-KRWDZBQOSA-N 2 1 398.414 3.429 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)N[C@@H]1CC[N@H+](C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000262127271 566146628 /nfs/dbraw/zinc/14/66/28/566146628.db2.gz LTGGEXUYBCZDTF-BBWFWOEESA-N 2 1 387.952 3.200 20 0 GGADMP CCC[NH2+]CCNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000417563994 566158472 /nfs/dbraw/zinc/15/84/72/566158472.db2.gz FMVMXYIMBOQKDA-UHFFFAOYSA-N 2 1 387.355 3.257 20 0 GGADMP CC(C)[C@H]([NH3+])CNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000417565050 566158574 /nfs/dbraw/zinc/15/85/74/566158574.db2.gz GFICBHZQDRETIC-QGZVFWFLSA-N 2 1 387.355 3.240 20 0 GGADMP C[NH2+]C[C@H](C)CNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000417568896 566159338 /nfs/dbraw/zinc/15/93/38/566159338.db2.gz KZXUUBPHEWTSPT-ZDUSSCGKSA-N 2 1 387.355 3.113 20 0 GGADMP CC[NH2+][C@H](C)CNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000417568329 566159511 /nfs/dbraw/zinc/15/95/11/566159511.db2.gz KHMYHUJIJQJNPH-CYBMUJFWSA-N 2 1 387.355 3.255 20 0 GGADMP C[C@@H](CCC[NH3+])NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000417578038 566162715 /nfs/dbraw/zinc/16/27/15/566162715.db2.gz XVUFYJVPCMPBPC-ZDUSSCGKSA-N 2 1 387.355 3.384 20 0 GGADMP C[C@H](CCC[NH3+])NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000417578035 566162789 /nfs/dbraw/zinc/16/27/89/566162789.db2.gz XVUFYJVPCMPBPC-CYBMUJFWSA-N 2 1 387.355 3.384 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(F)cc1I ZINC000417857258 566178411 /nfs/dbraw/zinc/17/84/11/566178411.db2.gz NTXRSUFBZFYGTL-LLVKDONJSA-N 2 1 387.240 3.361 20 0 GGADMP CC[NH2+][C@H](C)CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000417982153 566186311 /nfs/dbraw/zinc/18/63/11/566186311.db2.gz BADQGBRQEQHSDM-CYBMUJFWSA-N 2 1 387.355 3.255 20 0 GGADMP CN(C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)C1CC([NH3+])C1 ZINC000417982182 566186566 /nfs/dbraw/zinc/18/65/66/566186566.db2.gz BFBHJLOXJCPSJB-UHFFFAOYSA-N 2 1 385.339 3.089 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(Br)nc1 ZINC000290762141 566187619 /nfs/dbraw/zinc/18/76/19/566187619.db2.gz ROZFWTCLABNCDI-IAOVAPTHSA-N 2 1 382.346 3.263 20 0 GGADMP CC(C)[C@@H]([NH3+])CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000417992749 566187791 /nfs/dbraw/zinc/18/77/91/566187791.db2.gz NABWYWIHJNHQBS-KRWDZBQOSA-N 2 1 387.355 3.240 20 0 GGADMP C[N@@H+](CCCC[NH2+]Cc1ccc(F)cc1I)C1CC1 ZINC000418084909 566196405 /nfs/dbraw/zinc/19/64/05/566196405.db2.gz SISLPMWUXFHVIN-UHFFFAOYSA-N 2 1 376.257 3.394 20 0 GGADMP Brc1cc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc2c1OCCCO2 ZINC000368789432 566245461 /nfs/dbraw/zinc/24/54/61/566245461.db2.gz DABIGJONOQPMRZ-HUUCEWRRSA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc2c1OCCCO2 ZINC000368789432 566245463 /nfs/dbraw/zinc/24/54/63/566245463.db2.gz DABIGJONOQPMRZ-HUUCEWRRSA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc2c1OCCCO2 ZINC000368789432 566245465 /nfs/dbraw/zinc/24/54/65/566245465.db2.gz DABIGJONOQPMRZ-HUUCEWRRSA-N 2 1 381.314 3.327 20 0 GGADMP CC[NH+](CC)CCSCC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000266146118 566246504 /nfs/dbraw/zinc/24/65/04/566246504.db2.gz MTVYKNDBJMDCQY-QGZVFWFLSA-N 2 1 383.627 3.151 20 0 GGADMP CC[NH+](CC)CCSCC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000266170414 566246872 /nfs/dbraw/zinc/24/68/72/566246872.db2.gz SDEGUOGTYCVJIY-UHFFFAOYSA-N 2 1 381.611 3.249 20 0 GGADMP [NH3+]C[C@H]([NH2+]CCC(=O)Nc1ccc(Br)cc1F)C1CCCCC1 ZINC000420377653 566273288 /nfs/dbraw/zinc/27/32/88/566273288.db2.gz WILXQSSNBFXZLZ-INIZCTEOSA-N 2 1 386.309 3.414 20 0 GGADMP COc1c(Br)cccc1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000482001403 566274924 /nfs/dbraw/zinc/27/49/24/566274924.db2.gz WLFFREZHHMBWIQ-UHFFFAOYSA-N 2 1 397.357 3.392 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cccc(Br)c2OC)C1 ZINC000482011979 566275308 /nfs/dbraw/zinc/27/53/08/566275308.db2.gz CSRKDJQHNTVOMV-INIZCTEOSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cccc(Br)c2OC)C1 ZINC000482011979 566275311 /nfs/dbraw/zinc/27/53/11/566275311.db2.gz CSRKDJQHNTVOMV-INIZCTEOSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccc(Br)cn1 ZINC000482155228 566287365 /nfs/dbraw/zinc/28/73/65/566287365.db2.gz HRTMECVOPTUKIT-GOEBONIOSA-N 2 1 397.361 3.273 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)C[N@@H+](C)[C@H]2CCSC2)c2cccs2)CC1 ZINC000535317060 566296278 /nfs/dbraw/zinc/29/62/78/566296278.db2.gz CDVWTTXIVRGLHM-IRXDYDNUSA-N 2 1 381.611 3.075 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)c(Br)c1 ZINC000669618845 566314954 /nfs/dbraw/zinc/31/49/54/566314954.db2.gz GGJAHGDULJNUMY-CQSZACIVSA-N 2 1 384.362 3.134 20 0 GGADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1 ZINC000482539749 566316592 /nfs/dbraw/zinc/31/65/92/566316592.db2.gz SLBSYBXPBFOSSE-DOTOQJQBSA-N 2 1 383.989 3.388 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+]1CCCN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000482641868 566323008 /nfs/dbraw/zinc/32/30/08/566323008.db2.gz LDQOHHLLZASIAO-NEPJUHHUSA-N 2 1 376.353 3.362 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+]1CCCN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000482641868 566323013 /nfs/dbraw/zinc/32/30/13/566323013.db2.gz LDQOHHLLZASIAO-NEPJUHHUSA-N 2 1 376.353 3.362 20 0 GGADMP C[C@@H]1[C@H](C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CC[N@@H+]1C ZINC000648859161 566323441 /nfs/dbraw/zinc/32/34/41/566323441.db2.gz GZZPFECRKJMMFR-FZKQIMNGSA-N 2 1 384.351 3.414 20 0 GGADMP C[C@@H]1[C@H](C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CC[N@H+]1C ZINC000648859161 566323450 /nfs/dbraw/zinc/32/34/50/566323450.db2.gz GZZPFECRKJMMFR-FZKQIMNGSA-N 2 1 384.351 3.414 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+]1CCCN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000482641870 566323822 /nfs/dbraw/zinc/32/38/22/566323822.db2.gz LDQOHHLLZASIAO-RYUDHWBXSA-N 2 1 376.353 3.362 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+]1CCCN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000482641870 566323827 /nfs/dbraw/zinc/32/38/27/566323827.db2.gz LDQOHHLLZASIAO-RYUDHWBXSA-N 2 1 376.353 3.362 20 0 GGADMP C[N@H+]1CC[C@]2(C1)CCCN([C@@H]1CCc3cc(Br)ccc3NC1=O)C2 ZINC000625452070 566325472 /nfs/dbraw/zinc/32/54/72/566325472.db2.gz OOWUTYMTCGMRRU-MJGOQNOKSA-N 2 1 392.341 3.120 20 0 GGADMP CN(C(=O)Cc1cc(Cl)cc(Cl)c1)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000625502045 566330211 /nfs/dbraw/zinc/33/02/11/566330211.db2.gz MKWMUVBCPVPAHW-SFHVURJKSA-N 2 1 384.351 3.163 20 0 GGADMP CN(C(=O)Cc1cc(Cl)cc(Cl)c1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000625502045 566330219 /nfs/dbraw/zinc/33/02/19/566330219.db2.gz MKWMUVBCPVPAHW-SFHVURJKSA-N 2 1 384.351 3.163 20 0 GGADMP CC[C@@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc(Br)c1 ZINC000482874691 566339246 /nfs/dbraw/zinc/33/92/46/566339246.db2.gz JKJDYVBZWNFVPQ-GOSISDBHSA-N 2 1 396.373 3.433 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1cc(Br)cc2F ZINC000482882202 566341377 /nfs/dbraw/zinc/34/13/77/566341377.db2.gz AFESODZPLCNHAB-KSSFIOAISA-N 2 1 385.321 3.402 20 0 GGADMP COc1c(Br)cc(C[NH2+]C2(C)CC[NH2+]CC2)cc1Br ZINC000556932792 566346580 /nfs/dbraw/zinc/34/65/80/566346580.db2.gz LJWOPONOAOBZLY-UHFFFAOYSA-N 2 1 392.135 3.452 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)C[N@@H+](C)[C@@H]1CCSC1)c1ccccc1Cl ZINC000536072069 566349357 /nfs/dbraw/zinc/34/93/57/566349357.db2.gz HDKKPLZHZFVTBW-QAPCUYQASA-N 2 1 383.989 3.276 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+]Cc1c(F)ccc(I)c1F ZINC000510023959 566356761 /nfs/dbraw/zinc/35/67/61/566356761.db2.gz OVZXPEKBPORZIX-UHFFFAOYSA-N 2 1 391.203 3.254 20 0 GGADMP Brc1ccc2nc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)oc2c1 ZINC000463087122 566383222 /nfs/dbraw/zinc/38/32/22/566383222.db2.gz UTHDFZFYURVCIE-UHFFFAOYSA-N 2 1 394.313 3.135 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCc2nc(C(F)(F)F)cs2)[C@@H](C)C1 ZINC000483862395 566405245 /nfs/dbraw/zinc/40/52/45/566405245.db2.gz LOQBXOBMEMJLMA-UONOGXRCSA-N 2 1 379.492 3.431 20 0 GGADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(Br)cc1OCCCO ZINC000463373897 566405467 /nfs/dbraw/zinc/40/54/67/566405467.db2.gz YWOQJMKNNXRBPM-HOCLYGCPSA-N 2 1 385.346 3.345 20 0 GGADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Br)cc1OCCCO ZINC000463373897 566405469 /nfs/dbraw/zinc/40/54/69/566405469.db2.gz YWOQJMKNNXRBPM-HOCLYGCPSA-N 2 1 385.346 3.345 20 0 GGADMP CN(C(=O)CSc1ccc(Cl)cc1)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000601472262 566407675 /nfs/dbraw/zinc/40/76/75/566407675.db2.gz GELCWUBPPIAXGB-KRWDZBQOSA-N 2 1 381.973 3.059 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC[N@@H+]1C ZINC000536890243 566408596 /nfs/dbraw/zinc/40/85/96/566408596.db2.gz PUCMZKAAJINMGL-QAPCUYQASA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC[N@H+]1C ZINC000536890243 566408605 /nfs/dbraw/zinc/40/86/05/566408605.db2.gz PUCMZKAAJINMGL-QAPCUYQASA-N 2 1 380.374 3.486 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H](C)[C@H](OC)c2ccc(Br)cc2)CC1 ZINC000537014785 566417602 /nfs/dbraw/zinc/41/76/02/566417602.db2.gz ZWUWZEMGXFWTKQ-KSSFIOAISA-N 2 1 385.346 3.226 20 0 GGADMP Fc1cc(Br)ccc1CCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1 ZINC000484778322 566453467 /nfs/dbraw/zinc/45/34/67/566453467.db2.gz SPEPBORSYFPBGH-NXHRZFHOSA-N 2 1 385.321 3.268 20 0 GGADMP CC(C)(CC[NH3+])NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422592168 566458250 /nfs/dbraw/zinc/45/82/50/566458250.db2.gz DBVAMJZKDGGDRG-UHFFFAOYSA-N 2 1 387.355 3.384 20 0 GGADMP CC(C)(CC[NH3+])NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000422624319 566459506 /nfs/dbraw/zinc/45/95/06/566459506.db2.gz ZAVKUPSTGSBJRU-UHFFFAOYSA-N 2 1 387.355 3.384 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(OC)ccc2Br)C1 ZINC000537649300 566459697 /nfs/dbraw/zinc/45/96/97/566459697.db2.gz YZDKWGOFDKOQSR-KRWDZBQOSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cc(OC)ccc2Br)C1 ZINC000537649300 566459708 /nfs/dbraw/zinc/45/97/08/566459708.db2.gz YZDKWGOFDKOQSR-KRWDZBQOSA-N 2 1 385.346 3.390 20 0 GGADMP C[C@@H]([NH3+])C[C@H](C)NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000577749116 566460794 /nfs/dbraw/zinc/46/07/94/566460794.db2.gz MIGCLODPDQEVPV-OLZOCXBDSA-N 2 1 387.355 3.383 20 0 GGADMP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000422989144 566469853 /nfs/dbraw/zinc/46/98/53/566469853.db2.gz KMESZRBPHFHEBF-IRXDYDNUSA-N 2 1 382.346 3.035 20 0 GGADMP C[N@H+](CC(=O)Nc1ccc(SCC[NH+]2CCCC2)cc1)[C@@H]1CCSC1 ZINC000650680267 566470107 /nfs/dbraw/zinc/47/01/07/566470107.db2.gz XJCIPHFCLVXLJC-QGZVFWFLSA-N 2 1 379.595 3.250 20 0 GGADMP C[N@@H+](CC(=O)Nc1ccc(SCC[NH+]2CCCC2)cc1)[C@@H]1CCSC1 ZINC000650680267 566470110 /nfs/dbraw/zinc/47/01/10/566470110.db2.gz XJCIPHFCLVXLJC-QGZVFWFLSA-N 2 1 379.595 3.250 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)cc1Br ZINC000650705854 566471788 /nfs/dbraw/zinc/47/17/88/566471788.db2.gz YRBHEASJYXKIRQ-DAYGRLMNSA-N 2 1 383.330 3.176 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)cc1Br ZINC000650705855 566472024 /nfs/dbraw/zinc/47/20/24/566472024.db2.gz YRBHEASJYXKIRQ-HDMKZQKVSA-N 2 1 383.330 3.176 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)cc1Br ZINC000650705856 566472242 /nfs/dbraw/zinc/47/22/42/566472242.db2.gz YRBHEASJYXKIRQ-MPGHIAIKSA-N 2 1 383.330 3.176 20 0 GGADMP COc1sc(C[N@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)cc1Br ZINC000650708053 566472276 /nfs/dbraw/zinc/47/22/76/566472276.db2.gz SQIKEQYGMKDVHV-SLEUVZQESA-N 2 1 389.359 3.238 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000650707709 566472388 /nfs/dbraw/zinc/47/23/88/566472388.db2.gz LOIRTVFTZRODRC-HSMVNMDESA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000650707709 566472391 /nfs/dbraw/zinc/47/23/91/566472391.db2.gz LOIRTVFTZRODRC-HSMVNMDESA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](Cc3cc(Br)cc4c3OCC4)C2)C1 ZINC000650708108 566472487 /nfs/dbraw/zinc/47/24/87/566472487.db2.gz TUGJNAXJLJXDLK-QGTPRVQTSA-N 2 1 395.341 3.102 20 0 GGADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H](CO)Cc2ccccc2Br)c2ccccc21 ZINC000423076699 566473671 /nfs/dbraw/zinc/47/36/71/566473671.db2.gz RSQDQOZGUUZQJG-UPRAQXHNSA-N 2 1 375.310 3.335 20 0 GGADMP C[NH+](C)CC1CC[NH+](Cc2nc(-c3ccc(Br)s3)no2)CC1 ZINC000511647335 566478170 /nfs/dbraw/zinc/47/81/70/566478170.db2.gz JJZQCNZHZOCPSF-UHFFFAOYSA-N 2 1 385.331 3.334 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCOc3ccc(I)cc32)CC[NH2+]1 ZINC000423381312 566486300 /nfs/dbraw/zinc/48/63/00/566486300.db2.gz OJJRERSDHBPVST-OSAQELSMSA-N 2 1 386.277 3.235 20 0 GGADMP Cc1cc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@@H](C(N)=O)C2)sc1Br ZINC000512050878 566508257 /nfs/dbraw/zinc/50/82/57/566508257.db2.gz FGTAELLBTWPOTD-QWHCGFSZSA-N 2 1 388.375 3.057 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1)Nc1cccc(Br)c1 ZINC000578324108 566511097 /nfs/dbraw/zinc/51/10/97/566511097.db2.gz RKZJRYXCHUKPAR-CABCVRRESA-N 2 1 380.330 3.099 20 0 GGADMP C[C@@H](Cc1ccc(F)cc1Br)[NH2+]CCCC[N@H+]1CCC[C@@H]1CO ZINC000578395423 566517688 /nfs/dbraw/zinc/51/76/88/566517688.db2.gz AJFCPHHQKGHOOH-WMLDXEAASA-N 2 1 387.337 3.346 20 0 GGADMP C[C@@H](Cc1ccc(F)cc1Br)[NH2+]CCCC[N@H+]1CCC[C@H]1CO ZINC000578395424 566517825 /nfs/dbraw/zinc/51/78/25/566517825.db2.gz AJFCPHHQKGHOOH-YOEHRIQHSA-N 2 1 387.337 3.346 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cc(O)ccc3Br)CC2)C[C@H](C)O1 ZINC000512177877 566517958 /nfs/dbraw/zinc/51/79/58/566517958.db2.gz GUCYTSHFQCBGKM-GASCZTMLSA-N 2 1 397.357 3.476 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cc(O)ccc3Br)CC2)C[C@H](C)O1 ZINC000512177877 566517960 /nfs/dbraw/zinc/51/79/60/566517960.db2.gz GUCYTSHFQCBGKM-GASCZTMLSA-N 2 1 397.357 3.476 20 0 GGADMP C[C@H]1CC2(C[N@H+]1Cc1cc3c(cc1Br)OCCO3)CC[NH2+]CC2 ZINC000424283214 566525200 /nfs/dbraw/zinc/52/52/00/566525200.db2.gz BBJRXKBPBBFPTC-ZDUSSCGKSA-N 2 1 381.314 3.184 20 0 GGADMP C[C@H]1CC2(C[N@H+]1CC(=O)N(C)Cc1ccc(Cl)c(Cl)c1)CC[NH2+]CC2 ZINC000424286054 566525398 /nfs/dbraw/zinc/52/53/98/566525398.db2.gz GVWREHYVYLXYCH-AWEZNQCLSA-N 2 1 384.351 3.416 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1cc(Cl)cc(I)c1 ZINC000424286028 566525570 /nfs/dbraw/zinc/52/55/70/566525570.db2.gz FRZVCZHESACREI-YGRLFVJLSA-N 2 1 378.685 3.374 20 0 GGADMP OC1CC[NH+](CCC[NH2+]C2CC(c3ccc(Br)cc3F)C2)CC1 ZINC000449093585 566527087 /nfs/dbraw/zinc/52/70/87/566527087.db2.gz PCXBGHJFSGUQFB-UHFFFAOYSA-N 2 1 385.321 3.271 20 0 GGADMP C[C@H]1CC2(C[N@H+]1CC(=O)NCCc1cccc(Cl)c1Cl)CC[NH2+]CC2 ZINC000424294430 566527102 /nfs/dbraw/zinc/52/71/02/566527102.db2.gz QIOFJMMLHFUWFH-AWEZNQCLSA-N 2 1 384.351 3.116 20 0 GGADMP C[C@@H](NC(=O)C[N@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2)c1ccc(Br)cc1 ZINC000424301177 566527267 /nfs/dbraw/zinc/52/72/67/566527267.db2.gz XJKIJVBDXNFNSP-LSDHHAIUSA-N 2 1 394.357 3.090 20 0 GGADMP Cc1cc(Br)cn2c(C[N@@H+]3CC4(C[C@@H]3C)CC[NH2+]CC4)cnc12 ZINC000424380551 566530459 /nfs/dbraw/zinc/53/04/59/566530459.db2.gz PXTWRJOZLIMIFN-AWEZNQCLSA-N 2 1 377.330 3.369 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCOc2ncc(Cl)cc2Cl)[C@@H](C)C1 ZINC000539058043 566556035 /nfs/dbraw/zinc/55/60/35/566556035.db2.gz HXWQLWVYYDXBIT-WMLDXEAASA-N 2 1 390.355 3.494 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCOc2ncc(Cl)cc2Cl)[C@@H](C)C1 ZINC000539058044 566556293 /nfs/dbraw/zinc/55/62/93/566556293.db2.gz HXWQLWVYYDXBIT-YOEHRIQHSA-N 2 1 390.355 3.494 20 0 GGADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CCC(CS(C)(=O)=O)CC2)[C@@H]1c1cccs1 ZINC000559767393 566569126 /nfs/dbraw/zinc/56/91/26/566569126.db2.gz SJVQJZPOSISOJW-FLAMNCDFSA-N 2 1 384.611 3.324 20 0 GGADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CCC(CS(C)(=O)=O)CC2)[C@@H]1c1cccs1 ZINC000559767393 566569138 /nfs/dbraw/zinc/56/91/38/566569138.db2.gz SJVQJZPOSISOJW-FLAMNCDFSA-N 2 1 384.611 3.324 20 0 GGADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CCC(CS(C)(=O)=O)CC2)[C@@H]1c1cccs1 ZINC000559767395 566569786 /nfs/dbraw/zinc/56/97/86/566569786.db2.gz SJVQJZPOSISOJW-MPLMCADHSA-N 2 1 384.611 3.324 20 0 GGADMP C[N@H+]1CCC[C@H](C[NH2+]C2CCC(CS(C)(=O)=O)CC2)[C@@H]1c1cccs1 ZINC000559767395 566569792 /nfs/dbraw/zinc/56/97/92/566569792.db2.gz SJVQJZPOSISOJW-MPLMCADHSA-N 2 1 384.611 3.324 20 0 GGADMP C[C@@H]1C[N@H+](C)C[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486233024 566571324 /nfs/dbraw/zinc/57/13/24/566571324.db2.gz UZFLNFMTCBEBGV-CZUORRHYSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486233024 566571327 /nfs/dbraw/zinc/57/13/27/566571327.db2.gz UZFLNFMTCBEBGV-CZUORRHYSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C[C@H](O)C[NH+]1CCCC1 ZINC000539308160 566572431 /nfs/dbraw/zinc/57/24/31/566572431.db2.gz HVCFSAOIXILTKM-HACGYAERSA-N 2 1 385.371 3.278 20 0 GGADMP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C[C@@H](O)C[NH+]1CCCC1 ZINC000539308163 566572610 /nfs/dbraw/zinc/57/26/10/566572610.db2.gz HVCFSAOIXILTKM-MRRJBJDNSA-N 2 1 385.371 3.278 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+]Cc2c[nH+]ccc2N(C)C)cc1Br ZINC000449596498 566578621 /nfs/dbraw/zinc/57/86/21/566578621.db2.gz BNVACFOKGGMOMH-INIZCTEOSA-N 2 1 392.341 3.159 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2ccc(C)c(Br)c2)[C@H](C)C1 ZINC000449599170 566580459 /nfs/dbraw/zinc/58/04/59/566580459.db2.gz KDBPTNQEQPNNID-SUMDDJOVSA-N 2 1 383.374 3.228 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2ccc(F)c(Br)c2)[C@@H](C)C1 ZINC000449680467 566591484 /nfs/dbraw/zinc/59/14/84/566591484.db2.gz HAYUSDKBWWSBRS-JOQOYGCGSA-N 2 1 387.337 3.059 20 0 GGADMP COc1cc2[nH+]ccc(NC[C@H]3CC[N@H+](C4CC4)C3)c2cc1Br ZINC000579229949 566592057 /nfs/dbraw/zinc/59/20/57/566592057.db2.gz LPTASSRWBNXUNG-GFCCVEGCSA-N 2 1 376.298 3.324 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](CC(=O)Nc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000652345667 566602909 /nfs/dbraw/zinc/60/29/09/566602909.db2.gz IHFQPDFOMCQOIS-XNJGSVPQSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3cn4cc(Cl)cc(Cl)c4n3)C2)C1 ZINC000652348383 566603324 /nfs/dbraw/zinc/60/33/24/566603324.db2.gz BOBUJLOOVHQVHF-MRRJBJDNSA-N 2 1 383.323 3.359 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](Cc3cn4cc(Cl)cc(Cl)c4n3)C2)C1 ZINC000652348383 566603330 /nfs/dbraw/zinc/60/33/30/566603330.db2.gz BOBUJLOOVHQVHF-MRRJBJDNSA-N 2 1 383.323 3.359 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](CC(=O)Nc3ccc(Cl)cc3Cl)C2)C1 ZINC000652346111 566603682 /nfs/dbraw/zinc/60/36/82/566603682.db2.gz UDQKSFJURKRJDK-DXCKQFNASA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](CC(=O)Nc3ccc(Cl)cc3Cl)C2)C1 ZINC000652346111 566603688 /nfs/dbraw/zinc/60/36/88/566603688.db2.gz UDQKSFJURKRJDK-DXCKQFNASA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](CCOc3cccc(Br)c3)C2)C1 ZINC000652349415 566603886 /nfs/dbraw/zinc/60/38/86/566603886.db2.gz OJUHWLASINSCRC-LESCRADOSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3cn4cc(Cl)cc(Cl)c4n3)C2)C1 ZINC000652348384 566604006 /nfs/dbraw/zinc/60/40/06/566604006.db2.gz BOBUJLOOVHQVHF-QEORTHHSSA-N 2 1 383.323 3.359 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](Cc3cn4cc(Cl)cc(Cl)c4n3)C2)C1 ZINC000652348384 566604009 /nfs/dbraw/zinc/60/40/09/566604009.db2.gz BOBUJLOOVHQVHF-QEORTHHSSA-N 2 1 383.323 3.359 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](CCOc3ccc(Br)cc3)C2)C1 ZINC000652345980 566604017 /nfs/dbraw/zinc/60/40/17/566604017.db2.gz QKMNAKALSVENQR-KYJSFNMBSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+]C[C@]12CCC[C@H]1C[N@@H+](Cc1ccnc(-c3ccc(Br)cc3)n1)C2 ZINC000652352734 566604497 /nfs/dbraw/zinc/60/44/97/566604497.db2.gz RVUCXGZBXXAMOB-KXBFYZLASA-N 2 1 387.325 3.467 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2CC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000652360310 566604895 /nfs/dbraw/zinc/60/48/95/566604895.db2.gz FEXMIKJQYFVULH-JLZZUVOBSA-N 2 1 386.323 3.293 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@H+]2CC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000652360310 566604904 /nfs/dbraw/zinc/60/49/04/566604904.db2.gz FEXMIKJQYFVULH-JLZZUVOBSA-N 2 1 386.323 3.293 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2CC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000652360309 566605304 /nfs/dbraw/zinc/60/53/04/566605304.db2.gz FEXMIKJQYFVULH-DQYPLSBCSA-N 2 1 386.323 3.293 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@H+]2CC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000652360309 566605307 /nfs/dbraw/zinc/60/53/07/566605307.db2.gz FEXMIKJQYFVULH-DQYPLSBCSA-N 2 1 386.323 3.293 20 0 GGADMP Cc1cc(C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)sc1Br ZINC000513572548 566609540 /nfs/dbraw/zinc/60/95/40/566609540.db2.gz NHFOYCCIHIHCLG-ZDUSSCGKSA-N 2 1 375.376 3.344 20 0 GGADMP CSc1cc(Br)ccc1C[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000674878696 566615133 /nfs/dbraw/zinc/61/51/33/566615133.db2.gz OJXCPJIKVDSMNZ-UHFFFAOYSA-N 2 1 386.403 3.288 20 0 GGADMP COc1cc2[nH+]ccc(N[C@H]3CC[N@H+]4CCC[C@@H]4C3)c2cc1Br ZINC000425209608 566617480 /nfs/dbraw/zinc/61/74/80/566617480.db2.gz SDDIRRBVDHSJMC-QWHCGFSZSA-N 2 1 376.298 3.467 20 0 GGADMP Cc1cc(Br)c(C[N@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)s1 ZINC000560360019 566618637 /nfs/dbraw/zinc/61/86/37/566618637.db2.gz PSLQLINSVVEPCK-OAHLLOKOSA-N 2 1 386.403 3.419 20 0 GGADMP Cc1cc(Br)c(C[N@@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)s1 ZINC000560360019 566618643 /nfs/dbraw/zinc/61/86/43/566618643.db2.gz PSLQLINSVVEPCK-OAHLLOKOSA-N 2 1 386.403 3.419 20 0 GGADMP Brc1cnn(CC[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000560580592 566640769 /nfs/dbraw/zinc/64/07/69/566640769.db2.gz KVUIMZZSTNZZAT-QXAKKESOSA-N 2 1 389.341 3.146 20 0 GGADMP OC1(C[NH+]2CCOCC2)CC[NH+](Cc2sc3ccccc3c2Cl)CC1 ZINC000540297580 566641742 /nfs/dbraw/zinc/64/17/42/566641742.db2.gz URNXHHWMGGJBLC-UHFFFAOYSA-N 2 1 380.941 3.214 20 0 GGADMP C[C@@H]1C[N@H+](C)C[C@@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487013160 566643326 /nfs/dbraw/zinc/64/33/26/566643326.db2.gz LGBYQCHWTJQERE-ACJLOTCBSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487013160 566643331 /nfs/dbraw/zinc/64/33/31/566643331.db2.gz LGBYQCHWTJQERE-ACJLOTCBSA-N 2 1 384.351 3.272 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc2c(cc1Br)OCCO2 ZINC000540373977 566648807 /nfs/dbraw/zinc/64/88/07/566648807.db2.gz BNODHGUOFCGKDU-LBPRGKRZSA-N 2 1 380.286 3.466 20 0 GGADMP C[NH+]1CCN([C@H](C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c2cccs2)CC1 ZINC000675723839 566660951 /nfs/dbraw/zinc/66/09/51/566660951.db2.gz BFZTUTCFECWWCP-RBUKOAKNSA-N 2 1 375.969 3.447 20 0 GGADMP O=C1Nc2ccc(Br)cc2CC[C@@H]1[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000629533130 566664385 /nfs/dbraw/zinc/66/43/85/566664385.db2.gz ITYGZQYMNVTZNB-DAYGRLMNSA-N 2 1 392.341 3.024 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](CCOc2cccc(Br)c2)CC[C@H]1C(F)(F)F ZINC000629562505 566666371 /nfs/dbraw/zinc/66/63/71/566666371.db2.gz NQTJZHQHEJFOKC-BXUZGUMPSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCOc2cccc(Br)c2)CC[C@H]1C(F)(F)F ZINC000629562505 566666374 /nfs/dbraw/zinc/66/63/74/566666374.db2.gz NQTJZHQHEJFOKC-BXUZGUMPSA-N 2 1 381.236 3.287 20 0 GGADMP O[C@H]1CCCC[C@H]1C[N@@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000580198020 566672496 /nfs/dbraw/zinc/67/24/96/566672496.db2.gz OBMMKGMXPJOJHH-HOCLYGCPSA-N 2 1 382.302 3.292 20 0 GGADMP C[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(Br)cn1 ZINC000676064163 566673563 /nfs/dbraw/zinc/67/35/63/566673563.db2.gz FKUUMGCBJYUWOV-CQSZACIVSA-N 2 1 393.329 3.420 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1O ZINC000580245653 566676154 /nfs/dbraw/zinc/67/61/54/566676154.db2.gz YJQCLFBSDCZLQI-AWEZNQCLSA-N 2 1 383.330 3.327 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](C[NH2+]C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000514932705 566679544 /nfs/dbraw/zinc/67/95/44/566679544.db2.gz KNKJBKNUZZYGIO-ZBFHGGJFSA-N 2 1 375.340 3.301 20 0 GGADMP Brc1cc2c(cc1C[N@H+]1CCC[C@H]([C@@H]3CC[NH2+]C3)C1)OCCO2 ZINC000580312397 566682848 /nfs/dbraw/zinc/68/28/48/566682848.db2.gz MQBRBVCHPRUNOL-KGLIPLIRSA-N 2 1 381.314 3.042 20 0 GGADMP Brc1cc2c(cc1C[N@H+]1CCC[C@H]([C@H]3CC[NH2+]C3)C1)OCCO2 ZINC000580312396 566683219 /nfs/dbraw/zinc/68/32/19/566683219.db2.gz MQBRBVCHPRUNOL-KBPBESRZSA-N 2 1 381.314 3.042 20 0 GGADMP O=C(C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000515053349 566687089 /nfs/dbraw/zinc/68/70/89/566687089.db2.gz QKARDBQBVVUEHQ-YESZJQIVSA-N 2 1 380.330 3.288 20 0 GGADMP O=C(C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000515053346 566687217 /nfs/dbraw/zinc/68/72/17/566687217.db2.gz QKARDBQBVVUEHQ-BRWVUGGUSA-N 2 1 380.330 3.288 20 0 GGADMP Brc1ccc(-n2cc(C[N@H+]3CCC[C@H]([C@@H]4CC[NH2+]C4)C3)cn2)cc1 ZINC000515061150 566689016 /nfs/dbraw/zinc/68/90/16/566689016.db2.gz TXHXVEFOWSQLPO-SJORKVTESA-N 2 1 389.341 3.456 20 0 GGADMP Brc1ccc(-n2cc(C[N@H+]3CCC[C@@H]([C@H]4CC[NH2+]C4)C3)cn2)cc1 ZINC000515061147 566690011 /nfs/dbraw/zinc/69/00/11/566690011.db2.gz TXHXVEFOWSQLPO-DLBZAZTESA-N 2 1 389.341 3.456 20 0 GGADMP CN(CC[NH+](C)C)C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000541478359 566727346 /nfs/dbraw/zinc/72/73/46/566727346.db2.gz LPWFPTAGJGUCDS-UHFFFAOYSA-N 2 1 387.355 3.161 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(Br)ccc3F)CC2)CC1 ZINC000541661962 566741154 /nfs/dbraw/zinc/74/11/54/566741154.db2.gz FHMLMGXLDMUYIM-UHFFFAOYSA-N 2 1 398.364 3.438 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]Cc2cn3ccc(Br)cc3n2)C[C@H](C)O1 ZINC000581053815 566745619 /nfs/dbraw/zinc/74/56/19/566745619.db2.gz NLUSKVMNASCYCN-GASCZTMLSA-N 2 1 395.345 3.076 20 0 GGADMP CC[C@@H]1[NH2+]CC[C@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000581130571 566752693 /nfs/dbraw/zinc/75/26/93/566752693.db2.gz RHNWQEVPQBBXRX-MSOLQXFVSA-N 2 1 384.351 3.462 20 0 GGADMP C[N@@H+](Cc1ccc(F)c(Br)c1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000677801145 566763541 /nfs/dbraw/zinc/76/35/41/566763541.db2.gz DRAYJPANCLQYII-MRXNPFEDSA-N 2 1 384.337 3.189 20 0 GGADMP Brc1cccc(-c2noc(C[N@H+]3CCC[C@H]([C@@H]4CC[NH2+]C4)C3)n2)c1 ZINC000516469848 566764975 /nfs/dbraw/zinc/76/49/75/566764975.db2.gz XJNKBPBHYMDECN-CABCVRRESA-N 2 1 391.313 3.321 20 0 GGADMP O=C(C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)Nc1cccc(Br)c1 ZINC000581364198 566769959 /nfs/dbraw/zinc/76/99/59/566769959.db2.gz IUPPPNRFBJHKEG-IXDOHACOSA-N 2 1 380.330 3.288 20 0 GGADMP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccncc3Br)cc2)CC1 ZINC000631066033 566775869 /nfs/dbraw/zinc/77/58/69/566775869.db2.gz ROPMVCBSSHMWFB-UHFFFAOYSA-N 2 1 390.325 3.091 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3ccncc3Br)CC2)nc(C)[nH+]1 ZINC000631085531 566778471 /nfs/dbraw/zinc/77/84/71/566778471.db2.gz MMJTVAZTVMRFNF-UHFFFAOYSA-N 2 1 376.302 3.010 20 0 GGADMP CCC[N@@H+](C)[C@H](CNC(=O)C[NH+](C)[C@H]1CCSC1)c1ccc(Cl)cc1 ZINC000581445462 566778549 /nfs/dbraw/zinc/77/85/49/566778549.db2.gz BOEXFMNLCYETKJ-ZWKOTPCHSA-N 2 1 383.989 3.276 20 0 GGADMP CCC[NH+](C)[C@H](CNC(=O)C[N@H+](C)[C@H]1CCSC1)c1ccc(Cl)cc1 ZINC000581445462 566778555 /nfs/dbraw/zinc/77/85/55/566778555.db2.gz BOEXFMNLCYETKJ-ZWKOTPCHSA-N 2 1 383.989 3.276 20 0 GGADMP CC[C@@H](c1ccc(Br)cc1)N1CCC([N@H+]2CCC[C@H]2C(N)=O)CC1 ZINC000678079717 566780300 /nfs/dbraw/zinc/78/03/00/566780300.db2.gz AOULZSZLODITGE-ROUUACIJSA-N 2 1 394.357 3.314 20 0 GGADMP CC(C)c1nn(-c2ccc(Br)cc2)cc1C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000678343426 566795577 /nfs/dbraw/zinc/79/55/77/566795577.db2.gz SGJIHXLWPLKYEN-GJZGRUSLSA-N 2 1 389.341 3.409 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(F)ccc3Br)CC2)CC1 ZINC000542592184 566813192 /nfs/dbraw/zinc/81/31/92/566813192.db2.gz YSOQAJKQXZWQLW-UHFFFAOYSA-N 2 1 398.364 3.438 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000469874318 566822963 /nfs/dbraw/zinc/82/29/63/566822963.db2.gz QCCLHHDHXVJHSC-MORSLUCNSA-N 2 1 375.314 3.112 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cc(Br)c4c(c3)OCCCO4)C[C@H]21 ZINC000469873611 566823103 /nfs/dbraw/zinc/82/31/03/566823103.db2.gz NLCKGEKNPLLELR-IIAWOOMASA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3cc(Br)c4c(c3)OCCCO4)C[C@H]21 ZINC000469873611 566823107 /nfs/dbraw/zinc/82/31/07/566823107.db2.gz NLCKGEKNPLLELR-IIAWOOMASA-N 2 1 381.314 3.170 20 0 GGADMP CCOc1cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)cc(Br)c1OC ZINC000469871430 566823828 /nfs/dbraw/zinc/82/38/28/566823828.db2.gz GUHGMOSDSQXNRS-SQWLQELKSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1cc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)cc(Br)c1OC ZINC000469871430 566823834 /nfs/dbraw/zinc/82/38/34/566823834.db2.gz GUHGMOSDSQXNRS-SQWLQELKSA-N 2 1 383.330 3.416 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000469877935 566823944 /nfs/dbraw/zinc/82/39/44/566823944.db2.gz IOLFPMIRZRHSAL-BMGDILEWSA-N 2 1 397.357 3.424 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000469877935 566823952 /nfs/dbraw/zinc/82/39/52/566823952.db2.gz IOLFPMIRZRHSAL-BMGDILEWSA-N 2 1 397.357 3.424 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000469877937 566824030 /nfs/dbraw/zinc/82/40/30/566824030.db2.gz IOLFPMIRZRHSAL-QGTPRVQTSA-N 2 1 397.357 3.424 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000469877937 566824036 /nfs/dbraw/zinc/82/40/36/566824036.db2.gz IOLFPMIRZRHSAL-QGTPRVQTSA-N 2 1 397.357 3.424 20 0 GGADMP Brc1cccc(OCC[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)c1 ZINC000655699846 566836137 /nfs/dbraw/zinc/83/61/37/566836137.db2.gz CETPVJADJHSWQW-GOSISDBHSA-N 2 1 383.330 3.061 20 0 GGADMP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3cccc(Br)c3)nc2C)C1 ZINC000655711331 566837671 /nfs/dbraw/zinc/83/76/71/566837671.db2.gz HPKKAPKEOAOHKH-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2cn(-c3cccc(Br)c3)nc2C)C1 ZINC000655711331 566837682 /nfs/dbraw/zinc/83/76/82/566837682.db2.gz HPKKAPKEOAOHKH-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP Brc1ccccc1C1(C[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)CC1 ZINC000655715540 566838195 /nfs/dbraw/zinc/83/81/95/566838195.db2.gz LGQXLQSTENXQDD-INIZCTEOSA-N 2 1 379.342 3.324 20 0 GGADMP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccccc3Br)nc2C)C1 ZINC000655710956 566838333 /nfs/dbraw/zinc/83/83/33/566838333.db2.gz DXMPHPLFKALGPR-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccccc3Br)nc2C)C1 ZINC000655710956 566838338 /nfs/dbraw/zinc/83/83/38/566838338.db2.gz DXMPHPLFKALGPR-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)Oc1ccccc1Br ZINC000655719342 566838387 /nfs/dbraw/zinc/83/83/87/566838387.db2.gz RPYJEGGCRWHYNW-DOTOQJQBSA-N 2 1 397.357 3.449 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)Oc1ccccc1Br ZINC000655718501 566838480 /nfs/dbraw/zinc/83/84/80/566838480.db2.gz KXEGGVIXDWCRBI-GOEBONIOSA-N 2 1 383.330 3.059 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)Oc1ccccc1Br ZINC000655719343 566838903 /nfs/dbraw/zinc/83/89/03/566838903.db2.gz RPYJEGGCRWHYNW-NVXWUHKLSA-N 2 1 397.357 3.449 20 0 GGADMP Clc1ccc(Br)c(CC[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)c1 ZINC000655734676 566841266 /nfs/dbraw/zinc/84/12/66/566841266.db2.gz LYZIVXMICUEBEC-MRXNPFEDSA-N 2 1 387.749 3.488 20 0 GGADMP COc1cc(Br)ccc1CCC[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655754210 566844632 /nfs/dbraw/zinc/84/46/32/566844632.db2.gz MYJWDTZFWYNXNJ-SFHVURJKSA-N 2 1 397.357 3.233 20 0 GGADMP Clc1cc(Br)ccc1CC[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655772453 566847794 /nfs/dbraw/zinc/84/77/94/566847794.db2.gz WBCPAAMXVAQUSC-MRXNPFEDSA-N 2 1 387.749 3.488 20 0 GGADMP O=C1[C@@H]([NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)CCN1c1ccc(Cl)cc1Cl ZINC000563149537 566860346 /nfs/dbraw/zinc/86/03/46/566860346.db2.gz BMKHDYKIKXSEHN-KDOFPFPSSA-N 2 1 382.335 3.420 20 0 GGADMP CC[N@H+](Cc1cccc(Br)c1)C[C@H](O)[C@@H]([NH3+])Cc1ccccc1 ZINC000563155262 566860504 /nfs/dbraw/zinc/86/05/04/566860504.db2.gz DNZILTLRJISPKB-OALUTQOASA-N 2 1 377.326 3.202 20 0 GGADMP C[C@@H]1C[N@H+](CCOc2cc(Cl)cc(Cl)c2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000490632673 566872593 /nfs/dbraw/zinc/87/25/93/566872593.db2.gz SXSGUEIPFWJIMG-DNVCBOLYSA-N 2 1 386.367 3.330 20 0 GGADMP C[C@@H]1C[N@@H+](CCOc2cc(Cl)cc(Cl)c2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000490632673 566872596 /nfs/dbraw/zinc/87/25/96/566872596.db2.gz SXSGUEIPFWJIMG-DNVCBOLYSA-N 2 1 386.367 3.330 20 0 GGADMP O=C(CC[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)Nc1cc(Cl)cc(Cl)c1 ZINC000656260846 566895861 /nfs/dbraw/zinc/89/58/61/566895861.db2.gz WSLSWQDVCUMIID-QGZVFWFLSA-N 2 1 386.323 3.165 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](Cc2ccc(Br)c3cccnc23)CC12CCOCC2 ZINC000582905611 566905727 /nfs/dbraw/zinc/90/57/27/566905727.db2.gz VRYOPMVAWLMKNZ-OAHLLOKOSA-N 2 1 390.325 3.185 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](Cc2ccc(Br)c3cccnc23)CC12CCOCC2 ZINC000582905611 566905733 /nfs/dbraw/zinc/90/57/33/566905733.db2.gz VRYOPMVAWLMKNZ-OAHLLOKOSA-N 2 1 390.325 3.185 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)CC[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000680479012 566911103 /nfs/dbraw/zinc/91/11/03/566911103.db2.gz RBWGMAUVHYGINY-JKSUJKDBSA-N 2 1 380.330 3.303 20 0 GGADMP O=C(NC[C@H]1CCC[NH2+]1)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000518940460 566911887 /nfs/dbraw/zinc/91/18/87/566911887.db2.gz OMZPWIGPPAQPDQ-QGZVFWFLSA-N 2 1 385.339 3.009 20 0 GGADMP C(C[NH+]1CCC[C@@]2(CCSC2)C1)OCC[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451986409 566918642 /nfs/dbraw/zinc/91/86/42/566918642.db2.gz XNUHOLVPIDHEHG-BGYRXZFFSA-N 2 1 384.655 3.441 20 0 GGADMP C(C[NH+]1CCC[C@]2(CCSC2)C1)OCC[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451986409 566918649 /nfs/dbraw/zinc/91/86/49/566918649.db2.gz XNUHOLVPIDHEHG-BGYRXZFFSA-N 2 1 384.655 3.441 20 0 GGADMP C(C[NH+]1CCC[C@]2(CCSC2)C1)OCC[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451986409 566918653 /nfs/dbraw/zinc/91/86/53/566918653.db2.gz XNUHOLVPIDHEHG-BGYRXZFFSA-N 2 1 384.655 3.441 20 0 GGADMP C[C@@H](NCc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(Br)cn1 ZINC000583178963 566927304 /nfs/dbraw/zinc/92/73/04/566927304.db2.gz WHGCUJCJQRBJAS-KDOFPFPSSA-N 2 1 390.325 3.262 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(Br)cn1 ZINC000583178963 566927313 /nfs/dbraw/zinc/92/73/13/566927313.db2.gz WHGCUJCJQRBJAS-KDOFPFPSSA-N 2 1 390.325 3.262 20 0 GGADMP COc1c(Br)cc(C[N@H+](C)C2CC([NH3+])C2)cc1Br ZINC000583204809 566930036 /nfs/dbraw/zinc/93/00/36/566930036.db2.gz WDQGNBQAXXCFMQ-UHFFFAOYSA-N 2 1 378.108 3.142 20 0 GGADMP COc1c(Br)cc(C[N@@H+](C)C2CC([NH3+])C2)cc1Br ZINC000583204809 566930041 /nfs/dbraw/zinc/93/00/41/566930041.db2.gz WDQGNBQAXXCFMQ-UHFFFAOYSA-N 2 1 378.108 3.142 20 0 GGADMP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCc3sc(Br)cc32)CC1 ZINC000583217368 566930117 /nfs/dbraw/zinc/93/01/17/566930117.db2.gz XWJZJHLHEUDLFK-RBSFLKMASA-N 2 1 385.371 3.465 20 0 GGADMP C[N@H+](C[C@H](O)C[NH2+][C@@H](Cc1cccc(Br)c1)CC1CC1)C1CC1 ZINC000583436703 566951181 /nfs/dbraw/zinc/95/11/81/566951181.db2.gz XIGZRBLBEWTQSU-IEBWSBKVSA-N 2 1 381.358 3.205 20 0 GGADMP C[N@@H+](C[C@H](O)C[NH2+][C@@H](Cc1cccc(Br)c1)CC1CC1)C1CC1 ZINC000583436703 566951185 /nfs/dbraw/zinc/95/11/85/566951185.db2.gz XIGZRBLBEWTQSU-IEBWSBKVSA-N 2 1 381.358 3.205 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000564329424 566965516 /nfs/dbraw/zinc/96/55/16/566965516.db2.gz GRAKBFILXRZJNI-KBPBESRZSA-N 2 1 398.320 3.238 20 0 GGADMP Cc1cc(Br)cc2c1[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)CC2 ZINC000493975044 566966418 /nfs/dbraw/zinc/96/64/18/566966418.db2.gz DWZMGPUNMPFAHG-SFHVURJKSA-N 2 1 380.374 3.362 20 0 GGADMP Brc1csc(-c2noc(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)n2)c1 ZINC000583813036 566985846 /nfs/dbraw/zinc/98/58/46/566985846.db2.gz MBSHQFZKEAAGPX-LBPRGKRZSA-N 2 1 397.342 3.382 20 0 GGADMP C[C@]1(NC(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC[NH2+]C1 ZINC000612878663 567001903 /nfs/dbraw/zinc/00/19/03/567001903.db2.gz LALAVEILLDAGBN-SFHVURJKSA-N 2 1 385.339 3.009 20 0 GGADMP CSc1ccc(Cl)c(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)c1 ZINC000520473559 567008349 /nfs/dbraw/zinc/00/83/49/567008349.db2.gz OXRHKNPEPCYWMR-UHFFFAOYSA-N 2 1 376.913 3.461 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)[C@](C)([NH3+])c1ccc(Br)cc1 ZINC000564892502 567018404 /nfs/dbraw/zinc/01/84/04/567018404.db2.gz YZTSKKVWVJCHLL-RDTXWAMCSA-N 2 1 382.346 3.004 20 0 GGADMP [NH3+]CCCOC1CC[NH+](Cc2ncc(-c3ccccc3Br)o2)CC1 ZINC000430550973 567021632 /nfs/dbraw/zinc/02/16/32/567021632.db2.gz HGXJLZWPDNVUHF-UHFFFAOYSA-N 2 1 394.313 3.434 20 0 GGADMP CC(C)[C@](C)(C[NH3+])[NH2+]CCCOc1cccc(I)c1 ZINC000430586840 567022923 /nfs/dbraw/zinc/02/29/23/567022923.db2.gz UCSCVYTUIWWACA-HNNXBMFYSA-N 2 1 376.282 3.023 20 0 GGADMP CC(C)[C@H]([NH3+])CC[N@H+](C)[C@@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000430583540 567023062 /nfs/dbraw/zinc/02/30/62/567023062.db2.gz MWKCAYCFBOYRSP-WMLDXEAASA-N 2 1 384.362 3.101 20 0 GGADMP CC(C)[C@H]([NH3+])CC[N@@H+](C)[C@@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000430583540 567023065 /nfs/dbraw/zinc/02/30/65/567023065.db2.gz MWKCAYCFBOYRSP-WMLDXEAASA-N 2 1 384.362 3.101 20 0 GGADMP CC[NH2+]CC1CC[NH+](CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000430601374 567024721 /nfs/dbraw/zinc/02/47/21/567024721.db2.gz ZLJJRKHENKNQLJ-UHFFFAOYSA-N 2 1 375.847 3.201 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Br)cc1)[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000564988724 567028089 /nfs/dbraw/zinc/02/80/89/567028089.db2.gz OSFCSYXZFCNQJL-ILXRZTDVSA-N 2 1 380.330 3.098 20 0 GGADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469168 567028429 /nfs/dbraw/zinc/02/84/29/567028429.db2.gz HOYJVIDXTINSBH-WBVHZDCISA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469168 567028432 /nfs/dbraw/zinc/02/84/32/567028432.db2.gz HOYJVIDXTINSBH-WBVHZDCISA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469168 567028434 /nfs/dbraw/zinc/02/84/34/567028434.db2.gz HOYJVIDXTINSBH-WBVHZDCISA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469168 567028437 /nfs/dbraw/zinc/02/84/37/567028437.db2.gz HOYJVIDXTINSBH-WBVHZDCISA-N 2 1 387.351 3.397 20 0 GGADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469166 567028481 /nfs/dbraw/zinc/02/84/81/567028481.db2.gz HOYJVIDXTINSBH-RDJZCZTQSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469166 567028485 /nfs/dbraw/zinc/02/84/85/567028485.db2.gz HOYJVIDXTINSBH-RDJZCZTQSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469166 567028488 /nfs/dbraw/zinc/02/84/88/567028488.db2.gz HOYJVIDXTINSBH-RDJZCZTQSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469166 567028491 /nfs/dbraw/zinc/02/84/91/567028491.db2.gz HOYJVIDXTINSBH-RDJZCZTQSA-N 2 1 387.351 3.397 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+]Cc3c[nH+]ccc3N(C)C)nc12 ZINC000545351707 567041940 /nfs/dbraw/zinc/04/19/40/567041940.db2.gz QKRJFKXALMXOAM-UHFFFAOYSA-N 2 1 388.313 3.199 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000453064669 567050980 /nfs/dbraw/zinc/05/09/80/567050980.db2.gz GFOBOFYOIHFYSX-LJQANCHMSA-N 2 1 381.358 3.471 20 0 GGADMP Cc1c(Br)cncc1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000657433469 567055759 /nfs/dbraw/zinc/05/57/59/567055759.db2.gz YHZBCUXZVHHDGC-GOSISDBHSA-N 2 1 390.325 3.009 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H](CO)Cc1ccc(F)c(Br)c1 ZINC000453336315 567076447 /nfs/dbraw/zinc/07/64/47/567076447.db2.gz ALTICLYBEBGOCY-ONUSSAAZSA-N 2 1 387.337 3.058 20 0 GGADMP COc1ccc(C[NH2+]C[C@H](c2cccs2)N2CC[NH+](C)CC2)c(Cl)c1 ZINC000521806338 567080559 /nfs/dbraw/zinc/08/05/59/567080559.db2.gz XEHIYGMXIUHSNT-GOSISDBHSA-N 2 1 379.957 3.488 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]CCC(=O)Nc1cccc(Br)c1 ZINC000565594300 567080819 /nfs/dbraw/zinc/08/08/19/567080819.db2.gz SYCBPHPDFIUPQZ-ZDUSSCGKSA-N 2 1 379.302 3.209 20 0 GGADMP C[N@H+]1CC[C@](O)(CN[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864908 567081797 /nfs/dbraw/zinc/08/17/97/567081797.db2.gz ARDZDYAWOKFKPH-KXBFYZLASA-N 2 1 377.941 3.497 20 0 GGADMP C[N@@H+]1CC[C@](O)(C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864908 567081804 /nfs/dbraw/zinc/08/18/04/567081804.db2.gz ARDZDYAWOKFKPH-KXBFYZLASA-N 2 1 377.941 3.497 20 0 GGADMP C[N@H+]1CC[C@](O)(C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864908 567081808 /nfs/dbraw/zinc/08/18/08/567081808.db2.gz ARDZDYAWOKFKPH-KXBFYZLASA-N 2 1 377.941 3.497 20 0 GGADMP C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@H+](C)CCCN(C)CC[NH+](C)C ZINC000565680733 567089930 /nfs/dbraw/zinc/08/99/30/567089930.db2.gz GSHQLDUNDZMGID-CQSZACIVSA-N 2 1 389.371 3.136 20 0 GGADMP C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@@H+](C)CCCN(C)CC[NH+](C)C ZINC000565680733 567089936 /nfs/dbraw/zinc/08/99/36/567089936.db2.gz GSHQLDUNDZMGID-CQSZACIVSA-N 2 1 389.371 3.136 20 0 GGADMP CC[C@@H](Cc1ccc(Br)cc1)[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000657872544 567101625 /nfs/dbraw/zinc/10/16/25/567101625.db2.gz OAFMMCZEJKWTFF-IBGZPJMESA-N 2 1 382.390 3.387 20 0 GGADMP CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000565834278 567104269 /nfs/dbraw/zinc/10/42/69/567104269.db2.gz DTYKUCAZSXKNHS-HZPDHXFCSA-N 2 1 384.351 3.273 20 0 GGADMP CC[C@H](Cc1ccc(Br)cc1)[NH2+]CCN1CC[N@@H+](C)C(C)(C)C1 ZINC000658003835 567114029 /nfs/dbraw/zinc/11/40/29/567114029.db2.gz USKMMPOFYXTUNR-GOSISDBHSA-N 2 1 382.390 3.386 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000566245154 567141943 /nfs/dbraw/zinc/14/19/43/567141943.db2.gz JIKUAIOQOUZOME-CABCVRRESA-N 2 1 380.330 3.099 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000566245158 567142582 /nfs/dbraw/zinc/14/25/82/567142582.db2.gz JIKUAIOQOUZOME-HUUCEWRRSA-N 2 1 380.330 3.099 20 0 GGADMP C[N@@H+](Cc1c(F)ccc(I)c1F)CC1CC[NH+](C)CC1 ZINC000474267417 567153905 /nfs/dbraw/zinc/15/39/05/567153905.db2.gz FNSINRACYLXSFK-UHFFFAOYSA-N 2 1 394.247 3.343 20 0 GGADMP C[N@H+](Cc1c(F)ccc(I)c1F)CC1CC[NH+](C)CC1 ZINC000474267417 567153910 /nfs/dbraw/zinc/15/39/10/567153910.db2.gz FNSINRACYLXSFK-UHFFFAOYSA-N 2 1 394.247 3.343 20 0 GGADMP Cn1cncc1CCC[N@@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000566425321 567157766 /nfs/dbraw/zinc/15/77/66/567157766.db2.gz UAMAKGFBFKACTB-UHFFFAOYSA-N 2 1 392.301 3.107 20 0 GGADMP Cn1c[nH+]cc1CCC[N@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000566425321 567157772 /nfs/dbraw/zinc/15/77/72/567157772.db2.gz UAMAKGFBFKACTB-UHFFFAOYSA-N 2 1 392.301 3.107 20 0 GGADMP Cn1c[nH+]cc1CCC[N@@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000566425321 567157781 /nfs/dbraw/zinc/15/77/81/567157781.db2.gz UAMAKGFBFKACTB-UHFFFAOYSA-N 3 1 392.301 3.107 20 0 GGADMP COc1cc(Br)ccc1CCC[NH+]1CCC(CO)([NH2+]C(C)C)CC1 ZINC000566423041 567157957 /nfs/dbraw/zinc/15/79/57/567157957.db2.gz JYFIONXAUINLGD-UHFFFAOYSA-N 2 1 399.373 3.215 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]CCc2cn3cc(Br)cc(C)c3n2)[C@H](C)C1 ZINC000546932654 567171720 /nfs/dbraw/zinc/17/17/20/567171720.db2.gz XMPGCCCAXSSLQE-RHSMWYFYSA-N 2 1 379.346 3.268 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)CCc1ccc(I)cc1 ZINC000474631004 567185818 /nfs/dbraw/zinc/18/58/18/567185818.db2.gz RAOAEDUNZHZKRI-CYBMUJFWSA-N 2 1 383.277 3.407 20 0 GGADMP CN(CCC[N@@H+](C)Cc1cc(Br)c(Cl)s1)CC[NH+](C)C ZINC000566824698 567193933 /nfs/dbraw/zinc/19/39/33/567193933.db2.gz VDMFITQZDXSVHV-UHFFFAOYSA-N 2 1 382.799 3.479 20 0 GGADMP C[NH2+][C@H](C(=O)Nc1cnc2c(c1)C[C@H]([NH3+])CC2)c1cccc(Cl)c1Cl ZINC000659303804 567202217 /nfs/dbraw/zinc/20/22/17/567202217.db2.gz VXKOQGLEQPFBCH-DIFFPNOSSA-N 2 1 379.291 3.104 20 0 GGADMP C[NH2+][C@@H](C(=O)Nc1ccc2c(c1)C[NH2+]CCO2)c1cccc(Cl)c1Cl ZINC000659312332 567203705 /nfs/dbraw/zinc/20/37/05/567203705.db2.gz DHLULZNKURXGAT-QGZVFWFLSA-N 2 1 380.275 3.375 20 0 GGADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cnn3cc(Br)cnc23)CC1 ZINC000637958587 567228126 /nfs/dbraw/zinc/22/81/26/567228126.db2.gz RRHBFZHUWAWOHA-UHFFFAOYSA-N 2 1 380.334 3.044 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cnn2cc(Br)cnc12 ZINC000638366620 567244638 /nfs/dbraw/zinc/24/46/38/567244638.db2.gz PSGKSDSPOPDHRM-CQSZACIVSA-N 2 1 380.334 3.236 20 0 GGADMP CC(C)[N@@H+](C)CC1CC[NH+](C[C@@H](O)COc2ccc(Br)cc2)CC1 ZINC000590787268 567247531 /nfs/dbraw/zinc/24/75/31/567247531.db2.gz XQAWSWMATUMRQN-GOSISDBHSA-N 2 1 399.373 3.241 20 0 GGADMP C[NH2+][C@H](C(=O)N1CC[C@H](C(F)(F)F)[C@H](C[NH3+])C1)c1cccc(Cl)c1Cl ZINC000638564731 567258306 /nfs/dbraw/zinc/25/83/06/567258306.db2.gz WBHPMOVUKVYCEV-PUYPPJJSSA-N 2 1 398.256 3.240 20 0 GGADMP CC[N@H+]1CC[C@@H](N(C)CC(=O)c2c[nH]c3ncc(Br)cc23)[C@@H](C)C1 ZINC000660081102 567258736 /nfs/dbraw/zinc/25/87/36/567258736.db2.gz CVRQZSIMDACJLG-BLLLJJGKSA-N 2 1 393.329 3.170 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]C[C@H](O)COc2cccc(Br)c2)C1 ZINC000567688813 567266672 /nfs/dbraw/zinc/26/66/72/567266672.db2.gz ZSRZVURPJKLFIA-WMZOPIPTSA-N 2 1 399.373 3.146 20 0 GGADMP C[C@H]([NH2+]Cc1cnn2cc(Br)cnc12)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000638970752 567280039 /nfs/dbraw/zinc/28/00/39/567280039.db2.gz OUKSUNCJENLAGE-UONOGXRCSA-N 2 1 392.345 3.234 20 0 GGADMP C[C@H]([NH2+]Cc1cnn2cc(Br)cnc12)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000638970752 567280047 /nfs/dbraw/zinc/28/00/47/567280047.db2.gz OUKSUNCJENLAGE-UONOGXRCSA-N 2 1 392.345 3.234 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(Cl)cc(Cl)c3N)CC2)CC1 ZINC000639044321 567284342 /nfs/dbraw/zinc/28/43/42/567284342.db2.gz KOTMHCKXQUIZFN-UHFFFAOYSA-N 2 1 385.383 3.425 20 0 GGADMP CC(C)[N@H+](C)C[C@@H](O)C[NH+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000660403350 567292228 /nfs/dbraw/zinc/29/22/28/567292228.db2.gz XLESLOKNRRQTBV-LJQANCHMSA-N 2 1 399.373 3.131 20 0 GGADMP CC(C)[N@@H+](C)C[C@@H](O)C[NH+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000660403350 567292234 /nfs/dbraw/zinc/29/22/34/567292234.db2.gz XLESLOKNRRQTBV-LJQANCHMSA-N 2 1 399.373 3.131 20 0 GGADMP CC(C)[NH+](C)C[C@@H](O)C[N@H+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000660403350 567292238 /nfs/dbraw/zinc/29/22/38/567292238.db2.gz XLESLOKNRRQTBV-LJQANCHMSA-N 2 1 399.373 3.131 20 0 GGADMP CC(C)[NH+](C)C[C@@H](O)C[N@@H+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000660403350 567292243 /nfs/dbraw/zinc/29/22/43/567292243.db2.gz XLESLOKNRRQTBV-LJQANCHMSA-N 2 1 399.373 3.131 20 0 GGADMP CC(C)(O)C[NH+]1CCC([NH2+][C@H](c2cncc(Br)c2)C2CC2)CC1 ZINC000639146145 567292984 /nfs/dbraw/zinc/29/29/84/567292984.db2.gz FCJRHYGTZFKKNR-KRWDZBQOSA-N 2 1 382.346 3.120 20 0 GGADMP CC(C)(O)C[NH+]1CCC([NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)CC1 ZINC000639163389 567293013 /nfs/dbraw/zinc/29/30/13/567293013.db2.gz XPJOYMGOGFGKEQ-QGZVFWFLSA-N 2 1 375.340 3.242 20 0 GGADMP C[N@H+]1CC[C@H](C(=O)N(CC[NH+]2CCCC2)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000591865692 567302569 /nfs/dbraw/zinc/30/25/69/567302569.db2.gz LYXHBVMUVWAHST-INIZCTEOSA-N 2 1 384.351 3.370 20 0 GGADMP C[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1ccc(Br)cc1OCCCO ZINC000568175727 567310151 /nfs/dbraw/zinc/31/01/51/567310151.db2.gz GHGQNTBBHQULFT-CQSZACIVSA-N 2 1 396.329 3.227 20 0 GGADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](CCC(=O)Nc1ccc(Br)cc1F)C2 ZINC000660656431 567317799 /nfs/dbraw/zinc/31/77/99/567317799.db2.gz UHFAPOPJMVYDAS-SFHVURJKSA-N 2 1 398.320 3.335 20 0 GGADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](CCC(=O)Nc1ccc(Br)cc1F)C2 ZINC000660656431 567317804 /nfs/dbraw/zinc/31/78/04/567317804.db2.gz UHFAPOPJMVYDAS-SFHVURJKSA-N 2 1 398.320 3.335 20 0 GGADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCC(=O)Nc1ccc(Br)cc1F)C2 ZINC000660656431 567317811 /nfs/dbraw/zinc/31/78/11/567317811.db2.gz UHFAPOPJMVYDAS-SFHVURJKSA-N 2 1 398.320 3.335 20 0 GGADMP Brc1c[nH+]ccc1N1CCC([NH2+]CCOc2ccccc2)CC1 ZINC000548481947 567318003 /nfs/dbraw/zinc/31/80/03/567318003.db2.gz YDDDGHGXYBTYOH-UHFFFAOYSA-N 2 1 376.298 3.482 20 0 GGADMP CC(C)C[N@@H+](CCN1CC[NH+](C)CC1)Cc1ccc(Br)cc1F ZINC000568329970 567319647 /nfs/dbraw/zinc/31/96/47/567319647.db2.gz OITGELQVTLVWCK-UHFFFAOYSA-N 2 1 386.353 3.294 20 0 GGADMP Cc1nccn1CCCC[N@H+]1CC[C@@H](Oc2cncc(Br)c2)C1 ZINC000639771176 567320991 /nfs/dbraw/zinc/32/09/91/567320991.db2.gz BJCOCUDBRLYYCU-MRXNPFEDSA-N 2 1 379.302 3.283 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](Oc2cncc(Br)c2)C1 ZINC000639771176 567320999 /nfs/dbraw/zinc/32/09/99/567320999.db2.gz BJCOCUDBRLYYCU-MRXNPFEDSA-N 2 1 379.302 3.283 20 0 GGADMP Brc1ccc(-c2n[nH]cc2C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)s1 ZINC000527638566 567354446 /nfs/dbraw/zinc/35/44/46/567354446.db2.gz XLKIRCZHNCSZGS-NSHDSACASA-N 2 1 381.343 3.475 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2ccc(Br)c(F)c2F)CC1 ZINC000527653992 567356546 /nfs/dbraw/zinc/35/65/46/567356546.db2.gz NZZSQZFBKIUUFP-UHFFFAOYSA-N 2 1 390.316 3.091 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000435377112 567357228 /nfs/dbraw/zinc/35/72/28/567357228.db2.gz YCUGYEPKDHMACX-DOMZBBRYSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000435377938 567357501 /nfs/dbraw/zinc/35/75/01/567357501.db2.gz BHZDBUYBKXHPEO-WFASDCNBSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000435374823 567357813 /nfs/dbraw/zinc/35/78/13/567357813.db2.gz YSRLWOJOXMPIHP-KZULUSFZSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000435374823 567357817 /nfs/dbraw/zinc/35/78/17/567357817.db2.gz YSRLWOJOXMPIHP-KZULUSFZSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000435377937 567357826 /nfs/dbraw/zinc/35/78/26/567357826.db2.gz BHZDBUYBKXHPEO-SWLSCSKDSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000435377114 567358422 /nfs/dbraw/zinc/35/84/22/567358422.db2.gz YCUGYEPKDHMACX-SWLSCSKDSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3ncc(Br)cc3F)CC2)nc(C)[nH+]1 ZINC000527671540 567358831 /nfs/dbraw/zinc/35/88/31/567358831.db2.gz VXPYEXXLTFZMHW-UHFFFAOYSA-N 2 1 394.292 3.149 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000435383759 567359257 /nfs/dbraw/zinc/35/92/57/567359257.db2.gz JRBDFCTUDSICHS-ZOCIIQOWSA-N 2 1 389.341 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000435383758 567359706 /nfs/dbraw/zinc/35/97/06/567359706.db2.gz JRBDFCTUDSICHS-KYNGSXCRSA-N 2 1 389.341 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000435383756 567359911 /nfs/dbraw/zinc/35/99/11/567359911.db2.gz JRBDFCTUDSICHS-GDIGMMSISA-N 2 1 389.341 3.421 20 0 GGADMP [NH3+]CCCOC1CC[NH+](Cc2nc(-c3cccc(Br)c3)c[nH]2)CC1 ZINC000435389145 567360074 /nfs/dbraw/zinc/36/00/74/567360074.db2.gz JISKGGDCRWXEEQ-UHFFFAOYSA-N 2 1 393.329 3.169 20 0 GGADMP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2ncc(Cl)cc2Br)CC1 ZINC000527694535 567363027 /nfs/dbraw/zinc/36/30/27/567363027.db2.gz ZYPAHPQFUFUUGK-UHFFFAOYSA-N 2 1 389.769 3.003 20 0 GGADMP C[N@H+](C[C@@H](O)C[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1CC1 ZINC000569111909 567380426 /nfs/dbraw/zinc/38/04/26/567380426.db2.gz DOJMIKDRDSBTIG-IBGZPJMESA-N 2 1 386.367 3.003 20 0 GGADMP C[N@@H+](C[C@@H](O)C[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1CC1 ZINC000569111909 567380433 /nfs/dbraw/zinc/38/04/33/567380433.db2.gz DOJMIKDRDSBTIG-IBGZPJMESA-N 2 1 386.367 3.003 20 0 GGADMP Brc1csc(-c2noc(C[N@H+]3CCC[C@@H]([C@@H]4CC[NH2+]C4)C3)n2)c1 ZINC000569245484 567389237 /nfs/dbraw/zinc/38/92/37/567389237.db2.gz KLVGTOFYTLMEKW-VXGBXAGGSA-N 2 1 397.342 3.382 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662291504 567426231 /nfs/dbraw/zinc/42/62/31/567426231.db2.gz VMPARZFXRWOUIH-INIZCTEOSA-N 2 1 394.357 3.408 20 0 GGADMP O=C(C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1)Nc1ccc(Br)cc1 ZINC000662290266 567426247 /nfs/dbraw/zinc/42/62/47/567426247.db2.gz OJRNXONOCKYLFQ-HNNXBMFYSA-N 2 1 380.330 3.099 20 0 GGADMP C[C@@H](NC(=O)C[N@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+])c1ccc(Br)cc1 ZINC000662315851 567427626 /nfs/dbraw/zinc/42/76/26/567427626.db2.gz UECLXFVXTWGBPT-IIDMSEBBSA-N 2 1 396.373 3.466 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662386260 567431560 /nfs/dbraw/zinc/43/15/60/567431560.db2.gz AGIIPWUVBBDTCC-DAYGRLMNSA-N 2 1 396.373 3.323 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662386260 567431566 /nfs/dbraw/zinc/43/15/66/567431566.db2.gz AGIIPWUVBBDTCC-DAYGRLMNSA-N 2 1 396.373 3.323 20 0 GGADMP C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662402369 567433402 /nfs/dbraw/zinc/43/34/02/567433402.db2.gz IJNGUJHZJKWBHC-CJNGLKHVSA-N 2 1 382.346 3.076 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662402369 567433408 /nfs/dbraw/zinc/43/34/08/567433408.db2.gz IJNGUJHZJKWBHC-CJNGLKHVSA-N 2 1 382.346 3.076 20 0 GGADMP Cc1ccc([C@H](CNC(=O)[C@@H]([NH3+])c2ccccc2Br)[NH+](C)C)cc1 ZINC000662417916 567434660 /nfs/dbraw/zinc/43/46/60/567434660.db2.gz OJDAECKKYQLPRA-ROUUACIJSA-N 2 1 390.325 3.176 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cc2c(s1)CC[NH2+]C2 ZINC000662426477 567434761 /nfs/dbraw/zinc/43/47/61/567434761.db2.gz RWWURNBWWFQQRC-CQSZACIVSA-N 2 1 375.563 3.097 20 0 GGADMP [NH3+][C@H](C(=O)NC1CC[NH+](CC2CCCC2)CC1)c1ccccc1Br ZINC000662421035 567435001 /nfs/dbraw/zinc/43/50/01/567435001.db2.gz BTWCRYNXLLTBTR-SFHVURJKSA-N 2 1 394.357 3.220 20 0 GGADMP C[NH2+][C@@H](C(=O)N1CC[C@@H](C[N@H+](C)CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000662486158 567441102 /nfs/dbraw/zinc/44/11/02/567441102.db2.gz LZHHNGFWKXXHSZ-KBXCAEBGSA-N 2 1 384.351 3.444 20 0 GGADMP C[NH2+][C@@H](C(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000662486158 567441108 /nfs/dbraw/zinc/44/11/08/567441108.db2.gz LZHHNGFWKXXHSZ-KBXCAEBGSA-N 2 1 384.351 3.444 20 0 GGADMP [NH3+][C@H](C(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccccc1Br ZINC000662487934 567441832 /nfs/dbraw/zinc/44/18/32/567441832.db2.gz OHEZMQYDEZYQEC-SFHVURJKSA-N 2 1 394.357 3.362 20 0 GGADMP C[NH2+][C@H](C(=O)N1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)c1cccc(Cl)c1Cl ZINC000662522275 567444610 /nfs/dbraw/zinc/44/46/10/567444610.db2.gz KKOWIXMCJPXTTA-GLJUWKHASA-N 2 1 384.351 3.492 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662526469 567446110 /nfs/dbraw/zinc/44/61/10/567446110.db2.gz FCVPPLFUOPONQU-FSZRXZPDSA-N 2 1 394.357 3.313 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662526469 567446116 /nfs/dbraw/zinc/44/61/16/567446116.db2.gz FCVPPLFUOPONQU-FSZRXZPDSA-N 2 1 394.357 3.313 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662526473 567446551 /nfs/dbraw/zinc/44/65/51/567446551.db2.gz FCVPPLFUOPONQU-KRXQYRFLSA-N 2 1 394.357 3.313 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662526473 567446555 /nfs/dbraw/zinc/44/65/55/567446555.db2.gz FCVPPLFUOPONQU-KRXQYRFLSA-N 2 1 394.357 3.313 20 0 GGADMP C[NH+](C)CCOc1cccc(NC(=O)[C@@H]([NH3+])c2ccccc2Br)c1 ZINC000662673800 567455567 /nfs/dbraw/zinc/45/55/67/567455567.db2.gz RJAYLJFQBFEQNS-KRWDZBQOSA-N 2 1 392.297 3.028 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)C1CCCCC1 ZINC000662679955 567455744 /nfs/dbraw/zinc/45/57/44/567455744.db2.gz QISSOMAEMDUHOQ-IRXDYDNUSA-N 2 1 382.346 3.076 20 0 GGADMP CS(=O)(=O)CC1CCC([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000550642834 567455851 /nfs/dbraw/zinc/45/58/51/567455851.db2.gz VUEVCUYAUNILGL-LXPRWKDFSA-N 2 1 384.611 3.153 20 0 GGADMP CS(=O)(=O)CC1CCC([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000550642834 567455858 /nfs/dbraw/zinc/45/58/58/567455858.db2.gz VUEVCUYAUNILGL-LXPRWKDFSA-N 2 1 384.611 3.153 20 0 GGADMP C[N@@H+](CCCOc1cccc(I)c1)[C@@H]1CCC[NH2+]CC1 ZINC000478552456 567467189 /nfs/dbraw/zinc/46/71/89/567467189.db2.gz SPYHQRKJPUMGKY-OAHLLOKOSA-N 2 1 388.293 3.134 20 0 GGADMP C[NH2+][C@H](C(=O)NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000663002144 567473083 /nfs/dbraw/zinc/47/30/83/567473083.db2.gz CCNQFOCWZJYOPL-KSSFIOAISA-N 2 1 384.351 3.492 20 0 GGADMP C[NH2+][C@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000663002144 567473091 /nfs/dbraw/zinc/47/30/91/567473091.db2.gz CCNQFOCWZJYOPL-KSSFIOAISA-N 2 1 384.351 3.492 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCc3sc(Br)cc32)CC1 ZINC000551029791 567473634 /nfs/dbraw/zinc/47/36/34/567473634.db2.gz RYPCZQNFZSDNCB-OAHLLOKOSA-N 2 1 386.403 3.361 20 0 GGADMP [NH3+]Cc1cn([C@@H]2CCC[N@@H+](CCSc3cc(Cl)ccc3Cl)C2)nn1 ZINC000570383780 567480567 /nfs/dbraw/zinc/48/05/67/567480567.db2.gz DAHASOHKBVSXND-CQSZACIVSA-N 2 1 386.352 3.473 20 0 GGADMP CC(C)(N)c1noc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)n1 ZINC000570683946 567505505 /nfs/dbraw/zinc/50/55/05/567505505.db2.gz OMEGIFCCOQXZMT-SECBINFHSA-N 2 1 375.420 3.118 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000644532070 567556117 /nfs/dbraw/zinc/55/61/17/567556117.db2.gz YTJVTNUMHHBKMZ-HUUCEWRRSA-N 2 1 375.340 3.443 20 0 GGADMP C[N@@H+](Cc1ccccc1)C[C@H](O)C[NH2+]CCc1ccccc1Br ZINC000644532478 567556310 /nfs/dbraw/zinc/55/63/10/567556310.db2.gz ULSZLCGAAYSNDN-GOSISDBHSA-N 2 1 377.326 3.074 20 0 GGADMP C[N@H+](Cc1ccccc1)C[C@H](O)C[NH2+]CCc1ccccc1Br ZINC000644532478 567556320 /nfs/dbraw/zinc/55/63/20/567556320.db2.gz ULSZLCGAAYSNDN-GOSISDBHSA-N 2 1 377.326 3.074 20 0 GGADMP C[N@@H+](Cc1ccccc1)C[C@H](O)C[NH2+]CCc1ccc(Br)cc1 ZINC000644570149 567559497 /nfs/dbraw/zinc/55/94/97/567559497.db2.gz JENKADFMKKYNLA-LJQANCHMSA-N 2 1 377.326 3.074 20 0 GGADMP C[N@H+](Cc1ccccc1)C[C@H](O)C[NH2+]CCc1ccc(Br)cc1 ZINC000644570149 567559500 /nfs/dbraw/zinc/55/95/00/567559500.db2.gz JENKADFMKKYNLA-LJQANCHMSA-N 2 1 377.326 3.074 20 0 GGADMP C[N@@H+](Cc1ccccc1)C[C@H](O)C[NH2+]CCc1cccc(Br)c1 ZINC000644667142 567569776 /nfs/dbraw/zinc/56/97/76/567569776.db2.gz ABZCCZXRPHADIK-LJQANCHMSA-N 2 1 377.326 3.074 20 0 GGADMP C[N@H+](Cc1ccccc1)C[C@H](O)C[NH2+]CCc1cccc(Br)c1 ZINC000644667142 567569778 /nfs/dbraw/zinc/56/97/78/567569778.db2.gz ABZCCZXRPHADIK-LJQANCHMSA-N 2 1 377.326 3.074 20 0 GGADMP CCO[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3csc(CC)n3)CC2)[C@@H]1SC ZINC000459403508 567622557 /nfs/dbraw/zinc/62/25/57/567622557.db2.gz BYPGWXKMLCNNBK-LMMKCTJWSA-N 2 1 383.627 3.416 20 0 GGADMP C[NH+](C)CCCNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000596417475 567631651 /nfs/dbraw/zinc/63/16/51/567631651.db2.gz DKZQSMKUGFGNBE-UHFFFAOYSA-N 2 1 387.355 3.209 20 0 GGADMP C[N@@H+]1CCCC[C@H]1C(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000665675780 567634746 /nfs/dbraw/zinc/63/47/46/567634746.db2.gz LCOWSMAXTPBKEN-SFHVURJKSA-N 2 1 394.357 3.014 20 0 GGADMP C[N@H+]1CCCC[C@H]1C(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000665675780 567634750 /nfs/dbraw/zinc/63/47/50/567634750.db2.gz LCOWSMAXTPBKEN-SFHVURJKSA-N 2 1 394.357 3.014 20 0 GGADMP Cc1ccc(C[C@@H](CO)C[NH2+]C2CC[NH+](C3CC3)CC2)cc1Br ZINC000459569466 567637998 /nfs/dbraw/zinc/63/79/98/567637998.db2.gz KRTPBJKYOHSVRL-MRXNPFEDSA-N 2 1 381.358 3.125 20 0 GGADMP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459728090 567655083 /nfs/dbraw/zinc/65/50/83/567655083.db2.gz CRIAUANOSYYGJG-GJZGRUSLSA-N 2 1 382.346 3.488 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2CCOc1cccc(Br)c1 ZINC000441181870 567656554 /nfs/dbraw/zinc/65/65/54/567656554.db2.gz SURKODREDBXMGP-BPQIPLTHSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2CCOc1cccc(Br)c1 ZINC000441181870 567656558 /nfs/dbraw/zinc/65/65/58/567656558.db2.gz SURKODREDBXMGP-BPQIPLTHSA-N 2 1 383.330 3.011 20 0 GGADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000459730177 567656727 /nfs/dbraw/zinc/65/67/27/567656727.db2.gz JXUQTHIIRSCQOA-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000459780900 567659449 /nfs/dbraw/zinc/65/94/49/567659449.db2.gz LTTZLIZEMQJENN-INIZCTEOSA-N 2 1 396.373 3.107 20 0 GGADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ncc(Br)cc2Br)C1 ZINC000459790986 567660460 /nfs/dbraw/zinc/66/04/60/567660460.db2.gz RILSTBBXQZPBSW-LLVKDONJSA-N 2 1 391.151 3.428 20 0 GGADMP COc1ccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c(Br)c1 ZINC000573045391 567682959 /nfs/dbraw/zinc/68/29/59/567682959.db2.gz MYDUBNILFXPTQW-UHFFFAOYSA-N 2 1 397.357 3.392 20 0 GGADMP COc1cc(C[NH2+]CCc2c[nH+]cn2C)cc(Br)c1OC(F)F ZINC000623086708 567684073 /nfs/dbraw/zinc/68/40/73/567684073.db2.gz GQRBNLDIGKKWIX-UHFFFAOYSA-N 2 1 390.228 3.125 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000531937209 567689814 /nfs/dbraw/zinc/68/98/14/567689814.db2.gz MFEUFGBWQFWYPI-XYPHTWIQSA-N 2 1 380.330 3.383 20 0 GGADMP CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481668898 567694057 /nfs/dbraw/zinc/69/40/57/567694057.db2.gz JCLKNBKEODZSAG-UXLLHSPISA-N 2 1 387.977 3.162 20 0 GGADMP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481668897 567694510 /nfs/dbraw/zinc/69/45/10/567694510.db2.gz JCLKNBKEODZSAG-INMHGKMJSA-N 2 1 387.977 3.162 20 0 GGADMP Brc1ccc(-c2noc(C[N@H+]3CCC[C@@H]([C@H]4CC[NH2+]C4)C3)n2)s1 ZINC000573207341 567696867 /nfs/dbraw/zinc/69/68/67/567696867.db2.gz NQVJDVHDXVPOGD-NWDGAFQWSA-N 2 1 397.342 3.382 20 0 GGADMP C[N@@H+](CCC(=O)Nc1ccc(Br)cc1F)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442788851 567709179 /nfs/dbraw/zinc/70/91/79/567709179.db2.gz JEFURHTXYGXXFN-PBWFPOADSA-N 2 1 384.293 3.132 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@@H]2CCc3c2c(Br)ccc3F)CC1(C)C ZINC000442871812 567714598 /nfs/dbraw/zinc/71/45/98/567714598.db2.gz GYIZHKCYPPIVOH-MRXNPFEDSA-N 2 1 384.337 3.191 20 0 GGADMP Brc1cc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc2c1OCCCO2 ZINC000666998370 567716677 /nfs/dbraw/zinc/71/66/77/567716677.db2.gz PTMZNTMPPKJFFL-AWEZNQCLSA-N 2 1 381.314 3.375 20 0 GGADMP O=C(CC[C@@H]1CC[NH2+]C1)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000646497107 567720650 /nfs/dbraw/zinc/72/06/50/567720650.db2.gz OJDFCHQFMGXBRR-CQSZACIVSA-N 2 1 384.351 3.464 20 0 GGADMP COc1ccc(Br)c(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000532672634 567727456 /nfs/dbraw/zinc/72/74/56/567727456.db2.gz OMLMQAVZDQKPHR-GASCZTMLSA-N 2 1 385.346 3.437 20 0 GGADMP O=C(C[N@H+](Cc1cccs1)C1CC1)N1CCN(Cc2ccsc2)CC1 ZINC000532750142 567732154 /nfs/dbraw/zinc/73/21/54/567732154.db2.gz PSFAQEJSTALDJD-UHFFFAOYSA-N 2 1 375.563 3.118 20 0 GGADMP O=C(C[N@@H+](Cc1cccs1)C1CC1)N1CCN(Cc2ccsc2)CC1 ZINC000532750142 567732158 /nfs/dbraw/zinc/73/21/58/567732158.db2.gz PSFAQEJSTALDJD-UHFFFAOYSA-N 2 1 375.563 3.118 20 0 GGADMP C[C@@H]([NH2+]CCCCN1CC[NH+](C)CC1)c1cc(F)c(Br)cc1F ZINC000623861737 567742908 /nfs/dbraw/zinc/74/29/08/567742908.db2.gz BOHGXENNQPKKOD-CYBMUJFWSA-N 2 1 390.316 3.406 20 0 GGADMP C[NH+](C)Cc1ccc(NC(=O)[C@]23C[NH2+]C[C@@H]2CCCC3)cc1Br ZINC000573918346 567744791 /nfs/dbraw/zinc/74/47/91/567744791.db2.gz BKWOJBBUKRRJCN-KBXCAEBGSA-N 2 1 380.330 3.229 20 0 GGADMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000624123210 567762123 /nfs/dbraw/zinc/76/21/23/567762123.db2.gz ICOWEIYOXNVPBY-WMLDXEAASA-N 2 1 387.977 3.021 20 0 GGADMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000624123210 567762128 /nfs/dbraw/zinc/76/21/28/567762128.db2.gz ICOWEIYOXNVPBY-WMLDXEAASA-N 2 1 387.977 3.021 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CCC[C@H](C[NH3+])C1 ZINC000574276967 567768299 /nfs/dbraw/zinc/76/82/99/567768299.db2.gz KUNFGEVLLGVVPD-OAHLLOKOSA-N 2 1 377.330 3.422 20 0 GGADMP Cc1[nH+]c2ccc(Br)cc2c(N[C@H](C)C[NH+]2CCOCC2)c1C ZINC000462085929 567768657 /nfs/dbraw/zinc/76/86/57/567768657.db2.gz CTKWHKRTFNLEDH-GFCCVEGCSA-N 2 1 378.314 3.169 20 0 GGADMP Clc1ccc(-n2cc(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)nn2)cc1Cl ZINC000647542077 567790595 /nfs/dbraw/zinc/79/05/95/567790595.db2.gz SDUQINOCFPENAR-CQSZACIVSA-N 2 1 380.323 3.396 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cc1O ZINC000647542959 567790768 /nfs/dbraw/zinc/79/07/68/567790768.db2.gz FGGMNZIRFXSIBV-UONOGXRCSA-N 2 1 383.330 3.375 20 0 GGADMP COc1cc(Br)c(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)c(OC)c1 ZINC000647542161 567790824 /nfs/dbraw/zinc/79/08/24/567790824.db2.gz GDDYJWYJKAEUGF-AWEZNQCLSA-N 2 1 383.330 3.288 20 0 GGADMP Brc1ccc2ncc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)n2c1 ZINC000647543399 567790848 /nfs/dbraw/zinc/79/08/48/567790848.db2.gz MQAXABAOURTKPJ-HUUCEWRRSA-N 2 1 377.330 3.308 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]CCC(=O)Nc1ccc(Br)cc1 ZINC000574685117 567791765 /nfs/dbraw/zinc/79/17/65/567791765.db2.gz ZJIGKMAJLJAKQI-CYBMUJFWSA-N 2 1 379.302 3.209 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@H]1C[C@@]12CC[NH2+]C2 ZINC000444187030 567796623 /nfs/dbraw/zinc/79/66/23/567796623.db2.gz SFSMDOLTQWYENZ-DNVCBOLYSA-N 2 1 382.335 3.074 20 0 GGADMP O[C@H]1CC[N@@H+](CCNc2cc(C3CC3)nc3c(Br)cccc23)C1 ZINC000624775841 567799107 /nfs/dbraw/zinc/79/91/07/567799107.db2.gz HGJKIIUWVQPGSG-ZDUSSCGKSA-N 2 1 376.298 3.353 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)c(I)c1 ZINC000574845293 567800147 /nfs/dbraw/zinc/80/01/47/567800147.db2.gz SOJUCKMPAFYHEB-RYUDHWBXSA-N 2 1 376.257 3.423 20 0 GGADMP CC[C@H]1C[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC[C@@H]1[NH3+] ZINC000647934988 567808240 /nfs/dbraw/zinc/80/82/40/567808240.db2.gz WJDNACZYFFYIQG-GUYCJALGSA-N 2 1 375.314 3.465 20 0 GGADMP CC[C@H]1C[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC[C@@H]1[NH3+] ZINC000647934988 567808244 /nfs/dbraw/zinc/80/82/44/567808244.db2.gz WJDNACZYFFYIQG-GUYCJALGSA-N 2 1 375.314 3.465 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000647977054 567808922 /nfs/dbraw/zinc/80/89/22/567808922.db2.gz XKZQEXUXKJUDGC-JKSUJKDBSA-N 2 1 394.357 3.489 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(Br)c1 ZINC000647975204 567809103 /nfs/dbraw/zinc/80/91/03/567809103.db2.gz PZEUEULVLAUJQW-HZPDHXFCSA-N 2 1 394.357 3.408 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(Br)c1 ZINC000647975204 567809105 /nfs/dbraw/zinc/80/91/05/567809105.db2.gz PZEUEULVLAUJQW-HZPDHXFCSA-N 2 1 394.357 3.408 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1OC ZINC000647986875 567809948 /nfs/dbraw/zinc/80/99/48/567809948.db2.gz ILBXBQPZEVYFFN-KBPBESRZSA-N 2 1 383.330 3.288 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1OC ZINC000647986877 567810081 /nfs/dbraw/zinc/81/00/81/567810081.db2.gz ILBXBQPZEVYFFN-UONOGXRCSA-N 2 1 383.330 3.288 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NCc3ccc(C[NH+](C)C)cc3)cc2)C[C@H](C)O1 ZINC000028895148 570465986 /nfs/dbraw/zinc/46/59/86/570465986.db2.gz QCEXTRQODAUFLD-OALUTQOASA-N 2 1 395.547 3.287 20 0 GGADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOc2ccc(-c3nn[nH]n3)cc2)C1 ZINC000736265436 598870682 /nfs/dbraw/zinc/87/06/82/598870682.db2.gz APNOUBZHXJFHTE-RBUKOAKNSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCOc2ccc(-c3nn[nH]n3)cc2)C1 ZINC000736265436 598870684 /nfs/dbraw/zinc/87/06/84/598870684.db2.gz APNOUBZHXJFHTE-RBUKOAKNSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCOc2ccc(-c3nn[nH]n3)cc2)C1 ZINC000736265436 598870685 /nfs/dbraw/zinc/87/06/85/598870685.db2.gz APNOUBZHXJFHTE-RBUKOAKNSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCOc2ccc(-c3nn[nH]n3)cc2)C1 ZINC000736265436 598870687 /nfs/dbraw/zinc/87/06/87/598870687.db2.gz APNOUBZHXJFHTE-RBUKOAKNSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc(-c3nn[nH]n3)c2)C1 ZINC000736276962 598492490 /nfs/dbraw/zinc/49/24/90/598492490.db2.gz JHQGKBMLNMCKCK-QGZVFWFLSA-N 2 1 376.508 3.388 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(-c2nn[nH]n2)cc1 ZINC000820420427 599371109 /nfs/dbraw/zinc/37/11/09/599371109.db2.gz QTNJNPSLHBIDHP-HKUYNNGSSA-N 2 1 376.508 3.430 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(-c2nn[nH]n2)cc1 ZINC000820420147 599373299 /nfs/dbraw/zinc/37/32/99/599373299.db2.gz MZIQINMSRPWWLJ-HZPDHXFCSA-N 2 1 382.537 3.491 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(-c2nn[nH]n2)cc1 ZINC000820420147 599373302 /nfs/dbraw/zinc/37/33/02/599373302.db2.gz MZIQINMSRPWWLJ-HZPDHXFCSA-N 2 1 382.537 3.491 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)[nH+]1 ZINC000822192895 599583000 /nfs/dbraw/zinc/58/30/00/599583000.db2.gz DZRIDYHGWMRUIW-PBHICJAKSA-N 2 1 383.525 3.435 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)[nH+]1 ZINC000822192895 599583002 /nfs/dbraw/zinc/58/30/02/599583002.db2.gz DZRIDYHGWMRUIW-PBHICJAKSA-N 2 1 383.525 3.435 20 0 GGADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@@H](C(=O)[O-])c1ccc(F)cc1 ZINC000830923207 601156442 /nfs/dbraw/zinc/15/64/42/601156442.db2.gz AIDMKYPPEADDNK-OAQYLSRUSA-N 2 1 391.531 3.080 20 0 GGADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@@H](C(=O)[O-])c1ccc(F)cc1 ZINC000830923207 601156444 /nfs/dbraw/zinc/15/64/44/601156444.db2.gz AIDMKYPPEADDNK-OAQYLSRUSA-N 2 1 391.531 3.080 20 0 GGADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)Cc1ccsc1C(=O)[O-] ZINC000830924010 601491172 /nfs/dbraw/zinc/49/11/72/601491172.db2.gz YQBJUOVRZIKYEB-UHFFFAOYSA-N 2 1 379.570 3.074 20 0 GGADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)Cc1ccsc1C(=O)[O-] ZINC000830924010 601491175 /nfs/dbraw/zinc/49/11/75/601491175.db2.gz YQBJUOVRZIKYEB-UHFFFAOYSA-N 2 1 379.570 3.074 20 0 GGADMP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](Cc4cccc(-c5nn[nH]n5)c4)CC[C@@H]32)cc1 ZINC000823780776 607074114 /nfs/dbraw/zinc/07/41/14/607074114.db2.gz VZTIIWIAJSDXGD-VXKWHMMOSA-N 2 1 388.519 3.353 20 0 GGADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](Cc4cccc(-c5nn[nH]n5)c4)CC[C@@H]32)cc1 ZINC000823780776 607074116 /nfs/dbraw/zinc/07/41/16/607074116.db2.gz VZTIIWIAJSDXGD-VXKWHMMOSA-N 2 1 388.519 3.353 20 0 GGADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](Cc4cccc(-c5nn[nH]n5)c4)CC[C@@H]32)cc1 ZINC000823780776 607074118 /nfs/dbraw/zinc/07/41/18/607074118.db2.gz VZTIIWIAJSDXGD-VXKWHMMOSA-N 2 1 388.519 3.353 20 0 GGADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](Cc4cccc(-c5nn[nH]n5)c4)CC[C@@H]32)cc1 ZINC000823780776 607074120 /nfs/dbraw/zinc/07/41/20/607074120.db2.gz VZTIIWIAJSDXGD-VXKWHMMOSA-N 2 1 388.519 3.353 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1ccccc1-c1nn[nH]n1 ZINC000824983483 607910745 /nfs/dbraw/zinc/91/07/45/607910745.db2.gz AGBNHDUHJGENRW-LFUKPOHLSA-N 2 1 376.508 3.113 20 0 GGADMP c1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccc(-c4nn[nH]n4)cc2)CC3)cc1 ZINC000826521823 608105603 /nfs/dbraw/zinc/10/56/03/608105603.db2.gz ZSQOLQJTMCFSHO-UHFFFAOYSA-N 2 1 388.519 3.355 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(-c2nn[nH]n2)cc1 ZINC000825918931 608207524 /nfs/dbraw/zinc/20/75/24/608207524.db2.gz PJJJSVIPCRTCRR-UHFFFAOYSA-N 2 1 377.496 3.000 20 0 GGADMP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH2+]Cc4cccc(-c5nn[nH]n5)c4)[C@@H]3C2)cc1 ZINC000826521367 609326826 /nfs/dbraw/zinc/32/68/26/609326826.db2.gz JSZPQRXPRQGTPK-BHDDXSALSA-N 2 1 388.519 3.257 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccco1 ZINC000054038147 1406597968 /nfs/dbraw/zinc/59/79/68/1406597968.db2.gz GAJSFNMBWIRJNK-HXUWFJFHSA-N 2 1 384.524 3.368 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000054044785 1406602768 /nfs/dbraw/zinc/60/27/68/1406602768.db2.gz CFJVKDXVPHAQGO-HSZRJFAPSA-N 2 1 392.547 3.225 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000054609187 1406782898 /nfs/dbraw/zinc/78/28/98/1406782898.db2.gz KFUFJQUQTKNPMU-HDICACEKSA-N 2 1 398.555 3.133 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000054609187 1406782906 /nfs/dbraw/zinc/78/29/06/1406782906.db2.gz KFUFJQUQTKNPMU-HDICACEKSA-N 2 1 398.555 3.133 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)N2CCC([NH+]3CCCCC3)CC2)C1 ZINC000054720622 1406812824 /nfs/dbraw/zinc/81/28/24/1406812824.db2.gz ZDHBVNLWLZRABM-CTNGQTDRSA-N 2 1 384.568 3.482 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC(C)(C)[NH+]2C[C@@H](C)C[C@H](C)C2)cn1 ZINC000054725355 1406814258 /nfs/dbraw/zinc/81/42/58/1406814258.db2.gz OQWMJHNXVUGPID-IRXDYDNUSA-N 2 1 398.555 3.131 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000054777642 1406822785 /nfs/dbraw/zinc/82/27/85/1406822785.db2.gz KWFYSSXLCIMCJG-UHFFFAOYSA-N 2 1 394.563 3.391 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@H+](C)Cc3ccccc3C)cc2)CC1 ZINC000007355659 1398658253 /nfs/dbraw/zinc/65/82/53/1398658253.db2.gz ZBUAMZFHKQCSEM-UHFFFAOYSA-N 2 1 380.536 3.207 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](C)Cc3ccccc3C)cc2)CC1 ZINC000007355659 1398658262 /nfs/dbraw/zinc/65/82/62/1398658262.db2.gz ZBUAMZFHKQCSEM-UHFFFAOYSA-N 2 1 380.536 3.207 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC000026100173 1399859354 /nfs/dbraw/zinc/85/93/54/1399859354.db2.gz MLUZXDZDXGMIBP-QHCPKHFHSA-N 2 1 377.532 3.235 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC000027233841 1400008536 /nfs/dbraw/zinc/00/85/36/1400008536.db2.gz FTZAKRUPKNJLOJ-UHFFFAOYSA-N 2 1 379.548 3.332 20 0 GGADMP Cn1cc(C[NH2+]CCC[NH+]2CCCCC2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000028310426 1400149671 /nfs/dbraw/zinc/14/96/71/1400149671.db2.gz MHDZVZIUMADARE-UHFFFAOYSA-N 2 1 384.524 3.214 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCc3ccccc3C[NH+](C)C)cc2)C[C@H](C)O1 ZINC000028896295 1400209187 /nfs/dbraw/zinc/20/91/87/1400209187.db2.gz HYPCCXKBFSVVSN-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCc3ccccc3C[NH+](C)C)cc2)C[C@H](C)O1 ZINC000028896295 1400209192 /nfs/dbraw/zinc/20/91/92/1400209192.db2.gz HYPCCXKBFSVVSN-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)C(=O)NC(=O)NC(C)(C)C ZINC000056156156 1407232542 /nfs/dbraw/zinc/23/25/42/1407232542.db2.gz DEWDWVOXLQNHOS-SJORKVTESA-N 2 1 388.556 3.021 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)C(=O)NC(=O)NC(C)(C)C ZINC000056156157 1407232695 /nfs/dbraw/zinc/23/26/95/1407232695.db2.gz DEWDWVOXLQNHOS-IRXDYDNUSA-N 2 1 388.556 3.021 20 0 GGADMP CC(C)CNC(=O)NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000056156191 1407232891 /nfs/dbraw/zinc/23/28/91/1407232891.db2.gz KDRKFFGCCXHTDZ-ROUUACIJSA-N 2 1 388.556 3.021 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000042929673 1403675641 /nfs/dbraw/zinc/67/56/41/1403675641.db2.gz NRFUSWKMUXVZEN-FQEVSTJZSA-N 2 1 386.584 3.462 20 0 GGADMP Cc1ccc(C[N@H+]2CCCN(C(=O)NC[C@H](c3ccco3)[NH+](C)C)CC2)cc1 ZINC000043138245 1403714735 /nfs/dbraw/zinc/71/47/35/1403714735.db2.gz HBYUCCRNPCZZBV-HXUWFJFHSA-N 2 1 384.524 3.108 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)NC[C@H](c3ccco3)[NH+](C)C)CC2)cc1 ZINC000043138245 1403714741 /nfs/dbraw/zinc/71/47/41/1403714741.db2.gz HBYUCCRNPCZZBV-HXUWFJFHSA-N 2 1 384.524 3.108 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000043167388 1403723433 /nfs/dbraw/zinc/72/34/33/1403723433.db2.gz SPQHSOWRALFLDH-OAQYLSRUSA-N 2 1 396.535 3.334 20 0 GGADMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000043167387 1403723661 /nfs/dbraw/zinc/72/36/61/1403723661.db2.gz SPQHSOWRALFLDH-NRFANRHFSA-N 2 1 396.535 3.334 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)NC[C@H](c3ccco3)[NH+](C)C)c(C)c2)CC1 ZINC000043526573 1403780161 /nfs/dbraw/zinc/78/01/61/1403780161.db2.gz KHCYKKIYEXDJPE-HXUWFJFHSA-N 2 1 399.539 3.154 20 0 GGADMP C[N@@H+](CCCNC(=O)Nc1ccccc1N1CC[NH+](C)CC1)Cc1ccccc1 ZINC000043800434 1403819550 /nfs/dbraw/zinc/81/95/50/1403819550.db2.gz YTOWEYTUISXVDS-UHFFFAOYSA-N 2 1 395.551 3.082 20 0 GGADMP O[C@@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)C[NH+]1CCCC1 ZINC000044344845 1403922779 /nfs/dbraw/zinc/92/27/79/1403922779.db2.gz AFKFCLFGKXXUQR-QFIPXVFZSA-N 2 1 394.494 3.225 20 0 GGADMP CC1CC[NH+](CCCNC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)CC1 ZINC000045122373 1404057851 /nfs/dbraw/zinc/05/78/51/1404057851.db2.gz OSYNCIOWSGARFT-UHFFFAOYSA-N 2 1 390.547 3.165 20 0 GGADMP CC1CC[NH+](CCCNC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)CC1 ZINC000045122373 1404057860 /nfs/dbraw/zinc/05/78/60/1404057860.db2.gz OSYNCIOWSGARFT-UHFFFAOYSA-N 2 1 390.547 3.165 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N[C@H]3CC[N@H+]4CCCC[C@H]34)cc2)CC1 ZINC000045777491 1404201461 /nfs/dbraw/zinc/20/14/61/1404201461.db2.gz PLSXILHOYLJRBZ-FCHUYYIVSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N[C@@H]3CC[NH+]4CCCC[C@H]34)cc2)C1 ZINC000045786564 1404204621 /nfs/dbraw/zinc/20/46/21/1404204621.db2.gz PHBGFWUHFQUODI-STZQEDGTSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N[C@@H]3CC[N@@H+]4CCCC[C@H]34)cc2)C1 ZINC000045786564 1404204626 /nfs/dbraw/zinc/20/46/26/1404204626.db2.gz PHBGFWUHFQUODI-STZQEDGTSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N[C@@H]3CC[N@H+]4CCCC[C@H]34)cc2)C1 ZINC000045786564 1404204634 /nfs/dbraw/zinc/20/46/34/1404204634.db2.gz PHBGFWUHFQUODI-STZQEDGTSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Nc1ccccc1N1CC[NH+](C)CC1 ZINC000045983947 1404262157 /nfs/dbraw/zinc/26/21/57/1404262157.db2.gz QHLHZJLNYPYSDV-LJQANCHMSA-N 2 1 387.572 3.215 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)c1ccsc1 ZINC000046347149 1404377142 /nfs/dbraw/zinc/37/71/42/1404377142.db2.gz LATZFAICJMBYPA-HXUWFJFHSA-N 2 1 386.565 3.268 20 0 GGADMP O=C(N[C@H]1CC[NH+]2CCCC[C@H]12)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000047103549 1404707178 /nfs/dbraw/zinc/70/71/78/1404707178.db2.gz IZHUWVJMGNRAGJ-VQTJNVASSA-N 2 1 390.959 3.184 20 0 GGADMP O=C(N[C@H]1CC[NH+]2CCCC[C@H]12)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000047103549 1404707187 /nfs/dbraw/zinc/70/71/87/1404707187.db2.gz IZHUWVJMGNRAGJ-VQTJNVASSA-N 2 1 390.959 3.184 20 0 GGADMP O=C(N[C@H]1CC[N@@H+]2CCCC[C@H]12)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000047103549 1404707193 /nfs/dbraw/zinc/70/71/93/1404707193.db2.gz IZHUWVJMGNRAGJ-VQTJNVASSA-N 2 1 390.959 3.184 20 0 GGADMP O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000047103549 1404707198 /nfs/dbraw/zinc/70/71/98/1404707198.db2.gz IZHUWVJMGNRAGJ-VQTJNVASSA-N 2 1 390.959 3.184 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000047301917 1404795730 /nfs/dbraw/zinc/79/57/30/1404795730.db2.gz GMMNGELRDSIWLE-QHCPKHFHSA-N 2 1 377.532 3.289 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000047871721 1404978152 /nfs/dbraw/zinc/97/81/52/1404978152.db2.gz APVKMQQCWUWHJI-OTWHNJEPSA-N 2 1 376.545 3.084 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)NC[C@@H](Cc1ccccc1)[NH+](C)C ZINC000047929657 1405001237 /nfs/dbraw/zinc/00/12/37/1405001237.db2.gz BYMHUAVFLQJJQI-HSZRJFAPSA-N 2 1 396.579 3.499 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000047935791 1405002802 /nfs/dbraw/zinc/00/28/02/1405002802.db2.gz JZRPGFXICNSMGR-RTWAWAEBSA-N 2 1 384.499 3.002 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000047935793 1405003040 /nfs/dbraw/zinc/00/30/40/1405003040.db2.gz JZRPGFXICNSMGR-SFTDATJTSA-N 2 1 384.499 3.002 20 0 GGADMP C[C@H](CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2sccc2C1 ZINC000047966031 1405012764 /nfs/dbraw/zinc/01/27/64/1405012764.db2.gz UGAQUEDZBZJSMO-YLJYHZDGSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@H](CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2sccc2C1 ZINC000047966031 1405012779 /nfs/dbraw/zinc/01/27/79/1405012779.db2.gz UGAQUEDZBZJSMO-YLJYHZDGSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@H](CNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2sccc2C1 ZINC000047966031 1405012791 /nfs/dbraw/zinc/01/27/91/1405012791.db2.gz UGAQUEDZBZJSMO-YLJYHZDGSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@H](CNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2sccc2C1 ZINC000047966031 1405012803 /nfs/dbraw/zinc/01/28/03/1405012803.db2.gz UGAQUEDZBZJSMO-YLJYHZDGSA-N 2 1 398.576 3.068 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047964776 1405012898 /nfs/dbraw/zinc/01/28/98/1405012898.db2.gz FRRHNAIRKLSBHY-QHCPKHFHSA-N 2 1 392.547 3.356 20 0 GGADMP CC(=O)Nc1cccc(NC(=O)C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000048563500 1405225949 /nfs/dbraw/zinc/22/59/49/1405225949.db2.gz KXVCIYLUILWQJA-UHFFFAOYSA-N 2 1 386.540 3.172 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)cn2)cc1 ZINC000048711583 1405265061 /nfs/dbraw/zinc/26/50/61/1405265061.db2.gz QILCLKRFRBHLIL-AWEZNQCLSA-N 2 1 375.314 3.209 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)cn2)cc1 ZINC000048711583 1405265073 /nfs/dbraw/zinc/26/50/73/1405265073.db2.gz QILCLKRFRBHLIL-AWEZNQCLSA-N 2 1 375.314 3.209 20 0 GGADMP CCOc1cccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)c1 ZINC000048778173 1405289083 /nfs/dbraw/zinc/28/90/83/1405289083.db2.gz DYBMKEOFLGIWDR-UHFFFAOYSA-N 2 1 397.519 3.036 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000050024287 1405454069 /nfs/dbraw/zinc/45/40/69/1405454069.db2.gz GSLSJLUYQDTTDM-RBBKRZOGSA-N 2 1 395.547 3.326 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000050024287 1405454072 /nfs/dbraw/zinc/45/40/72/1405454072.db2.gz GSLSJLUYQDTTDM-RBBKRZOGSA-N 2 1 395.547 3.326 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCCCC1 ZINC000050136838 1405496630 /nfs/dbraw/zinc/49/66/30/1405496630.db2.gz ITXYHNFLDMUHPL-ROUUACIJSA-N 2 1 378.586 3.134 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccco1 ZINC000050137179 1405496811 /nfs/dbraw/zinc/49/68/11/1405496811.db2.gz HFYXPJDLEBGOAR-WMZOPIPTSA-N 2 1 390.553 3.155 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccco1 ZINC000050137179 1405496814 /nfs/dbraw/zinc/49/68/14/1405496814.db2.gz HFYXPJDLEBGOAR-WMZOPIPTSA-N 2 1 390.553 3.155 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccco1 ZINC000050137180 1405496894 /nfs/dbraw/zinc/49/68/94/1405496894.db2.gz HFYXPJDLEBGOAR-FUHWJXTLSA-N 2 1 390.553 3.155 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccco1 ZINC000050137180 1405496897 /nfs/dbraw/zinc/49/68/97/1405496897.db2.gz HFYXPJDLEBGOAR-FUHWJXTLSA-N 2 1 390.553 3.155 20 0 GGADMP CC(C)CN(CC[NH+](C)C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000050137040 1405497655 /nfs/dbraw/zinc/49/76/55/1405497655.db2.gz IHWPNSWXCFAAOW-SFHVURJKSA-N 2 1 380.602 3.189 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccco1 ZINC000050137182 1405497691 /nfs/dbraw/zinc/49/76/91/1405497691.db2.gz HFYXPJDLEBGOAR-SJLPKXTDSA-N 2 1 390.553 3.155 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccco1 ZINC000050137182 1405497695 /nfs/dbraw/zinc/49/76/95/1405497695.db2.gz HFYXPJDLEBGOAR-SJLPKXTDSA-N 2 1 390.553 3.155 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCCCC1 ZINC000050136840 1405497805 /nfs/dbraw/zinc/49/78/05/1405497805.db2.gz ITXYHNFLDMUHPL-ZWKOTPCHSA-N 2 1 378.586 3.134 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccco1 ZINC000050137181 1405497973 /nfs/dbraw/zinc/49/79/73/1405497973.db2.gz HFYXPJDLEBGOAR-AEFFLSMTSA-N 2 1 390.553 3.155 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccco1 ZINC000050137181 1405497985 /nfs/dbraw/zinc/49/79/85/1405497985.db2.gz HFYXPJDLEBGOAR-AEFFLSMTSA-N 2 1 390.553 3.155 20 0 GGADMP COc1cccc(C[N@H+](C)CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000051324936 1405787696 /nfs/dbraw/zinc/78/76/96/1405787696.db2.gz QOJUJNBSBNULAC-UHFFFAOYSA-N 2 1 395.547 3.216 20 0 GGADMP COc1cccc(C[N@@H+](C)CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000051324936 1405787706 /nfs/dbraw/zinc/78/77/06/1405787706.db2.gz QOJUJNBSBNULAC-UHFFFAOYSA-N 2 1 395.547 3.216 20 0 GGADMP Cc1ccc(-c2noc([C@@H](C)[NH+]3CCC(C[NH+]4CCOCC4)CC3)n2)cc1F ZINC000051959865 1405889614 /nfs/dbraw/zinc/88/96/14/1405889614.db2.gz CXFLILFUGZFEHY-MRXNPFEDSA-N 2 1 388.487 3.289 20 0 GGADMP Cc1c(Cl)cccc1NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959755 1405889718 /nfs/dbraw/zinc/88/97/18/1405889718.db2.gz QUHMJDBUTAEDRQ-MRXNPFEDSA-N 2 1 379.932 3.020 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959047 1405889729 /nfs/dbraw/zinc/88/97/29/1405889729.db2.gz QGJKUZCVNAJNHL-HNNXBMFYSA-N 2 1 399.457 3.077 20 0 GGADMP COc1cccc(-c2nc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)cs2)c1 ZINC000051957459 1405889770 /nfs/dbraw/zinc/88/97/70/1405889770.db2.gz TTYTYXGBEHIBSE-UHFFFAOYSA-N 2 1 387.549 3.363 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(C[NH+]2CCOCC2)CC1)c1ccc2ccccc2c1 ZINC000051957011 1405889914 /nfs/dbraw/zinc/88/99/14/1405889914.db2.gz MYJANODLSHZDFW-LJQANCHMSA-N 2 1 395.547 3.061 20 0 GGADMP Cc1ccc(Cl)cc1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959792 1405889979 /nfs/dbraw/zinc/88/99/79/1405889979.db2.gz FVHWUIWXNFNUBT-INIZCTEOSA-N 2 1 379.932 3.020 20 0 GGADMP COc1ccc(-c2nc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)cs2)cc1 ZINC000051958997 1405890080 /nfs/dbraw/zinc/89/00/80/1405890080.db2.gz AZQMMCJWZANBMD-UHFFFAOYSA-N 2 1 387.549 3.363 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](C)CCc2ccccc2)CC1 ZINC000052000369 1405895718 /nfs/dbraw/zinc/89/57/18/1405895718.db2.gz QORUVKPMSQSPKI-UHFFFAOYSA-N 2 1 379.548 3.250 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccccc2C(F)(F)F)C2CC2)CC1 ZINC000052045746 1405910277 /nfs/dbraw/zinc/91/02/77/1405910277.db2.gz BQJZDONIKYLKNE-UHFFFAOYSA-N 2 1 383.458 3.270 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccccc2C(F)(F)F)C2CC2)CC1 ZINC000052045746 1405910300 /nfs/dbraw/zinc/91/03/00/1405910300.db2.gz BQJZDONIKYLKNE-UHFFFAOYSA-N 2 1 383.458 3.270 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+](Cc2ccccn2)C(C)C)CC1 ZINC000052218603 1405989794 /nfs/dbraw/zinc/98/97/94/1405989794.db2.gz ZIXLBESUZCAMGV-UHFFFAOYSA-N 2 1 394.563 3.381 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccccn2)C(C)C)CC1 ZINC000052218603 1405989806 /nfs/dbraw/zinc/98/98/06/1405989806.db2.gz ZIXLBESUZCAMGV-UHFFFAOYSA-N 2 1 394.563 3.381 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000052290405 1406009048 /nfs/dbraw/zinc/00/90/48/1406009048.db2.gz MZNBFMMPTJDXNC-HDICACEKSA-N 2 1 383.540 3.169 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000052290405 1406009055 /nfs/dbraw/zinc/00/90/55/1406009055.db2.gz MZNBFMMPTJDXNC-HDICACEKSA-N 2 1 383.540 3.169 20 0 GGADMP CC(C)n1nccc1NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000052713630 1406134316 /nfs/dbraw/zinc/13/43/16/1406134316.db2.gz ISUPJKOEWZIIFS-GOSISDBHSA-N 2 1 375.561 3.379 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000056788352 1407433167 /nfs/dbraw/zinc/43/31/67/1407433167.db2.gz USUHZAOFXMDFOV-QZTJIDSGSA-N 2 1 390.547 3.210 20 0 GGADMP C[NH+](C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000056796627 1407435736 /nfs/dbraw/zinc/43/57/36/1407435736.db2.gz LKECMLMQBJMVBP-QFIPXVFZSA-N 2 1 398.526 3.173 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000176320432 1428242334 /nfs/dbraw/zinc/24/23/34/1428242334.db2.gz VYHWOAPKSZEWLW-UHFFFAOYSA-N 2 1 383.540 3.278 20 0 GGADMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000057123971 1407528123 /nfs/dbraw/zinc/52/81/23/1407528123.db2.gz LREGFCSPOAFMCE-SFTDATJTSA-N 2 1 381.520 3.445 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NCc1ccc(-n2cc[nH+]c2C)nc1)CC(C)C ZINC000057127979 1407530915 /nfs/dbraw/zinc/53/09/15/1407530915.db2.gz HXDNQPLNWNYEDE-IBGZPJMESA-N 2 1 386.544 3.131 20 0 GGADMP CC[N@@H+]1CCc2nc(NC(=O)C3CC[NH+](Cc4ccccc4)CC3)sc2C1 ZINC000057153937 1407537061 /nfs/dbraw/zinc/53/70/61/1407537061.db2.gz GQIZURPFVWPPMR-UHFFFAOYSA-N 2 1 384.549 3.372 20 0 GGADMP CC[N@H+]1CCc2nc(NC(=O)C3CC[NH+](Cc4ccccc4)CC3)sc2C1 ZINC000057153937 1407537067 /nfs/dbraw/zinc/53/70/67/1407537067.db2.gz GQIZURPFVWPPMR-UHFFFAOYSA-N 2 1 384.549 3.372 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(NC(=O)C2CC[NH+](Cc3ccccc3)CC2)cn1 ZINC000057172778 1407544419 /nfs/dbraw/zinc/54/44/19/1407544419.db2.gz FPQQPLFPLYHHHU-UHFFFAOYSA-N 2 1 375.476 3.426 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000057173193 1407544534 /nfs/dbraw/zinc/54/45/34/1407544534.db2.gz ODQFHDMVMWWTFH-LJQANCHMSA-N 2 1 375.476 3.426 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000057173193 1407544537 /nfs/dbraw/zinc/54/45/37/1407544537.db2.gz ODQFHDMVMWWTFH-LJQANCHMSA-N 2 1 375.476 3.426 20 0 GGADMP Cc1ccc2nc(C[NH+]3CCC(C[N@H+](C)Cc4ccccc4)CC3)cc(=O)n2c1 ZINC000057843783 1407736222 /nfs/dbraw/zinc/73/62/22/1407736222.db2.gz ZNSYHHYWQVZJNX-UHFFFAOYSA-N 2 1 390.531 3.347 20 0 GGADMP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H](c1ccccc1Cl)[NH+](C)C ZINC000176353574 1428265451 /nfs/dbraw/zinc/26/54/51/1428265451.db2.gz UHYJKUPLIJQTOH-GJYPPUQNSA-N 2 1 378.948 3.211 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H](c1ccccc1Cl)[NH+](C)C ZINC000176353574 1428265464 /nfs/dbraw/zinc/26/54/64/1428265464.db2.gz UHYJKUPLIJQTOH-GJYPPUQNSA-N 2 1 378.948 3.211 20 0 GGADMP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000058436560 1407828003 /nfs/dbraw/zinc/82/80/03/1407828003.db2.gz KGAUIIUENNZFLU-HXUWFJFHSA-N 2 1 398.576 3.412 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)Nc1cccc2nsnc21 ZINC000058470779 1407833779 /nfs/dbraw/zinc/83/37/79/1407833779.db2.gz CMVCVPTWMGEOGL-UHFFFAOYSA-N 2 1 387.553 3.218 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000058533433 1407841492 /nfs/dbraw/zinc/84/14/92/1407841492.db2.gz URRLNWFKAFCRRM-RTBURBONSA-N 2 1 387.572 3.131 20 0 GGADMP O=C([C@@H]1CCC[N@H+](Cc2ccccc2)C1)N1CC[NH+](CCc2cccs2)CC1 ZINC000058835592 1407888096 /nfs/dbraw/zinc/88/80/96/1407888096.db2.gz FGRRIHWLHAADSR-OAQYLSRUSA-N 2 1 397.588 3.347 20 0 GGADMP O=C([C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](CCc2cccs2)CC1 ZINC000058835592 1407888100 /nfs/dbraw/zinc/88/81/00/1407888100.db2.gz FGRRIHWLHAADSR-OAQYLSRUSA-N 2 1 397.588 3.347 20 0 GGADMP CN(CC[N@H+](C)C1CCCCC1)C(=O)[C@@H](c1ccccc1)[NH+]1CCSCC1 ZINC000058879216 1407892762 /nfs/dbraw/zinc/89/27/62/1407892762.db2.gz JMEPCNFWDCVEPL-OAQYLSRUSA-N 2 1 389.609 3.499 20 0 GGADMP CN(CC[N@@H+](C)C1CCCCC1)C(=O)[C@@H](c1ccccc1)[NH+]1CCSCC1 ZINC000058879216 1407892763 /nfs/dbraw/zinc/89/27/63/1407892763.db2.gz JMEPCNFWDCVEPL-OAQYLSRUSA-N 2 1 389.609 3.499 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N[C@@H]1CC[NH+](CC2CCCC2)C1 ZINC000176375608 1428283068 /nfs/dbraw/zinc/28/30/68/1428283068.db2.gz WKLHCSWZMUXWSM-DHIUTWEWSA-N 2 1 398.595 3.115 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC000176375608 1428283078 /nfs/dbraw/zinc/28/30/78/1428283078.db2.gz WKLHCSWZMUXWSM-DHIUTWEWSA-N 2 1 398.595 3.115 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000176375608 1428283093 /nfs/dbraw/zinc/28/30/93/1428283093.db2.gz WKLHCSWZMUXWSM-DHIUTWEWSA-N 2 1 398.595 3.115 20 0 GGADMP C[N@@H+](CCCNC(=O)N[C@@H]1CCC[NH+](Cc2ccccc2)C1)Cc1ccccc1 ZINC000061501797 1408137978 /nfs/dbraw/zinc/13/79/78/1408137978.db2.gz SFWPAFGZHVMJOE-HSZRJFAPSA-N 2 1 394.563 3.472 20 0 GGADMP C[NH+](CCCNC(=O)N[C@@H]1CCC[N@H+](Cc2ccccc2)C1)Cc1ccccc1 ZINC000061501797 1408137990 /nfs/dbraw/zinc/13/79/90/1408137990.db2.gz SFWPAFGZHVMJOE-HSZRJFAPSA-N 2 1 394.563 3.472 20 0 GGADMP C[NH+](CCCNC(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)Cc1ccccc1 ZINC000061501797 1408137997 /nfs/dbraw/zinc/13/79/97/1408137997.db2.gz SFWPAFGZHVMJOE-HSZRJFAPSA-N 2 1 394.563 3.472 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H](C)[NH+]2CCc3ccccc3C2)c1 ZINC000061908521 1408190005 /nfs/dbraw/zinc/19/00/05/1408190005.db2.gz YOQDORNWRUKBAJ-IBGZPJMESA-N 2 1 394.563 3.384 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NC[C@H](C)[N@@H+]2CCc3ccccc3C2)c1 ZINC000061908521 1408190019 /nfs/dbraw/zinc/19/00/19/1408190019.db2.gz YOQDORNWRUKBAJ-IBGZPJMESA-N 2 1 394.563 3.384 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)c1 ZINC000061908521 1408190033 /nfs/dbraw/zinc/19/00/33/1408190033.db2.gz YOQDORNWRUKBAJ-IBGZPJMESA-N 2 1 394.563 3.384 20 0 GGADMP Fc1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1-n1cncn1 ZINC000062426609 1408256422 /nfs/dbraw/zinc/25/64/22/1408256422.db2.gz XEMXBEQKBQTEQF-HXUWFJFHSA-N 2 1 379.483 3.408 20 0 GGADMP Cn1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000062426485 1408256615 /nfs/dbraw/zinc/25/66/15/1408256615.db2.gz ZQAGCRVHRYFISP-HXUWFJFHSA-N 2 1 375.520 3.484 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC1CC[NH+](CC2CCCCC2)CC1)c1ccco1 ZINC000062529542 1408274324 /nfs/dbraw/zinc/27/43/24/1408274324.db2.gz PZXDERXUYWJCHL-LJQANCHMSA-N 2 1 376.545 3.226 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCC2)CC1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000063333346 1408339689 /nfs/dbraw/zinc/33/96/89/1408339689.db2.gz CKYSSYKFKSMSMQ-UHFFFAOYSA-N 2 1 398.595 3.211 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](CC2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000063407608 1408350259 /nfs/dbraw/zinc/35/02/59/1408350259.db2.gz BHUBUKBZZDTVTD-IBGZPJMESA-N 2 1 398.595 3.387 20 0 GGADMP CC(C)[N@@H+](C)CC(=O)Nc1ccc(CN2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000063466826 1408359447 /nfs/dbraw/zinc/35/94/47/1408359447.db2.gz LMXYDSUFQJSPGQ-UHFFFAOYSA-N 2 1 394.563 3.283 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cn(C)nc2-c2ccncc2)cc1F ZINC000063548904 1408370667 /nfs/dbraw/zinc/37/06/67/1408370667.db2.gz VEJWSLQETGZSJL-UHFFFAOYSA-N 2 1 376.439 3.405 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cn(C)nc2-c2cccnc2)cc1F ZINC000063548903 1408370762 /nfs/dbraw/zinc/37/07/62/1408370762.db2.gz JASMWNPSXPYULT-UHFFFAOYSA-N 2 1 376.439 3.405 20 0 GGADMP Cc1cc(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)ccc1N1CC[NH+](C)CC1 ZINC000063643422 1408386809 /nfs/dbraw/zinc/38/68/09/1408386809.db2.gz GAULQEBNMSGJFZ-QHCPKHFHSA-N 2 1 392.547 3.350 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCCC[N@@H+]3CCCC[C@@H]3C)cc2)C[C@@H](C)O1 ZINC000063665456 1408388461 /nfs/dbraw/zinc/38/84/61/1408388461.db2.gz XCQBPNANXJZVIR-XUVXKRRUSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCCC[N@H+]3CCCC[C@@H]3C)cc2)C[C@@H](C)O1 ZINC000063665456 1408388468 /nfs/dbraw/zinc/38/84/68/1408388468.db2.gz XCQBPNANXJZVIR-XUVXKRRUSA-N 2 1 387.568 3.290 20 0 GGADMP CCC[N@@H+](C)CC(=O)Nc1ccc(CN2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000063756044 1408403326 /nfs/dbraw/zinc/40/33/26/1408403326.db2.gz RFCRZIUIXBDOJP-UHFFFAOYSA-N 2 1 394.563 3.285 20 0 GGADMP C[C@@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)[N@H+]1CCc2ccccc2C1 ZINC000063915385 1408444934 /nfs/dbraw/zinc/44/49/34/1408444934.db2.gz SJJBQHZXZFGWSV-IBGZPJMESA-N 2 1 377.532 3.459 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1cccc(C[NH+]2CCCC2)c1 ZINC000064027019 1408469139 /nfs/dbraw/zinc/46/91/39/1408469139.db2.gz JRMSQBDFACUQGI-UHFFFAOYSA-N 2 1 393.531 3.409 20 0 GGADMP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[NH+](CCc2cccs2)CC1 ZINC000064027826 1408469406 /nfs/dbraw/zinc/46/94/06/1408469406.db2.gz PAZNDRRODRJIKG-UHFFFAOYSA-N 2 1 383.561 3.344 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N(CC[NH+](C)C)Cc2ccc(C)o2)c1 ZINC000064229450 1408515686 /nfs/dbraw/zinc/51/56/86/1408515686.db2.gz PXRRBBXIYGIUKZ-UHFFFAOYSA-N 2 1 386.540 3.313 20 0 GGADMP C[N@@H+]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)[C@H](c2ccccc2)C1 ZINC000176490184 1428337816 /nfs/dbraw/zinc/33/78/16/1428337816.db2.gz QMQXOCMZILMMBC-QFIPXVFZSA-N 2 1 384.568 3.482 20 0 GGADMP C[N@H+]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)[C@H](c2ccccc2)C1 ZINC000176490184 1428337825 /nfs/dbraw/zinc/33/78/25/1428337825.db2.gz QMQXOCMZILMMBC-QFIPXVFZSA-N 2 1 384.568 3.482 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)C1 ZINC000065441594 1408670008 /nfs/dbraw/zinc/67/00/08/1408670008.db2.gz RUQQKJIAEONATQ-KNQAVFIVSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000065441594 1408670011 /nfs/dbraw/zinc/67/00/11/1408670011.db2.gz RUQQKJIAEONATQ-KNQAVFIVSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000065441594 1408670015 /nfs/dbraw/zinc/67/00/15/1408670015.db2.gz RUQQKJIAEONATQ-KNQAVFIVSA-N 2 1 386.584 3.448 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)[NH+](C)C)cc1 ZINC000065467686 1408673467 /nfs/dbraw/zinc/67/34/67/1408673467.db2.gz SOJYZHFDADFLIB-XXBNENTESA-N 2 1 394.563 3.344 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000065475437 1408674868 /nfs/dbraw/zinc/67/48/68/1408674868.db2.gz XHYPDLHRIVGGPT-CEXWTWQISA-N 2 1 390.572 3.472 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000065518023 1408682414 /nfs/dbraw/zinc/68/24/14/1408682414.db2.gz RTDZDCIKRNDFLQ-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)Cc1ccccc1 ZINC000065541750 1408686363 /nfs/dbraw/zinc/68/63/63/1408686363.db2.gz NLFWQHQVJMWZIP-FQEVSTJZSA-N 2 1 384.524 3.238 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000176508480 1428343857 /nfs/dbraw/zinc/34/38/57/1428343857.db2.gz GTQSJXFAHBCPHG-JOCHJYFZSA-N 2 1 386.584 3.176 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)Cc1ccccc1 ZINC000065858300 1408743178 /nfs/dbraw/zinc/74/31/78/1408743178.db2.gz FYPCHQYEYCXOBM-GMAHTHKFSA-N 2 1 397.538 3.327 20 0 GGADMP C[C@H](C[NH2+]Cc1cc(Br)c2c(c1)OCCCO2)C[NH+]1CCCC1 ZINC000065932379 1408756902 /nfs/dbraw/zinc/75/69/02/1408756902.db2.gz UEBLVAZNDJAZMO-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP COc1cccc(C[NH+]2CCC(NC(=O)[C@@H](c3ccccc3)[NH+](C)C)CC2)c1 ZINC000066047994 1408778759 /nfs/dbraw/zinc/77/87/59/1408778759.db2.gz RJTRGVOUTVNQEF-JOCHJYFZSA-N 2 1 381.520 3.079 20 0 GGADMP C[NH+](C)[C@@H](C(=O)NCCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000066047194 1408778823 /nfs/dbraw/zinc/77/88/23/1408778823.db2.gz BNOVCCRONLNWEI-HSZRJFAPSA-N 2 1 394.563 3.008 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)N1CC[C@H]([NH+]2CCCC2)C1 ZINC000066178602 1408787646 /nfs/dbraw/zinc/78/76/46/1408787646.db2.gz SQRSUUJWXSYIPM-KNQAVFIVSA-N 2 1 384.568 3.441 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@H](c2cccc(OC)c2)[NH+]2CCCC2)cc1 ZINC000066242378 1408794772 /nfs/dbraw/zinc/79/47/72/1408794772.db2.gz VNGFKFFUFPAGTF-JOCHJYFZSA-N 2 1 396.535 3.197 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NCc2ccc(-n3cc[nH+]c3C)c(F)c2)cc1 ZINC000066244697 1408795092 /nfs/dbraw/zinc/79/50/92/1408795092.db2.gz VFEWNANKLYADKL-UHFFFAOYSA-N 2 1 381.455 3.185 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)[C@H](c2ccccc2)[NH+]2CCSCC2)CC1 ZINC000066395502 1408830265 /nfs/dbraw/zinc/83/02/65/1408830265.db2.gz HFOVVVCBZKAUFP-FQEVSTJZSA-N 2 1 375.582 3.109 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(F)c4cccnc34)CC2)CC1 ZINC000066568333 1408859176 /nfs/dbraw/zinc/85/91/76/1408859176.db2.gz ZQXFAKXJMNGNOT-UHFFFAOYSA-N 2 1 398.526 3.140 20 0 GGADMP C#CC[NH+]1CCC(C(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000066921545 1408952400 /nfs/dbraw/zinc/95/24/00/1408952400.db2.gz ZFXAVDRLEYGAGN-UHFFFAOYSA-N 2 1 381.564 3.413 20 0 GGADMP C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2ccc(CSC(F)F)o2)c1 ZINC000066994614 1408974658 /nfs/dbraw/zinc/97/46/58/1408974658.db2.gz YWNNYPJFUBNMGD-UHFFFAOYSA-N 2 1 397.491 3.317 20 0 GGADMP Cn1cc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c(-c2cccnc2)n1 ZINC000067187806 1409035892 /nfs/dbraw/zinc/03/58/92/1409035892.db2.gz YNASLCHMCAVYKG-UHFFFAOYSA-N 2 1 375.520 3.279 20 0 GGADMP Cc1nn(CCO)c(C)c1C[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000067189305 1409036583 /nfs/dbraw/zinc/03/65/83/1409036583.db2.gz XTIOPUHBOWJPSL-HDICACEKSA-N 2 1 384.568 3.260 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)N2CCC(C[NH+](C)Cc3ccccc3)CC2)C1 ZINC000067282591 1409063667 /nfs/dbraw/zinc/06/36/67/1409063667.db2.gz KWIFALDLWAOFED-QFIPXVFZSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1 ZINC000067282591 1409063671 /nfs/dbraw/zinc/06/36/71/1409063671.db2.gz KWIFALDLWAOFED-QFIPXVFZSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C1 ZINC000067282591 1409063674 /nfs/dbraw/zinc/06/36/74/1409063674.db2.gz KWIFALDLWAOFED-QFIPXVFZSA-N 2 1 386.584 3.270 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000067414793 1409109928 /nfs/dbraw/zinc/10/99/28/1409109928.db2.gz XFCCUMOWNGDZBJ-LJQANCHMSA-N 2 1 397.567 3.381 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000067414793 1409109936 /nfs/dbraw/zinc/10/99/36/1409109936.db2.gz XFCCUMOWNGDZBJ-LJQANCHMSA-N 2 1 397.567 3.381 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[NH+](C3CCCC3)CC2)cc1F ZINC000067646603 1409195792 /nfs/dbraw/zinc/19/57/92/1409195792.db2.gz GUGFWWMYDVNJRF-UHFFFAOYSA-N 2 1 385.487 3.090 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCC[N@H+]2CCCC[C@@H]2C)cc1F ZINC000067646348 1409196502 /nfs/dbraw/zinc/19/65/02/1409196502.db2.gz OBCNDIUEJANBGM-INIZCTEOSA-N 2 1 387.503 3.384 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc1F ZINC000067646348 1409196509 /nfs/dbraw/zinc/19/65/09/1409196509.db2.gz OBCNDIUEJANBGM-INIZCTEOSA-N 2 1 387.503 3.384 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C)C[NH+]2CCCCC2)cc1F ZINC000067646788 1409196898 /nfs/dbraw/zinc/19/68/98/1409196898.db2.gz DSWKTZNYWQUVIW-MRXNPFEDSA-N 2 1 387.503 3.241 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C)C[NH+]2CCCCC2)cc1F ZINC000067646789 1409197068 /nfs/dbraw/zinc/19/70/68/1409197068.db2.gz DSWKTZNYWQUVIW-INIZCTEOSA-N 2 1 387.503 3.241 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000067691557 1409207599 /nfs/dbraw/zinc/20/75/99/1409207599.db2.gz RIXMYQULROHOSO-FQEVSTJZSA-N 2 1 387.568 3.290 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000067735056 1409216972 /nfs/dbraw/zinc/21/69/72/1409216972.db2.gz PDHSSSDPICWFCX-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)o1 ZINC000067976605 1409267433 /nfs/dbraw/zinc/26/74/33/1409267433.db2.gz JVWGWSNSYZZLAV-QGZVFWFLSA-N 2 1 380.492 3.489 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)o1 ZINC000067976605 1409267438 /nfs/dbraw/zinc/26/74/38/1409267438.db2.gz JVWGWSNSYZZLAV-QGZVFWFLSA-N 2 1 380.492 3.489 20 0 GGADMP COc1ccc([C@@H](CNC(=O)C[N@H+](C)Cc2ccccc2)[NH+]2CCCC2)cc1 ZINC000068280640 1409352176 /nfs/dbraw/zinc/35/21/76/1409352176.db2.gz PFHVMGQFZGJNGP-JOCHJYFZSA-N 2 1 381.520 3.080 20 0 GGADMP COc1ccc([C@@H](CNC(=O)C[N@@H+](C)Cc2ccccc2)[NH+]2CCCC2)cc1 ZINC000068280640 1409352180 /nfs/dbraw/zinc/35/21/80/1409352180.db2.gz PFHVMGQFZGJNGP-JOCHJYFZSA-N 2 1 381.520 3.080 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@H](C)C[N@H+]3C[C@H](C)C[C@H](C)C3)CC2)cs1 ZINC000068306212 1409358965 /nfs/dbraw/zinc/35/89/65/1409358965.db2.gz NFVXDYHZIAYQQR-IXDOHACOSA-N 2 1 392.613 3.146 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@H](C)C[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)cs1 ZINC000068306212 1409358968 /nfs/dbraw/zinc/35/89/68/1409358968.db2.gz NFVXDYHZIAYQQR-IXDOHACOSA-N 2 1 392.613 3.146 20 0 GGADMP COc1cccc([C@H](CNC(=O)C[N@H+](C)Cc2ccccc2)[NH+]2CCCC2)c1 ZINC000068410793 1409394790 /nfs/dbraw/zinc/39/47/90/1409394790.db2.gz VSQBQVZBXWZWAN-QFIPXVFZSA-N 2 1 381.520 3.080 20 0 GGADMP COc1cccc([C@H](CNC(=O)C[N@@H+](C)Cc2ccccc2)[NH+]2CCCC2)c1 ZINC000068410793 1409394795 /nfs/dbraw/zinc/39/47/95/1409394795.db2.gz VSQBQVZBXWZWAN-QFIPXVFZSA-N 2 1 381.520 3.080 20 0 GGADMP C[NH+](C)CCC(=O)Nc1ccc(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000068441995 1409403982 /nfs/dbraw/zinc/40/39/82/1409403982.db2.gz YGTZSJWWZQJZPQ-NRFANRHFSA-N 2 1 394.519 3.180 20 0 GGADMP C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000068565321 1409440017 /nfs/dbraw/zinc/44/00/17/1409440017.db2.gz NHGSURWXZCLWSF-SFHVURJKSA-N 2 1 392.931 3.309 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1 ZINC000068586024 1409445729 /nfs/dbraw/zinc/44/57/29/1409445729.db2.gz KOAOFCCFEWGLJD-UHFFFAOYSA-N 2 1 377.920 3.008 20 0 GGADMP CC(C)OCC[NH+]1CCC(NC(=O)[C@H]2CCCC[N@H+]2Cc2ccccc2)CC1 ZINC000176689786 1428409182 /nfs/dbraw/zinc/40/91/82/1428409182.db2.gz IUHVWOPYCFMLBP-JOCHJYFZSA-N 2 1 387.568 3.047 20 0 GGADMP C[N@H+](CCc1ccccc1F)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000068861071 1409509752 /nfs/dbraw/zinc/50/97/52/1409509752.db2.gz KMCFBHVTMLBMTF-UHFFFAOYSA-N 2 1 383.511 3.212 20 0 GGADMP C[N@@H+](CCc1ccccc1F)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000068861071 1409509756 /nfs/dbraw/zinc/50/97/56/1409509756.db2.gz KMCFBHVTMLBMTF-UHFFFAOYSA-N 2 1 383.511 3.212 20 0 GGADMP CSc1ccc(NC(=O)C[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000069017046 1409544026 /nfs/dbraw/zinc/54/40/26/1409544026.db2.gz SLKGMRWCFPYEKY-IAGOWNOFSA-N 2 1 391.581 3.168 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](CC(=O)N[C@@H](c3ccccc3)C3CC3)CC2)C[C@H](C)O1 ZINC000069017141 1409544046 /nfs/dbraw/zinc/54/40/46/1409544046.db2.gz IDFAIAKNKBGLIN-GLDPYIMESA-N 2 1 399.579 3.075 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CC(=O)N[C@@H](c3ccccc3)C3CC3)CC2)C[C@H](C)O1 ZINC000069017141 1409544053 /nfs/dbraw/zinc/54/40/53/1409544053.db2.gz IDFAIAKNKBGLIN-GLDPYIMESA-N 2 1 399.579 3.075 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCOCC2)CC1)N[C@@H](c1ccccc1)C1CCCC1 ZINC000069028450 1409546876 /nfs/dbraw/zinc/54/68/76/1409546876.db2.gz LMDSHTKENPTQOF-DEOSSOPVSA-N 2 1 399.579 3.078 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)c1ccc(C[NH+]2CCCC2)cc1)[NH+](C)C ZINC000069180386 1409582392 /nfs/dbraw/zinc/58/23/92/1409582392.db2.gz HZZWGVBLXAVPJB-OAQYLSRUSA-N 2 1 381.520 3.324 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)N3CCC[N@H+](C(C)C)CC3)c(C)c2)CC1 ZINC000069224665 1409589775 /nfs/dbraw/zinc/58/97/75/1409589775.db2.gz ZGYYNCDLXISMMS-UHFFFAOYSA-N 2 1 387.572 3.085 20 0 GGADMP CCOc1cc(C[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)ccc1OC ZINC000069785296 1409698578 /nfs/dbraw/zinc/69/85/78/1409698578.db2.gz IOKHUCMCLXKIBI-UHFFFAOYSA-N 2 1 383.536 3.131 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(-n3cncn3)cc2)C[C@H](C)O1 ZINC000069833382 1409712013 /nfs/dbraw/zinc/71/20/13/1409712013.db2.gz KPMKGDJYZZOHLR-KDURUIRLSA-N 2 1 391.519 3.166 20 0 GGADMP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000071935882 1409831791 /nfs/dbraw/zinc/83/17/91/1409831791.db2.gz PHEMRVCGSILBRU-SFTDATJTSA-N 2 1 386.584 3.272 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)C1 ZINC000072020089 1409838358 /nfs/dbraw/zinc/83/83/58/1409838358.db2.gz VFYJFXGHGUELER-SFHLNBCPSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)C1 ZINC000072020089 1409838359 /nfs/dbraw/zinc/83/83/59/1409838359.db2.gz VFYJFXGHGUELER-SFHLNBCPSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)N2CC[NH+](C)C[C@@H]2c2ccccc2)C1 ZINC000072020087 1409838454 /nfs/dbraw/zinc/83/84/54/1409838454.db2.gz VFYJFXGHGUELER-SVFBPWRDSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)N2CC[NH+](C)C[C@@H]2c2ccccc2)C1 ZINC000072020087 1409838456 /nfs/dbraw/zinc/83/84/56/1409838456.db2.gz VFYJFXGHGUELER-SVFBPWRDSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)C1 ZINC000072020087 1409838460 /nfs/dbraw/zinc/83/84/60/1409838460.db2.gz VFYJFXGHGUELER-SVFBPWRDSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)C1 ZINC000072020087 1409838463 /nfs/dbraw/zinc/83/84/63/1409838463.db2.gz VFYJFXGHGUELER-SVFBPWRDSA-N 2 1 386.584 3.441 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](CC(=O)Nc2ccc(C)c(Cl)c2)CC1 ZINC000072694695 1409852610 /nfs/dbraw/zinc/85/26/10/1409852610.db2.gz RZDKYCPQSMFMEZ-UHFFFAOYSA-N 2 1 381.948 3.410 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2ccc(Cl)cc2)CC1 ZINC000072694681 1409852667 /nfs/dbraw/zinc/85/26/67/1409852667.db2.gz NLDQWHMPQVGXBO-MRXNPFEDSA-N 2 1 381.948 3.490 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](CC(=O)Nc2ccc(Cl)cc2C)CC1 ZINC000072694682 1409852742 /nfs/dbraw/zinc/85/27/42/1409852742.db2.gz CXJARNDRBDDEOA-UHFFFAOYSA-N 2 1 381.948 3.410 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000073541810 1409861930 /nfs/dbraw/zinc/86/19/30/1409861930.db2.gz XBWWBNKWLAOSGO-LJQANCHMSA-N 2 1 378.948 3.088 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCCC[NH+]1CCCCC1 ZINC000073536468 1409861975 /nfs/dbraw/zinc/86/19/75/1409861975.db2.gz JXGZGGIVGYVPPI-JOCHJYFZSA-N 2 1 386.584 3.416 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000073618402 1409862795 /nfs/dbraw/zinc/86/27/95/1409862795.db2.gz UJWJUPQHNLBOPJ-NRFANRHFSA-N 2 1 386.584 3.067 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000073618404 1409863439 /nfs/dbraw/zinc/86/34/39/1409863439.db2.gz UJWJUPQHNLBOPJ-OAQYLSRUSA-N 2 1 386.584 3.067 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(C)CC1 ZINC000073897630 1409866802 /nfs/dbraw/zinc/86/68/02/1409866802.db2.gz YTJXAELURZGHEF-UNMCSNQZSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(C)CC1 ZINC000073897635 1409866854 /nfs/dbraw/zinc/86/68/54/1409866854.db2.gz YTJXAELURZGHEF-IFMALSPDSA-N 2 1 386.584 3.270 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000073903368 1409867095 /nfs/dbraw/zinc/86/70/95/1409867095.db2.gz VVFBAXRLRFNGEK-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000073903368 1409867100 /nfs/dbraw/zinc/86/71/00/1409867100.db2.gz VVFBAXRLRFNGEK-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000073903368 1409867101 /nfs/dbraw/zinc/86/71/01/1409867101.db2.gz VVFBAXRLRFNGEK-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)CC1 ZINC000074008405 1409868670 /nfs/dbraw/zinc/86/86/70/1409868670.db2.gz GVJSKQOQIYWALT-PMACEKPBSA-N 2 1 378.605 3.403 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2ccnn2C2CCCC2)CC1 ZINC000074319747 1409871487 /nfs/dbraw/zinc/87/14/87/1409871487.db2.gz YWEQSMOBYMGAFF-UHFFFAOYSA-N 2 1 375.561 3.381 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2ccnn2C2CCCC2)CC1 ZINC000074319747 1409871490 /nfs/dbraw/zinc/87/14/90/1409871490.db2.gz YWEQSMOBYMGAFF-UHFFFAOYSA-N 2 1 375.561 3.381 20 0 GGADMP CCc1ccc([C@H](CNC(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)[NH+](C)C)cc1 ZINC000074833176 1409877071 /nfs/dbraw/zinc/87/70/71/1409877071.db2.gz GMTJJQWYKGQYOL-UNMCSNQZSA-N 2 1 386.584 3.225 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000074848828 1409877665 /nfs/dbraw/zinc/87/76/65/1409877665.db2.gz GDCSAYZIQZMCLZ-HXUWFJFHSA-N 2 1 386.584 3.400 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)N1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000074848828 1409877667 /nfs/dbraw/zinc/87/76/67/1409877667.db2.gz GDCSAYZIQZMCLZ-HXUWFJFHSA-N 2 1 386.584 3.400 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000074848828 1409877669 /nfs/dbraw/zinc/87/76/69/1409877669.db2.gz GDCSAYZIQZMCLZ-HXUWFJFHSA-N 2 1 386.584 3.400 20 0 GGADMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@H](C[NH+](C)CC3CC3)C2)C1 ZINC000074879572 1409878963 /nfs/dbraw/zinc/87/89/63/1409878963.db2.gz HUBGGQBCHBIUMN-UYAOXDASSA-N 2 1 378.605 3.260 20 0 GGADMP CC[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)C1 ZINC000074879572 1409878966 /nfs/dbraw/zinc/87/89/66/1409878966.db2.gz HUBGGQBCHBIUMN-UYAOXDASSA-N 2 1 378.605 3.260 20 0 GGADMP CC[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)C1 ZINC000074879572 1409878967 /nfs/dbraw/zinc/87/89/67/1409878967.db2.gz HUBGGQBCHBIUMN-UYAOXDASSA-N 2 1 378.605 3.260 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](Cc2nc(-c3ccc(F)cc3)no2)CC1 ZINC000075007382 1409880046 /nfs/dbraw/zinc/88/00/46/1409880046.db2.gz FJCIIHOWDJAPCB-UHFFFAOYSA-N 2 1 376.476 3.199 20 0 GGADMP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(C[NH+]3CCSCC3)cc2)[C@H](C)C1 ZINC000076487960 1409888769 /nfs/dbraw/zinc/88/87/69/1409888769.db2.gz YFKBNVGXISZCCH-YLJYHZDGSA-N 2 1 375.582 3.038 20 0 GGADMP Cc1nc(N2CCCCC2)sc1C[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000076763112 1409891367 /nfs/dbraw/zinc/89/13/67/1409891367.db2.gz RNKMWPPKPJKVCW-KRWDZBQOSA-N 2 1 378.586 3.032 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1OCC(C)C ZINC000076763518 1409891452 /nfs/dbraw/zinc/89/14/52/1409891452.db2.gz LVHVTFXESYMNQQ-IBGZPJMESA-N 2 1 376.541 3.321 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1OCC(C)C ZINC000076763524 1409891581 /nfs/dbraw/zinc/89/15/81/1409891581.db2.gz LVHVTFXESYMNQQ-LJQANCHMSA-N 2 1 376.541 3.321 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)CC1 ZINC000077171297 1409893819 /nfs/dbraw/zinc/89/38/19/1409893819.db2.gz BZAFQCSLCQCPER-JOCHJYFZSA-N 2 1 380.536 3.241 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@@H]2c2ccc[nH]2)CC1 ZINC000077171297 1409893820 /nfs/dbraw/zinc/89/38/20/1409893820.db2.gz BZAFQCSLCQCPER-JOCHJYFZSA-N 2 1 380.536 3.241 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000077545856 1409897188 /nfs/dbraw/zinc/89/71/88/1409897188.db2.gz ILFNGRQUTHVMNW-HXUWFJFHSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000077545857 1409897323 /nfs/dbraw/zinc/89/73/23/1409897323.db2.gz ILFNGRQUTHVMNW-FQEVSTJZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCN(c2ccc(C(=O)N3CC[N@H+](C)Cc4ccccc43)cc2)CC1 ZINC000078415525 1409917382 /nfs/dbraw/zinc/91/73/82/1409917382.db2.gz HFOZWXHVKYHNBT-UHFFFAOYSA-N 2 1 392.547 3.309 20 0 GGADMP CC(C)[NH+]1CCN(c2ccc(C(=O)N3CC[N@@H+](C)Cc4ccccc43)cc2)CC1 ZINC000078415525 1409917400 /nfs/dbraw/zinc/91/74/00/1409917400.db2.gz HFOZWXHVKYHNBT-UHFFFAOYSA-N 2 1 392.547 3.309 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000176742072 1428443957 /nfs/dbraw/zinc/44/39/57/1428443957.db2.gz WTRGGQBTJAJDIX-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@@H]1CCCC[NH+]1CCNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000176742072 1428443959 /nfs/dbraw/zinc/44/39/59/1428443959.db2.gz WTRGGQBTJAJDIX-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@@H]1CCCC[NH+]1CCNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000176742072 1428443963 /nfs/dbraw/zinc/44/39/63/1428443963.db2.gz WTRGGQBTJAJDIX-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CC1 ZINC000079168971 1409960736 /nfs/dbraw/zinc/96/07/36/1409960736.db2.gz PTLQFRRAPKZUFZ-LJQANCHMSA-N 2 1 384.568 3.202 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@H]3CC[N@H+](C4CC4)C3)cc2)CC1 ZINC000079168920 1409960905 /nfs/dbraw/zinc/96/09/05/1409960905.db2.gz OKPDMVIUJGSQDD-OAQYLSRUSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)N2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC000079394070 1409974672 /nfs/dbraw/zinc/97/46/72/1409974672.db2.gz WHJWSXIDGVBIHE-OAQYLSRUSA-N 2 1 386.584 3.416 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC000079394070 1409974698 /nfs/dbraw/zinc/97/46/98/1409974698.db2.gz WHJWSXIDGVBIHE-OAQYLSRUSA-N 2 1 386.584 3.416 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC000079394070 1409974716 /nfs/dbraw/zinc/97/47/16/1409974716.db2.gz WHJWSXIDGVBIHE-OAQYLSRUSA-N 2 1 386.584 3.416 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)CC1 ZINC000079572644 1409982389 /nfs/dbraw/zinc/98/23/89/1409982389.db2.gz BFCGYZOPVQRYEK-FQEVSTJZSA-N 2 1 378.536 3.190 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC(CC[NH+](C)C)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079599328 1409982639 /nfs/dbraw/zinc/98/26/39/1409982639.db2.gz RZVPRYOCSYFHHB-QFIPXVFZSA-N 2 1 386.584 3.197 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)N[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC000079627283 1409984409 /nfs/dbraw/zinc/98/44/09/1409984409.db2.gz KWRJGWSILIBWRY-JOCHJYFZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000079627283 1409984431 /nfs/dbraw/zinc/98/44/31/1409984431.db2.gz KWRJGWSILIBWRY-JOCHJYFZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000079627283 1409984439 /nfs/dbraw/zinc/98/44/39/1409984439.db2.gz KWRJGWSILIBWRY-JOCHJYFZSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000079653467 1409985056 /nfs/dbraw/zinc/98/50/56/1409985056.db2.gz ACWSIEGMYOSOAJ-XLIONFOSSA-N 2 1 378.536 3.240 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000079653456 1409985338 /nfs/dbraw/zinc/98/53/38/1409985338.db2.gz KTCAVUPUIQZRME-XLIONFOSSA-N 2 1 378.536 3.382 20 0 GGADMP CC[C@H](CNC(=O)N1CCC([NH+](CC)CC)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079982774 1409996211 /nfs/dbraw/zinc/99/62/11/1409996211.db2.gz VYHACJIZMCNCIT-OAQYLSRUSA-N 2 1 386.584 3.339 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000080012324 1409998563 /nfs/dbraw/zinc/99/85/63/1409998563.db2.gz FIBJZUDYODQMMW-UHFFFAOYSA-N 2 1 386.584 3.339 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000080064795 1409999710 /nfs/dbraw/zinc/99/97/10/1409999710.db2.gz JLEHVGQXXOWNEX-KNQAVFIVSA-N 2 1 386.584 3.459 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)NC1CCC([NH+]2CCCCC2)CC1 ZINC000080157103 1410001931 /nfs/dbraw/zinc/00/19/31/1410001931.db2.gz PWFYZKOUMHMBFT-KBWCOIMZSA-N 2 1 376.589 3.347 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000080655922 1410009237 /nfs/dbraw/zinc/00/92/37/1410009237.db2.gz VORUVWAIFZHOOV-NRFANRHFSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000080655922 1410009245 /nfs/dbraw/zinc/00/92/45/1410009245.db2.gz VORUVWAIFZHOOV-NRFANRHFSA-N 2 1 375.532 3.417 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCCC[NH+](C(C)C)C(C)C)CC2)[nH+]c1 ZINC000080704261 1410010518 /nfs/dbraw/zinc/01/05/18/1410010518.db2.gz OUMWZSKPBKSUGL-UHFFFAOYSA-N 2 1 375.561 3.167 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000081156068 1410015599 /nfs/dbraw/zinc/01/55/99/1410015599.db2.gz WTMSIKFUEBIGRW-LJQANCHMSA-N 2 1 380.536 3.103 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000081156151 1410015933 /nfs/dbraw/zinc/01/59/33/1410015933.db2.gz XGLJPZWNTGGLNT-UHFFFAOYSA-N 2 1 379.548 3.455 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N1CCC[N@@H+](Cc2ccc(C)cc2)CC1 ZINC000081243964 1410016392 /nfs/dbraw/zinc/01/63/92/1410016392.db2.gz AOKDTRWMEYXXLA-UHFFFAOYSA-N 2 1 377.598 3.104 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000081363203 1410018407 /nfs/dbraw/zinc/01/84/07/1410018407.db2.gz ZMUPRHNFQQMFOQ-VQTJNVASSA-N 2 1 375.532 3.228 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)C1 ZINC000081363203 1410018415 /nfs/dbraw/zinc/01/84/15/1410018415.db2.gz ZMUPRHNFQQMFOQ-VQTJNVASSA-N 2 1 375.532 3.228 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000081363203 1410018418 /nfs/dbraw/zinc/01/84/18/1410018418.db2.gz ZMUPRHNFQQMFOQ-VQTJNVASSA-N 2 1 375.532 3.228 20 0 GGADMP CC(C)[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000081615125 1410022922 /nfs/dbraw/zinc/02/29/22/1410022922.db2.gz WLQGCTSCMLOBJE-CTNGQTDRSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000081615125 1410022929 /nfs/dbraw/zinc/02/29/29/1410022929.db2.gz WLQGCTSCMLOBJE-CTNGQTDRSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000081615125 1410022937 /nfs/dbraw/zinc/02/29/37/1410022937.db2.gz WLQGCTSCMLOBJE-CTNGQTDRSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000081615125 1410022947 /nfs/dbraw/zinc/02/29/47/1410022947.db2.gz WLQGCTSCMLOBJE-CTNGQTDRSA-N 2 1 375.532 3.417 20 0 GGADMP CC[NH+](CC)[C@@H](C(=O)NCCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1 ZINC000083028001 1410027030 /nfs/dbraw/zinc/02/70/30/1410027030.db2.gz ILWYDBQWRUSGLC-SVFBPWRDSA-N 2 1 375.557 3.075 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)CC1 ZINC000085389936 1410040389 /nfs/dbraw/zinc/04/03/89/1410040389.db2.gz ZTVFPEXFNHJMDL-UGKGYDQZSA-N 2 1 386.584 3.400 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H]3CN(Cc4ccccc4)C[C@@H]3C)CC2)nc(C)[nH+]1 ZINC000088740735 1410051251 /nfs/dbraw/zinc/05/12/51/1410051251.db2.gz UOSATOYXWPFNGL-JTSKRJEESA-N 2 1 379.552 3.172 20 0 GGADMP COc1ccc(C[C@@H](C)[NH2+]CC2([NH+]3CCCCC3)CCOCC2)cc1OC ZINC000089594307 1410055154 /nfs/dbraw/zinc/05/51/54/1410055154.db2.gz XOHWCIYJJZJIKL-GOSISDBHSA-N 2 1 376.541 3.260 20 0 GGADMP COCC[C@H](Cc1cccc(F)c1)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000089594456 1410055990 /nfs/dbraw/zinc/05/59/90/1410055990.db2.gz MYVRZUATAFBUAI-OAQYLSRUSA-N 2 1 378.532 3.398 20 0 GGADMP CN1CCC([NH+]2CCC(N[C@H]3C[N@H+](Cc4ccccc4)C(C)(C)C3)CC2)CC1 ZINC000090172036 1410062882 /nfs/dbraw/zinc/06/28/82/1410062882.db2.gz ZOTHPNSWQHPHFZ-JOCHJYFZSA-N 2 1 384.612 3.188 20 0 GGADMP CN1CCC([NH+]2CCC(N[C@H]3C[N@@H+](Cc4ccccc4)C(C)(C)C3)CC2)CC1 ZINC000090172036 1410062889 /nfs/dbraw/zinc/06/28/89/1410062889.db2.gz ZOTHPNSWQHPHFZ-JOCHJYFZSA-N 2 1 384.612 3.188 20 0 GGADMP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000090585696 1410065069 /nfs/dbraw/zinc/06/50/69/1410065069.db2.gz GDFANFXKHNAJDX-MSOLQXFVSA-N 2 1 381.586 3.467 20 0 GGADMP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000090585706 1410065186 /nfs/dbraw/zinc/06/51/86/1410065186.db2.gz GDFANFXKHNAJDX-QZTJIDSGSA-N 2 1 381.586 3.467 20 0 GGADMP COCCc1nc(C)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)s1 ZINC000090526741 1410065247 /nfs/dbraw/zinc/06/52/47/1410065247.db2.gz QFQSKYLHVJGUDZ-QGTPRVQTSA-N 2 1 381.586 3.059 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCO[C@]4(CCSC4)C3)CC2)cc1 ZINC000090540147 1410065399 /nfs/dbraw/zinc/06/53/99/1410065399.db2.gz WZFGVMGUYQCCBY-NHCUHLMSSA-N 2 1 378.557 3.477 20 0 GGADMP C[C@H]1C[C@H](NCc2ccnc(OCC[NH+](C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000090937360 1410067733 /nfs/dbraw/zinc/06/77/33/1410067733.db2.gz GNIZOYZVMUNLIP-SIKLNZKXSA-N 2 1 382.552 3.165 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CCN1Cc1ccccc1 ZINC000090937360 1410067739 /nfs/dbraw/zinc/06/77/39/1410067739.db2.gz GNIZOYZVMUNLIP-SIKLNZKXSA-N 2 1 382.552 3.165 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000090937360 1410067744 /nfs/dbraw/zinc/06/77/44/1410067744.db2.gz GNIZOYZVMUNLIP-SIKLNZKXSA-N 3 1 382.552 3.165 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000090937360 1410067753 /nfs/dbraw/zinc/06/77/53/1410067753.db2.gz GNIZOYZVMUNLIP-SIKLNZKXSA-N 3 1 382.552 3.165 20 0 GGADMP CC[C@H](CSC)[N@@H+](C)CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000091097160 1410070022 /nfs/dbraw/zinc/07/00/22/1410070022.db2.gz KOBDVGFDKFQQKE-HXUWFJFHSA-N 2 1 377.598 3.149 20 0 GGADMP CCN(CC)c1ncc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000092586985 1410175205 /nfs/dbraw/zinc/17/52/05/1410175205.db2.gz VDLRUELQZNTJQM-CALCHBBNSA-N 2 1 380.602 3.311 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3OCC(=O)N(C)C)C2)CC1 ZINC000092587752 1410176587 /nfs/dbraw/zinc/17/65/87/1410176587.db2.gz NJSFNBNTVHZBHD-HXUWFJFHSA-N 2 1 387.568 3.098 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3OCC(=O)N(C)C)C2)CC1 ZINC000092587752 1410176595 /nfs/dbraw/zinc/17/65/95/1410176595.db2.gz NJSFNBNTVHZBHD-HXUWFJFHSA-N 2 1 387.568 3.098 20 0 GGADMP COc1cc(OC)c(OC)cc1C[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000092587314 1410177107 /nfs/dbraw/zinc/17/71/07/1410177107.db2.gz XCQACOQSEWLDCH-CALCHBBNSA-N 2 1 392.540 3.034 20 0 GGADMP C[NH+](C)CCNC(=O)C1CC[NH+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000092615615 1410180164 /nfs/dbraw/zinc/18/01/64/1410180164.db2.gz HTAKPVOCYYZECY-UHFFFAOYSA-N 2 1 391.865 3.249 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)cc1 ZINC000092664405 1410183834 /nfs/dbraw/zinc/18/38/34/1410183834.db2.gz REDASARRIMYJDT-PMACEKPBSA-N 2 1 381.568 3.376 20 0 GGADMP CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000092704389 1410190717 /nfs/dbraw/zinc/19/07/17/1410190717.db2.gz SLWTYACQSXQRSR-LJQANCHMSA-N 2 1 389.540 3.260 20 0 GGADMP CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000092730417 1410193676 /nfs/dbraw/zinc/19/36/76/1410193676.db2.gz GGASRRNYCJHPCS-AZUAARDMSA-N 2 1 375.557 3.144 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)c3ccccc3)C2)cc1 ZINC000092783882 1410199298 /nfs/dbraw/zinc/19/92/98/1410199298.db2.gz CERIUMFKZRYNIX-NRFANRHFSA-N 2 1 395.547 3.269 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1 ZINC000092783881 1410199553 /nfs/dbraw/zinc/19/95/53/1410199553.db2.gz CERIUMFKZRYNIX-OAQYLSRUSA-N 2 1 395.547 3.269 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092820975 1410203836 /nfs/dbraw/zinc/20/38/36/1410203836.db2.gz SINWJUGWAIBLNQ-LJQANCHMSA-N 2 1 380.536 3.325 20 0 GGADMP C[C@H](C1CC1)N(C(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)C1CC1 ZINC000092821387 1410204542 /nfs/dbraw/zinc/20/45/42/1410204542.db2.gz GORLGDOMYYVKIN-GOSISDBHSA-N 2 1 384.568 3.409 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000093064456 1410219839 /nfs/dbraw/zinc/21/98/39/1410219839.db2.gz JKIDBCLJXAPBHE-QFIPXVFZSA-N 2 1 378.520 3.079 20 0 GGADMP Cn1cc(C[N@@H+](C)CC2CC[NH+](C)CC2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000093088606 1410221533 /nfs/dbraw/zinc/22/15/33/1410221533.db2.gz ARGISGPXYUXLAL-UHFFFAOYSA-N 2 1 384.524 3.022 20 0 GGADMP CCCOc1ccc(C[N@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)cc1OCC ZINC000093133047 1410223579 /nfs/dbraw/zinc/22/35/79/1410223579.db2.gz XEHYRZRDYYXSFH-HXUWFJFHSA-N 2 1 375.557 3.086 20 0 GGADMP CCCCOc1ccc(C[N@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)cc1OCC ZINC000093133234 1410223629 /nfs/dbraw/zinc/22/36/29/1410223629.db2.gz MGLRIZCDPVENAS-NRFANRHFSA-N 2 1 389.584 3.476 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](CC3=Cc4cc(Cl)cc(Cl)c4OC3)C2)CC1 ZINC000093132767 1410223656 /nfs/dbraw/zinc/22/36/56/1410223656.db2.gz NNXZQNGIDPXDRG-SFHVURJKSA-N 2 1 396.362 3.481 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccccc3OCc3ccccc3)C2)CC1 ZINC000093133037 1410223697 /nfs/dbraw/zinc/22/36/97/1410223697.db2.gz MFMDNRJPDUJZBW-QHCPKHFHSA-N 2 1 379.548 3.477 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cn(-c4ccccc4)nc3C(C)(C)C)C2)CC1 ZINC000093133007 1410223926 /nfs/dbraw/zinc/22/39/26/1410223926.db2.gz UXKPEYWICOSFGN-QFIPXVFZSA-N 2 1 395.595 3.382 20 0 GGADMP CCCCOc1ccc(C[N@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)cc1OCC ZINC000093133235 1410224301 /nfs/dbraw/zinc/22/43/01/1410224301.db2.gz MGLRIZCDPVENAS-OAQYLSRUSA-N 2 1 389.584 3.476 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(-c4c(F)cccc4F)o3)C2)CC1 ZINC000093132894 1410224334 /nfs/dbraw/zinc/22/43/34/1410224334.db2.gz ZWVBVFILSYYRRD-MRXNPFEDSA-N 2 1 375.463 3.437 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cccn3CCC(C)C)CC2)CC1 ZINC000093142088 1410226183 /nfs/dbraw/zinc/22/61/83/1410226183.db2.gz RPIADFHHDAUFIA-UHFFFAOYSA-N 2 1 388.600 3.300 20 0 GGADMP CC(C)[N@H+](CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)Cc1cccnc1 ZINC000093225308 1410227617 /nfs/dbraw/zinc/22/76/17/1410227617.db2.gz MMKRCBMZWVHCKC-UHFFFAOYSA-N 2 1 380.536 3.204 20 0 GGADMP CC(C)[N@@H+](CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)Cc1cccnc1 ZINC000093225308 1410227621 /nfs/dbraw/zinc/22/76/21/1410227621.db2.gz MMKRCBMZWVHCKC-UHFFFAOYSA-N 2 1 380.536 3.204 20 0 GGADMP O=C(COc1ccccc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)N1CCCC1 ZINC000093564066 1410254069 /nfs/dbraw/zinc/25/40/69/1410254069.db2.gz ZKUHVSOHPSAHJM-NRFANRHFSA-N 2 1 385.552 3.138 20 0 GGADMP O=C(COc1ccccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)N1CCCC1 ZINC000093564066 1410254077 /nfs/dbraw/zinc/25/40/77/1410254077.db2.gz ZKUHVSOHPSAHJM-NRFANRHFSA-N 2 1 385.552 3.138 20 0 GGADMP Cn1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000093596907 1410255129 /nfs/dbraw/zinc/25/51/29/1410255129.db2.gz YPAUKYQUABBTKX-SFHVURJKSA-N 2 1 396.535 3.166 20 0 GGADMP Cn1cc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000093596907 1410255136 /nfs/dbraw/zinc/25/51/36/1410255136.db2.gz YPAUKYQUABBTKX-SFHVURJKSA-N 2 1 396.535 3.166 20 0 GGADMP Cn1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000093596905 1410255682 /nfs/dbraw/zinc/25/56/82/1410255682.db2.gz YPAUKYQUABBTKX-GOSISDBHSA-N 2 1 396.535 3.166 20 0 GGADMP Cn1cc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000093596905 1410255688 /nfs/dbraw/zinc/25/56/88/1410255688.db2.gz YPAUKYQUABBTKX-GOSISDBHSA-N 2 1 396.535 3.166 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000093683858 1410259389 /nfs/dbraw/zinc/25/93/89/1410259389.db2.gz MCQPNKOTXFWXLT-QGZVFWFLSA-N 2 1 382.508 3.156 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000093683858 1410259393 /nfs/dbraw/zinc/25/93/93/1410259393.db2.gz MCQPNKOTXFWXLT-QGZVFWFLSA-N 2 1 382.508 3.156 20 0 GGADMP C[N@H+](Cc1cnc(N2CC[NH+](C)CC2)nc1)C1c2ccccc2-c2ccccc21 ZINC000093686882 1410260019 /nfs/dbraw/zinc/26/00/19/1410260019.db2.gz YDQPZKFYOZFPDI-UHFFFAOYSA-N 2 1 385.515 3.430 20 0 GGADMP C[N@@H+](Cc1cnc(N2CC[NH+](C)CC2)nc1)C1c2ccccc2-c2ccccc21 ZINC000093686882 1410260024 /nfs/dbraw/zinc/26/00/24/1410260024.db2.gz YDQPZKFYOZFPDI-UHFFFAOYSA-N 2 1 385.515 3.430 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093692727 1410260269 /nfs/dbraw/zinc/26/02/69/1410260269.db2.gz XEDVKDDTEKVOGF-GOSISDBHSA-N 2 1 398.551 3.412 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000093692727 1410260274 /nfs/dbraw/zinc/26/02/74/1410260274.db2.gz XEDVKDDTEKVOGF-GOSISDBHSA-N 2 1 398.551 3.412 20 0 GGADMP COc1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(OC(F)F)c1 ZINC000093734958 1410261825 /nfs/dbraw/zinc/26/18/25/1410261825.db2.gz GKSVYTPMDRAWCL-UHFFFAOYSA-N 2 1 384.467 3.373 20 0 GGADMP COc1cc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc(Cl)c1OC ZINC000093735014 1410261881 /nfs/dbraw/zinc/26/18/81/1410261881.db2.gz ODTKLFYVZBLHOD-UHFFFAOYSA-N 2 1 382.932 3.434 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCc3c(cccc3N3CCOC3=O)C2)cc1 ZINC000093740530 1410262941 /nfs/dbraw/zinc/26/29/41/1410262941.db2.gz NMTGSZVUMDKUNQ-UHFFFAOYSA-N 2 1 395.503 3.142 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2ccc(-n3cncn3)c(C)c2)CC1 ZINC000093769393 1410265670 /nfs/dbraw/zinc/26/56/70/1410265670.db2.gz FXHKMUKTESXNNF-UHFFFAOYSA-N 2 1 385.556 3.146 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3cn(C)nc3-c3cccnc3)CC2)C[C@H](C)O1 ZINC000093844268 1410275135 /nfs/dbraw/zinc/27/51/35/1410275135.db2.gz OLQLCEKPLRIFNF-KDURUIRLSA-N 2 1 397.567 3.193 20 0 GGADMP CCc1nn(C)c(CC)c1C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000093844493 1410275206 /nfs/dbraw/zinc/27/52/06/1410275206.db2.gz KCRNICMDOWDHLT-HDICACEKSA-N 2 1 376.589 3.256 20 0 GGADMP CN(c1ccccc1C[N@H+]1CC[C@H](Cc2cnn(C)c2)C1)C1CC[NH+](C)CC1 ZINC000093870323 1410278556 /nfs/dbraw/zinc/27/85/56/1410278556.db2.gz KIPSTPGAKLBXGV-LJQANCHMSA-N 2 1 381.568 3.015 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)NCC[NH+]2CCc3sccc3C2)CC1 ZINC000097216038 1410359282 /nfs/dbraw/zinc/35/92/82/1410359282.db2.gz GXEMRRRTCCLYRK-UHFFFAOYSA-N 2 1 392.613 3.260 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)NCC[NH+]2CCc3sccc3C2)CC1 ZINC000097216038 1410359287 /nfs/dbraw/zinc/35/92/87/1410359287.db2.gz GXEMRRRTCCLYRK-UHFFFAOYSA-N 2 1 392.613 3.260 20 0 GGADMP CCCC[NH+](C)CC1CCN(C(=O)NCC[N@@H+]2CCc3sccc3C2)CC1 ZINC000097216038 1410359293 /nfs/dbraw/zinc/35/92/93/1410359293.db2.gz GXEMRRRTCCLYRK-UHFFFAOYSA-N 2 1 392.613 3.260 20 0 GGADMP CCCC[NH+](C)CC1CCN(C(=O)NCC[N@H+]2CCc3sccc3C2)CC1 ZINC000097216038 1410359296 /nfs/dbraw/zinc/35/92/96/1410359296.db2.gz GXEMRRRTCCLYRK-UHFFFAOYSA-N 2 1 392.613 3.260 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NCC1([NH+]2CCSCC2)CCCC1 ZINC000097437696 1410369801 /nfs/dbraw/zinc/36/98/01/1410369801.db2.gz SBTJACVOGUXDLE-LJQANCHMSA-N 2 1 396.645 3.302 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1ccc(Oc2cccnc2)cc1 ZINC000101518395 1410444171 /nfs/dbraw/zinc/44/41/71/1410444171.db2.gz LVCIVOXQWPIUQS-HXUWFJFHSA-N 2 1 396.535 3.362 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1csc(-c2ccc(C)o2)n1 ZINC000101518474 1410444248 /nfs/dbraw/zinc/44/42/48/1410444248.db2.gz YGFPORQUCQBHIZ-INIZCTEOSA-N 2 1 390.553 3.200 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1csc(-c2ccc(C)o2)n1 ZINC000101518473 1410444426 /nfs/dbraw/zinc/44/44/26/1410444426.db2.gz YGFPORQUCQBHIZ-MRXNPFEDSA-N 2 1 390.553 3.200 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000176827672 1428488970 /nfs/dbraw/zinc/48/89/70/1428488970.db2.gz WYYODGNVGHFBEV-SFHVURJKSA-N 2 1 383.540 3.497 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1)C[NH+]1CCCC1 ZINC000101796635 1410503584 /nfs/dbraw/zinc/50/35/84/1410503584.db2.gz ZEQAUDXXCFVLIR-NRFANRHFSA-N 2 1 386.584 3.068 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1F ZINC000101993470 1410538925 /nfs/dbraw/zinc/53/89/25/1410538925.db2.gz QXTVIKXYKOYGOI-HOTGVXAUSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1F ZINC000101993470 1410538935 /nfs/dbraw/zinc/53/89/35/1410538935.db2.gz QXTVIKXYKOYGOI-HOTGVXAUSA-N 2 1 387.503 3.239 20 0 GGADMP C[NH+]1CCC(CCNC(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000102640331 1410681868 /nfs/dbraw/zinc/68/18/68/1410681868.db2.gz ISBWVBRXMHDICL-FQEVSTJZSA-N 2 1 397.485 3.289 20 0 GGADMP CCc1nc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cs1 ZINC000102781474 1410750611 /nfs/dbraw/zinc/75/06/11/1410750611.db2.gz HYWSNYVBPUUODD-UHFFFAOYSA-N 2 1 389.565 3.485 20 0 GGADMP CCc1nc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)cs1 ZINC000102781474 1410750622 /nfs/dbraw/zinc/75/06/22/1410750622.db2.gz HYWSNYVBPUUODD-UHFFFAOYSA-N 2 1 389.565 3.485 20 0 GGADMP COc1cccc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)c1 ZINC000102781537 1410751803 /nfs/dbraw/zinc/75/18/03/1410751803.db2.gz RUDZOZKLMDPYIC-UHFFFAOYSA-N 2 1 384.520 3.475 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H](O)COc2ccc(F)cc2)CC1 ZINC000103143040 1410831481 /nfs/dbraw/zinc/83/14/81/1410831481.db2.gz ZSECLTDIFHIXLZ-JOCHJYFZSA-N 2 1 386.511 3.409 20 0 GGADMP Cc1cccc2nc(C[NH+]3CCC(C[N@H+](C)Cc4ccccc4)CC3)cc(=O)n12 ZINC000103143168 1410831625 /nfs/dbraw/zinc/83/16/25/1410831625.db2.gz LPJHAFUQXWFWHB-UHFFFAOYSA-N 2 1 390.531 3.347 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)Nc1ccc2c(c1)OCO2 ZINC000103229200 1410838535 /nfs/dbraw/zinc/83/85/35/1410838535.db2.gz YNHVMPHWJGJXNM-GOSISDBHSA-N 2 1 387.524 3.332 20 0 GGADMP CCC[N@@H+]1CC[C@@H](CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000103291036 1410843000 /nfs/dbraw/zinc/84/30/00/1410843000.db2.gz FXIYTMDDYSKUOL-KRWDZBQOSA-N 2 1 376.570 3.089 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000103291036 1410843002 /nfs/dbraw/zinc/84/30/02/1410843002.db2.gz FXIYTMDDYSKUOL-KRWDZBQOSA-N 2 1 376.570 3.089 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccco1 ZINC000103297793 1410843868 /nfs/dbraw/zinc/84/38/68/1410843868.db2.gz WUCRANQOLJKBKT-RTBURBONSA-N 2 1 376.545 3.180 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)NCCC2CC[NH+](C)CC2)C1 ZINC000103303367 1410844634 /nfs/dbraw/zinc/84/46/34/1410844634.db2.gz BCMPZAUDNFKIBC-LJQANCHMSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(NCCC[NH2+]C1CCCCC1)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000103319205 1410847066 /nfs/dbraw/zinc/84/70/66/1410847066.db2.gz SOWQNRXOKUVBBB-OAQYLSRUSA-N 2 1 386.584 3.163 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N(C)CC2CC[NH+](C)CC2)C1 ZINC000103510200 1410865246 /nfs/dbraw/zinc/86/52/46/1410865246.db2.gz VGEULNWNBJVVAJ-LJQANCHMSA-N 2 1 386.584 3.402 20 0 GGADMP COc1ccc(NC(=[NH2+])NCc2ccccc2C[NH+]2CCOCC2)cc1Cl ZINC000104156852 1410886052 /nfs/dbraw/zinc/88/60/52/1410886052.db2.gz VZSDYQKSUQROSU-UHFFFAOYSA-N 2 1 388.899 3.108 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000104213902 1410887362 /nfs/dbraw/zinc/88/73/62/1410887362.db2.gz FSHFLJYJPIYKSK-LJQANCHMSA-N 2 1 385.474 3.145 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)Nc1cccc(NC(=O)C[NH+]2CCCCCC2)c1 ZINC000104363069 1410893247 /nfs/dbraw/zinc/89/32/47/1410893247.db2.gz QDUHTIXUTKFESG-HXUWFJFHSA-N 2 1 386.540 3.314 20 0 GGADMP CC[N@H+]1CCCC[C@H]1C(=O)Nc1cccc(NC(=O)C[NH+]2CCCCCC2)c1 ZINC000104363072 1410893275 /nfs/dbraw/zinc/89/32/75/1410893275.db2.gz QDUHTIXUTKFESG-FQEVSTJZSA-N 2 1 386.540 3.314 20 0 GGADMP COCC[NH+]1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000104978689 1411007095 /nfs/dbraw/zinc/00/70/95/1411007095.db2.gz CNHNEDWVOCWZPH-UHFFFAOYSA-N 2 1 388.556 3.247 20 0 GGADMP COCC[NH+]1CCN(C(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)CC1 ZINC000104978689 1411007104 /nfs/dbraw/zinc/00/71/04/1411007104.db2.gz CNHNEDWVOCWZPH-UHFFFAOYSA-N 2 1 388.556 3.247 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[N@@H+](C)C1CC1 ZINC000105093669 1411027917 /nfs/dbraw/zinc/02/79/17/1411027917.db2.gz IMLOVXFULHAINH-HNNXBMFYSA-N 2 1 378.948 3.086 20 0 GGADMP CC[N@H+]1CCC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)C1 ZINC000105113291 1411029614 /nfs/dbraw/zinc/02/96/14/1411029614.db2.gz RINKLGKQVMTAIE-UGKGYDQZSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+]1CCC[C@@H](CNC(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000105113291 1411029621 /nfs/dbraw/zinc/02/96/21/1411029621.db2.gz RINKLGKQVMTAIE-UGKGYDQZSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+]1CCC[C@@H](CNC(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000105113291 1411029629 /nfs/dbraw/zinc/02/96/29/1411029629.db2.gz RINKLGKQVMTAIE-UGKGYDQZSA-N 2 1 386.584 3.450 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)CC1 ZINC000105112549 1411030350 /nfs/dbraw/zinc/03/03/50/1411030350.db2.gz BQSNXTVQDJFQAP-HXUWFJFHSA-N 2 1 386.584 3.379 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C(C)C)[NH+]2CCCC2)cc1F ZINC000105190193 1411039964 /nfs/dbraw/zinc/03/99/64/1411039964.db2.gz FOBMYMLYEOQVPL-FQEVSTJZSA-N 2 1 387.503 3.239 20 0 GGADMP CC(C)[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCCC1 ZINC000105209360 1411042061 /nfs/dbraw/zinc/04/20/61/1411042061.db2.gz VNJQLGRGZMYRIK-AZUAARDMSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000105208202 1411042464 /nfs/dbraw/zinc/04/24/64/1411042464.db2.gz WEXVPRSSQZWECB-LJQANCHMSA-N 2 1 392.613 3.380 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000105244880 1411046943 /nfs/dbraw/zinc/04/69/43/1411046943.db2.gz HBFIYVRBGDEPPN-DHIUTWEWSA-N 2 1 398.595 3.211 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)[NH+](C)C1CC1 ZINC000105268693 1411048103 /nfs/dbraw/zinc/04/81/03/1411048103.db2.gz SEEJLXDGYLPWAY-INIZCTEOSA-N 2 1 378.948 3.040 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)[NH+](C)C1CC1 ZINC000105268693 1411048116 /nfs/dbraw/zinc/04/81/16/1411048116.db2.gz SEEJLXDGYLPWAY-INIZCTEOSA-N 2 1 378.948 3.040 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1)[N@H+](C)C1CC1 ZINC000105268693 1411048124 /nfs/dbraw/zinc/04/81/24/1411048124.db2.gz SEEJLXDGYLPWAY-INIZCTEOSA-N 2 1 378.948 3.040 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1)[N@@H+](C)C1CC1 ZINC000105268693 1411048132 /nfs/dbraw/zinc/04/81/32/1411048132.db2.gz SEEJLXDGYLPWAY-INIZCTEOSA-N 2 1 378.948 3.040 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)C1 ZINC000105273533 1411048582 /nfs/dbraw/zinc/04/85/82/1411048582.db2.gz QHGQBDUBOPDONS-IBGZPJMESA-N 2 1 378.536 3.019 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(Cc2ccco2)C2CC[NH+](C)CC2)C1 ZINC000105275687 1411049159 /nfs/dbraw/zinc/04/91/59/1411049159.db2.gz AYHNTBISZODVRZ-SFHVURJKSA-N 2 1 376.545 3.006 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCC(C)(C)[N@@H+]3CCC[C@@H](C)C3)CC2)cs1 ZINC000105339317 1411055512 /nfs/dbraw/zinc/05/55/12/1411055512.db2.gz IAUASPGKSUVLTL-MRXNPFEDSA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCC(C)(C)[N@H+]3CCC[C@@H](C)C3)CC2)cs1 ZINC000105339317 1411055522 /nfs/dbraw/zinc/05/55/22/1411055522.db2.gz IAUASPGKSUVLTL-MRXNPFEDSA-N 2 1 392.613 3.290 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2ccccc2OCc2cccnc2)CC1 ZINC000105451184 1411067192 /nfs/dbraw/zinc/06/71/92/1411067192.db2.gz VQKSLYSRZOMGNT-UHFFFAOYSA-N 2 1 382.552 3.024 20 0 GGADMP Cc1nn(Cc2ccccc2)c(Cl)c1C[NH2+]CCCN1CCC[N@H+](C)CC1 ZINC000105476736 1411070658 /nfs/dbraw/zinc/07/06/58/1411070658.db2.gz PLICETLFQZWWTK-UHFFFAOYSA-N 2 1 389.975 3.010 20 0 GGADMP COc1cc(C[NH2+]CCCN2CCC[N@@H+](C)CC2)ccc1OCc1ccccc1 ZINC000105476943 1411070729 /nfs/dbraw/zinc/07/07/29/1411070729.db2.gz QNJZRDRKVZZVMV-UHFFFAOYSA-N 2 1 397.563 3.391 20 0 GGADMP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3csc(-c4ccccn4)n3)cc2)CC1 ZINC000105495539 1411072198 /nfs/dbraw/zinc/07/21/98/1411072198.db2.gz KGKBILHWINKGHN-UHFFFAOYSA-N 2 1 394.544 3.452 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCC[N@H+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1 ZINC000106213941 1411181408 /nfs/dbraw/zinc/18/14/08/1411181408.db2.gz ISXGMFDMMPMOPE-KRWDZBQOSA-N 2 1 391.519 3.149 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCC[N@@H+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1 ZINC000106213941 1411181422 /nfs/dbraw/zinc/18/14/22/1411181422.db2.gz ISXGMFDMMPMOPE-KRWDZBQOSA-N 2 1 391.519 3.149 20 0 GGADMP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+][C@H](C)CN1CC[NH+](C)CC1 ZINC000106485572 1411224214 /nfs/dbraw/zinc/22/42/14/1411224214.db2.gz YGQKLRZHHAUBIH-QGZVFWFLSA-N 2 1 389.975 3.375 20 0 GGADMP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106522617 1411231045 /nfs/dbraw/zinc/23/10/45/1411231045.db2.gz FMYQFWVALUGZSI-OAQYLSRUSA-N 2 1 384.568 3.489 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N[C@@H]1CC[NH+](C2CCCC2)C1 ZINC000106550362 1411243773 /nfs/dbraw/zinc/24/37/73/1411243773.db2.gz KDLARSPVZPCXHA-ZWKOTPCHSA-N 2 1 390.597 3.276 20 0 GGADMP O=C(NC[C@@H]1CCC[NH+](Cc2cccs2)C1)N[C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC000106550362 1411243785 /nfs/dbraw/zinc/24/37/85/1411243785.db2.gz KDLARSPVZPCXHA-ZWKOTPCHSA-N 2 1 390.597 3.276 20 0 GGADMP O=C(NC[C@@H]1CCC[NH+](Cc2cccs2)C1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106550362 1411243811 /nfs/dbraw/zinc/24/38/11/1411243811.db2.gz KDLARSPVZPCXHA-ZWKOTPCHSA-N 2 1 390.597 3.276 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CC[NH+](Cc2coc(-c3ccccc3)n2)CC1)[NH+](C)C ZINC000106914636 1411319566 /nfs/dbraw/zinc/31/95/66/1411319566.db2.gz WRRXPXRRGARNOS-FQEVSTJZSA-N 2 1 384.524 3.008 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000107698191 1411399693 /nfs/dbraw/zinc/39/96/93/1411399693.db2.gz SSCDYROUZAQROP-ZCNNSNEGSA-N 2 1 390.572 3.474 20 0 GGADMP CC[C@H](CNC(=O)NCCC[NH2+]C1CCCCC1)[N@H+]1CCc2ccccc2C1 ZINC000107834164 1411417305 /nfs/dbraw/zinc/41/73/05/1411417305.db2.gz KZQCUAKIOOWRTO-JOCHJYFZSA-N 2 1 386.584 3.435 20 0 GGADMP CCOc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000108420999 1411495963 /nfs/dbraw/zinc/49/59/63/1411495963.db2.gz PBVNHUBPCJIIFU-NRFANRHFSA-N 2 1 381.520 3.072 20 0 GGADMP CC(C)Oc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000108420587 1411496482 /nfs/dbraw/zinc/49/64/82/1411496482.db2.gz ZPGLAGMPLJTUIB-QFIPXVFZSA-N 2 1 395.547 3.461 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000108576495 1411543576 /nfs/dbraw/zinc/54/35/76/1411543576.db2.gz IYRIAAJPWMNECR-GOSISDBHSA-N 2 1 392.975 3.193 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1 ZINC000108588758 1411545573 /nfs/dbraw/zinc/54/55/73/1411545573.db2.gz LOUBICYSCTYMIE-LJQANCHMSA-N 2 1 380.536 3.009 20 0 GGADMP O=C([C@H]1CCC[N@H+]1Cc1ccccc1)N1CCC[NH+](Cc2ccccc2)CC1 ZINC000108710234 1411580428 /nfs/dbraw/zinc/58/04/28/1411580428.db2.gz WWQVSSHAQVAUHJ-HSZRJFAPSA-N 2 1 377.532 3.386 20 0 GGADMP O=C([C@H]1CCC[NH+]1Cc1ccccc1)N1CCC[N@H+](Cc2ccccc2)CC1 ZINC000108710234 1411580441 /nfs/dbraw/zinc/58/04/41/1411580441.db2.gz WWQVSSHAQVAUHJ-HSZRJFAPSA-N 2 1 377.532 3.386 20 0 GGADMP O=C([C@H]1CCC[NH+]1Cc1ccccc1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000108710234 1411580457 /nfs/dbraw/zinc/58/04/57/1411580457.db2.gz WWQVSSHAQVAUHJ-HSZRJFAPSA-N 2 1 377.532 3.386 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000108815639 1411620505 /nfs/dbraw/zinc/62/05/05/1411620505.db2.gz VDWVQZYKVMACDS-PTUXOGIPSA-N 2 1 392.547 3.396 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000108815639 1411620512 /nfs/dbraw/zinc/62/05/12/1411620512.db2.gz VDWVQZYKVMACDS-PTUXOGIPSA-N 2 1 392.547 3.396 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(SC)cc3)CC2)CC1 ZINC000108873359 1411628575 /nfs/dbraw/zinc/62/85/75/1411628575.db2.gz FCJBAMLAISVEAQ-UHFFFAOYSA-N 2 1 375.582 3.175 20 0 GGADMP C[NH+](C)CCCOC1CCN(C(=O)[C@H]2CCCC[N@H+]2Cc2ccccc2)CC1 ZINC000177084294 1428582638 /nfs/dbraw/zinc/58/26/38/1428582638.db2.gz FSTVFAUSKFHKJT-JOCHJYFZSA-N 2 1 387.568 3.000 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000109269021 1411729342 /nfs/dbraw/zinc/72/93/42/1411729342.db2.gz HAIBMALOVZZFSL-HSZRJFAPSA-N 2 1 393.531 3.164 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000109269021 1411729349 /nfs/dbraw/zinc/72/93/49/1411729349.db2.gz HAIBMALOVZZFSL-HSZRJFAPSA-N 2 1 393.531 3.164 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1C(=O)NCc1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000109443229 1411764796 /nfs/dbraw/zinc/76/47/96/1411764796.db2.gz JOPGUUUQTBVTSE-JQVVWYNYSA-N 2 1 387.568 3.177 20 0 GGADMP CCC[NH+]1CCCC[C@H]1C(=O)NCc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000109443229 1411764801 /nfs/dbraw/zinc/76/48/01/1411764801.db2.gz JOPGUUUQTBVTSE-JQVVWYNYSA-N 2 1 387.568 3.177 20 0 GGADMP CCC[NH+]1CCCC[C@H]1C(=O)NCc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000109443229 1411764807 /nfs/dbraw/zinc/76/48/07/1411764807.db2.gz JOPGUUUQTBVTSE-JQVVWYNYSA-N 2 1 387.568 3.177 20 0 GGADMP C[N@@H+]1CCN(C(=O)CCC[NH+]2CCN(c3ccccc3)CC2)c2ccccc2C1 ZINC000110296177 1411842716 /nfs/dbraw/zinc/84/27/16/1411842716.db2.gz DBIDRNJAVADISC-UHFFFAOYSA-N 2 1 392.547 3.067 20 0 GGADMP C[N@H+]1CCN(C(=O)CCC[NH+]2CCN(c3ccccc3)CC2)c2ccccc2C1 ZINC000110296177 1411842717 /nfs/dbraw/zinc/84/27/17/1411842717.db2.gz DBIDRNJAVADISC-UHFFFAOYSA-N 2 1 392.547 3.067 20 0 GGADMP Cc1ccc(-c2noc(C[NH+]3CCC(C[N@@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)n2)cc1 ZINC000110429278 1411850309 /nfs/dbraw/zinc/85/03/09/1411850309.db2.gz FVYQIFMUDZAMBR-HDICACEKSA-N 2 1 384.524 3.366 20 0 GGADMP Cc1ccc(-c2noc(C[NH+]3CCC(C[N@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)n2)cc1 ZINC000110429278 1411850310 /nfs/dbraw/zinc/85/03/10/1411850310.db2.gz FVYQIFMUDZAMBR-HDICACEKSA-N 2 1 384.524 3.366 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c(C)c1 ZINC000110427926 1411850333 /nfs/dbraw/zinc/85/03/33/1411850333.db2.gz OBVDZTFTIBZNRM-AQNXPRMDSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1ccc(-c2noc(C[NH+]3CCC(C[NH+]4C[C@@H](C)O[C@H](C)C4)CC3)n2)cc1 ZINC000110429281 1411850339 /nfs/dbraw/zinc/85/03/39/1411850339.db2.gz FVYQIFMUDZAMBR-QZTJIDSGSA-N 2 1 384.524 3.366 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)[C@@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000110639373 1411861958 /nfs/dbraw/zinc/86/19/58/1411861958.db2.gz UWIZANULHBRBFC-RBUKOAKNSA-N 2 1 382.552 3.287 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000110745712 1411867738 /nfs/dbraw/zinc/86/77/38/1411867738.db2.gz HJNBLCQDLWLDOO-QHCPKHFHSA-N 2 1 394.563 3.008 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NCC2([NH+]3CCCCC3)CCOCC2)cc1)C1CC1 ZINC000111101266 1411887207 /nfs/dbraw/zinc/88/72/07/1411887207.db2.gz BBOAKDSGLKJJMR-UHFFFAOYSA-N 2 1 399.579 3.436 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C(=O)NC3CC3)c3ccccc3)CC2)oc1C ZINC000111377245 1411934984 /nfs/dbraw/zinc/93/49/84/1411934984.db2.gz OLABCPFASBDCRN-QFIPXVFZSA-N 2 1 396.535 3.113 20 0 GGADMP Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]CCCC[N@H+]1CCC[C@H]1CO ZINC000111386696 1411938570 /nfs/dbraw/zinc/93/85/70/1411938570.db2.gz KONIHAWTEJJORD-SFHVURJKSA-N 2 1 392.494 3.094 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3c(C)nn(C)c3Cl)CC2)cs1 ZINC000111397625 1411940345 /nfs/dbraw/zinc/94/03/45/1411940345.db2.gz YGOHIPZDVCRAPR-UHFFFAOYSA-N 2 1 381.977 3.403 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc(-n4ccnc4)cc3)CC2)oc1C ZINC000111412469 1411945566 /nfs/dbraw/zinc/94/55/66/1411945566.db2.gz SXISERGXANHEHB-UHFFFAOYSA-N 2 1 379.508 3.479 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3cn(C)nc3-c3ccncc3)CC2)oc1C ZINC000111412550 1411946276 /nfs/dbraw/zinc/94/62/76/1411946276.db2.gz WLOMRPKRFUIZEQ-UHFFFAOYSA-N 2 1 394.523 3.089 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)[C@@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC000111562562 1411991753 /nfs/dbraw/zinc/99/17/53/1411991753.db2.gz VMKABGIQLMKHGL-QHCPKHFHSA-N 2 1 392.547 3.348 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)[C@@H]1CCCC[N@H+]1Cc1cccnc1 ZINC000111562562 1411991757 /nfs/dbraw/zinc/99/17/57/1411991757.db2.gz VMKABGIQLMKHGL-QHCPKHFHSA-N 2 1 392.547 3.348 20 0 GGADMP C[C@H](C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000111607634 1412001410 /nfs/dbraw/zinc/00/14/10/1412001410.db2.gz LEGVUUFWYRBUDI-IRLDBZIGSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@H](C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000111607634 1412001416 /nfs/dbraw/zinc/00/14/16/1412001416.db2.gz LEGVUUFWYRBUDI-IRLDBZIGSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@H](C(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000111607634 1412001423 /nfs/dbraw/zinc/00/14/23/1412001423.db2.gz LEGVUUFWYRBUDI-IRLDBZIGSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@H](C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000111607634 1412001429 /nfs/dbraw/zinc/00/14/29/1412001429.db2.gz LEGVUUFWYRBUDI-IRLDBZIGSA-N 2 1 391.559 3.114 20 0 GGADMP CC(C)(C)OC(=O)N1CCC([NH2+]Cc2ccccc2C[NH+]2CCOCC2)CC1 ZINC000177189122 1428622466 /nfs/dbraw/zinc/62/24/66/1428622466.db2.gz SLFTUYMOIAAOJV-UHFFFAOYSA-N 2 1 389.540 3.008 20 0 GGADMP C[C@@H](CCc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000112545875 1412166827 /nfs/dbraw/zinc/16/68/27/1412166827.db2.gz MOFNDJJVNAJHTB-CVDCTZTESA-N 2 1 379.548 3.495 20 0 GGADMP C[NH+]1CCC([NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000177211056 1428634875 /nfs/dbraw/zinc/63/48/75/1428634875.db2.gz GUCAXNONRMILFI-UHFFFAOYSA-N 3 1 398.517 3.291 20 0 GGADMP CC[C@@H]1CCCC[N@@H+]1CCNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000113198534 1412273618 /nfs/dbraw/zinc/27/36/18/1412273618.db2.gz XYHZXXVKSUGMEC-LJQANCHMSA-N 2 1 378.586 3.044 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000113198534 1412273627 /nfs/dbraw/zinc/27/36/27/1412273627.db2.gz XYHZXXVKSUGMEC-LJQANCHMSA-N 2 1 378.586 3.044 20 0 GGADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177220869 1428638174 /nfs/dbraw/zinc/63/81/74/1428638174.db2.gz BVKDLZYQGIUFLO-OTWHNJEPSA-N 2 1 395.613 3.346 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)[C@@H](c2ccccc2)[NH+](C)C)CCOCC1)c1ccccc1 ZINC000113236227 1412280551 /nfs/dbraw/zinc/28/05/51/1412280551.db2.gz CPBXMWXIWMQHTN-SIKLNZKXSA-N 2 1 395.547 3.306 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)C[N@H+](C)Cc2ccccc2)CCOCC1)c1ccccc1 ZINC000113236114 1412280643 /nfs/dbraw/zinc/28/06/43/1412280643.db2.gz NKXFKHHMBASXOP-FQEVSTJZSA-N 2 1 395.547 3.135 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)C[N@@H+](C)Cc2ccccc2)CCOCC1)c1ccccc1 ZINC000113236114 1412280651 /nfs/dbraw/zinc/28/06/51/1412280651.db2.gz NKXFKHHMBASXOP-FQEVSTJZSA-N 2 1 395.547 3.135 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177220469 1428638377 /nfs/dbraw/zinc/63/83/77/1428638377.db2.gz SMJGFSLGEUNPIG-MSOLQXFVSA-N 2 1 381.586 3.242 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2csc(COc3ccccc3)n2)CC1 ZINC000113336097 1412294467 /nfs/dbraw/zinc/29/44/67/1412294467.db2.gz VHTWCVXHSGSHQO-UHFFFAOYSA-N 2 1 388.581 3.085 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)[C@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)CCOCC1)c1ccccc1 ZINC000113445749 1412306891 /nfs/dbraw/zinc/30/68/91/1412306891.db2.gz PVMKMVGPPNATOI-YRPNKDGESA-N 2 1 387.568 3.264 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000113616498 1412321937 /nfs/dbraw/zinc/32/19/37/1412321937.db2.gz AIRRYDQIEJJXQR-OAQYLSRUSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@H](O)COCc2ccccc2F)C1 ZINC000113997819 1412365583 /nfs/dbraw/zinc/36/55/83/1412365583.db2.gz PELYXLJEZMRZPP-SBHAEUEKSA-N 2 1 378.532 3.290 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@H](O)COCc2ccccc2F)C1 ZINC000113997819 1412365589 /nfs/dbraw/zinc/36/55/89/1412365589.db2.gz PELYXLJEZMRZPP-SBHAEUEKSA-N 2 1 378.532 3.290 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@H](O)COCc2ccccc2F)C1 ZINC000113997819 1412365594 /nfs/dbraw/zinc/36/55/94/1412365594.db2.gz PELYXLJEZMRZPP-SBHAEUEKSA-N 2 1 378.532 3.290 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@H](O)COCc2ccccc2F)C1 ZINC000113997819 1412365598 /nfs/dbraw/zinc/36/55/98/1412365598.db2.gz PELYXLJEZMRZPP-SBHAEUEKSA-N 2 1 378.532 3.290 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CC[NH+](C2CCCCC2)CC1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000177242629 1428647515 /nfs/dbraw/zinc/64/75/15/1428647515.db2.gz CNPOMEDGXNQGQF-UEXGIBASSA-N 2 1 379.589 3.034 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CC[NH+](C2CCCCC2)CC1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000177242629 1428647528 /nfs/dbraw/zinc/64/75/28/1428647528.db2.gz CNPOMEDGXNQGQF-UEXGIBASSA-N 2 1 379.589 3.034 20 0 GGADMP CC[NH+]1CCC(NC(=O)N[C@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000114583495 1412467630 /nfs/dbraw/zinc/46/76/30/1412467630.db2.gz CMBXNMOSFSMAHX-SFHVURJKSA-N 2 1 398.473 3.063 20 0 GGADMP CN(CC[NH+]1CCCC1)C(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000114604245 1412473046 /nfs/dbraw/zinc/47/30/46/1412473046.db2.gz OVGXEYNVCIXSAP-SFHVURJKSA-N 2 1 398.473 3.017 20 0 GGADMP C[NH+](C)[C@H]1CCCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)C1 ZINC000114604130 1412473522 /nfs/dbraw/zinc/47/35/22/1412473522.db2.gz WPLNQHBZOHTOFG-ROUUACIJSA-N 2 1 398.473 3.015 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCN(CC(F)(F)F)C1=O ZINC000114748017 1412517836 /nfs/dbraw/zinc/51/78/36/1412517836.db2.gz QKEZPMPJQIIJOT-CRAIPNDOSA-N 2 1 383.458 3.314 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCN(CC(F)(F)F)C2=O)C1 ZINC000114748004 1412517889 /nfs/dbraw/zinc/51/78/89/1412517889.db2.gz OAWZEENNSAPBMA-CRAIPNDOSA-N 2 1 383.458 3.171 20 0 GGADMP O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177267058 1428662458 /nfs/dbraw/zinc/66/24/58/1428662458.db2.gz FHWYYCACCLYNQV-QHCPKHFHSA-N 2 1 399.579 3.191 20 0 GGADMP O=C(C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177267058 1428662470 /nfs/dbraw/zinc/66/24/70/1428662470.db2.gz FHWYYCACCLYNQV-QHCPKHFHSA-N 2 1 399.579 3.191 20 0 GGADMP O=C(C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177267043 1428662559 /nfs/dbraw/zinc/66/25/59/1428662559.db2.gz FHWYYCACCLYNQV-HSZRJFAPSA-N 2 1 399.579 3.191 20 0 GGADMP O=C(C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177267043 1428662564 /nfs/dbraw/zinc/66/25/64/1428662564.db2.gz FHWYYCACCLYNQV-HSZRJFAPSA-N 2 1 399.579 3.191 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(Cl)c3c(c2)OCCO3)[C@H](C)C1 ZINC000115628214 1412739079 /nfs/dbraw/zinc/73/90/79/1412739079.db2.gz VDTKGJZWSVSCRN-QAPCUYQASA-N 2 1 382.932 3.338 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(Cl)c3c(c2)OCCO3)[C@H](C)C1 ZINC000115628214 1412739089 /nfs/dbraw/zinc/73/90/89/1412739089.db2.gz VDTKGJZWSVSCRN-QAPCUYQASA-N 2 1 382.932 3.338 20 0 GGADMP CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000115789736 1412789247 /nfs/dbraw/zinc/78/92/47/1412789247.db2.gz MPCSFYSVEUNJAH-GOSISDBHSA-N 2 1 392.975 3.288 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)CC1 ZINC000115794844 1412790626 /nfs/dbraw/zinc/79/06/26/1412790626.db2.gz ATDDZMBDHKZETF-FQEVSTJZSA-N 2 1 386.584 3.402 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2c(c1)C(=O)CCC2 ZINC000177299144 1428677278 /nfs/dbraw/zinc/67/72/78/1428677278.db2.gz CQHUNFAEQWMAFF-IBGZPJMESA-N 2 1 386.540 3.085 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)CC2)cs1 ZINC000116230995 1412845445 /nfs/dbraw/zinc/84/54/45/1412845445.db2.gz BXGXUVPDORTKAT-SFHVURJKSA-N 2 1 380.602 3.146 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccccc2OCC(=O)N(C)C)CC1 ZINC000116368232 1412852926 /nfs/dbraw/zinc/85/29/26/1412852926.db2.gz WGMCEUGDJBLUBP-LJQANCHMSA-N 2 1 395.547 3.469 20 0 GGADMP C[NH+](C)CCN(Cc1ccccc1F)C(=O)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000116395723 1412854572 /nfs/dbraw/zinc/85/45/72/1412854572.db2.gz ZQVVQELBAKALIT-OAQYLSRUSA-N 2 1 398.526 3.023 20 0 GGADMP C[NH+](C)CCN(Cc1ccccc1F)C(=O)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000116395725 1412854768 /nfs/dbraw/zinc/85/47/68/1412854768.db2.gz ZQVVQELBAKALIT-NRFANRHFSA-N 2 1 398.526 3.023 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000116434719 1412859594 /nfs/dbraw/zinc/85/95/94/1412859594.db2.gz UASBDUHLMVWRQS-NRFANRHFSA-N 2 1 383.536 3.390 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000177313060 1428682914 /nfs/dbraw/zinc/68/29/14/1428682914.db2.gz WLPSHMXALNDAMV-APWZRJJASA-N 2 1 380.964 3.220 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000177313060 1428682928 /nfs/dbraw/zinc/68/29/28/1428682928.db2.gz WLPSHMXALNDAMV-APWZRJJASA-N 2 1 380.964 3.220 20 0 GGADMP Cc1csc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)n1 ZINC000117384988 1413032871 /nfs/dbraw/zinc/03/28/71/1413032871.db2.gz YEPXPSNBLXFTFI-UHFFFAOYSA-N 2 1 375.538 3.231 20 0 GGADMP Cc1csc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)n1 ZINC000117384988 1413032880 /nfs/dbraw/zinc/03/28/80/1413032880.db2.gz YEPXPSNBLXFTFI-UHFFFAOYSA-N 2 1 375.538 3.231 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]C2CCN(C(=O)OC(C)(C)C)CC2)[C@H](C)C1 ZINC000177343150 1428700135 /nfs/dbraw/zinc/70/01/35/1428700135.db2.gz NWMSURNWAOBDQT-IEBWSBKVSA-N 2 1 383.577 3.113 20 0 GGADMP C[N@@H+](CCNC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)C1CCCC1 ZINC000118017400 1413096285 /nfs/dbraw/zinc/09/62/85/1413096285.db2.gz LBDVUJUCYLYZIL-UHFFFAOYSA-N 2 1 390.597 3.274 20 0 GGADMP C[N@H+](CCNC(=O)Nc1ccccc1C[NH+]1CCSCC1)C1CCCC1 ZINC000118017389 1413096825 /nfs/dbraw/zinc/09/68/25/1413096825.db2.gz RFGGPMCXDXBQRE-UHFFFAOYSA-N 2 1 376.570 3.231 20 0 GGADMP C[N@@H+](CCNC(=O)Nc1ccccc1C[NH+]1CCSCC1)C1CCCC1 ZINC000118017389 1413096832 /nfs/dbraw/zinc/09/68/32/1413096832.db2.gz RFGGPMCXDXBQRE-UHFFFAOYSA-N 2 1 376.570 3.231 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NCC[N@H+](C)Cc2ccccc2)cc1)[NH+]1CCOCC1 ZINC000118030572 1413099717 /nfs/dbraw/zinc/09/97/17/1413099717.db2.gz BVVLXPAYYMUWQC-IBGZPJMESA-N 2 1 396.535 3.333 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NCC[N@@H+](C)Cc2ccccc2)cc1)[NH+]1CCOCC1 ZINC000118030572 1413099725 /nfs/dbraw/zinc/09/97/25/1413099725.db2.gz BVVLXPAYYMUWQC-IBGZPJMESA-N 2 1 396.535 3.333 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCC[N@H+](C)Cc2ccccc2)cc1)[NH+]1CCOCC1 ZINC000118030575 1413099801 /nfs/dbraw/zinc/09/98/01/1413099801.db2.gz BVVLXPAYYMUWQC-LJQANCHMSA-N 2 1 396.535 3.333 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCC[N@@H+](C)Cc2ccccc2)cc1)[NH+]1CCOCC1 ZINC000118030575 1413099806 /nfs/dbraw/zinc/09/98/06/1413099806.db2.gz BVVLXPAYYMUWQC-LJQANCHMSA-N 2 1 396.535 3.333 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[NH+](C3CCCC3)CC2)cc1)[NH+]1CCOCC1 ZINC000118030926 1413099945 /nfs/dbraw/zinc/09/99/45/1413099945.db2.gz YCGUXZVFKGEERV-GOSISDBHSA-N 2 1 386.540 3.172 20 0 GGADMP Cc1cccc(N2CC[NH+](CCCNC(=O)CCn3cc[nH+]c3C(C)C)CC2)c1 ZINC000118770056 1413217529 /nfs/dbraw/zinc/21/75/29/1413217529.db2.gz YCUCKUQRZQGJEN-UHFFFAOYSA-N 2 1 397.567 3.034 20 0 GGADMP CC(C)c1[nH+]ccn1CCC(=O)NCCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000118776060 1413217914 /nfs/dbraw/zinc/21/79/14/1413217914.db2.gz YSXDZGFIXZMLMP-UHFFFAOYSA-N 2 1 397.567 3.115 20 0 GGADMP CN(C[C@@H]1CCC[N@H+](C)C1)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000118813954 1413230415 /nfs/dbraw/zinc/23/04/15/1413230415.db2.gz PTEVGXMYURNJNH-QGZVFWFLSA-N 2 1 376.570 3.041 20 0 GGADMP CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000118813954 1413230425 /nfs/dbraw/zinc/23/04/25/1413230425.db2.gz PTEVGXMYURNJNH-QGZVFWFLSA-N 2 1 376.570 3.041 20 0 GGADMP CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000118814008 1413230505 /nfs/dbraw/zinc/23/05/05/1413230505.db2.gz NZXGCVBRZNXYTJ-LJQANCHMSA-N 2 1 390.597 3.083 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](CCC(=O)Nc3cc(Cl)ccc3Cl)C2)CC1 ZINC000118834608 1413237376 /nfs/dbraw/zinc/23/73/76/1413237376.db2.gz SZNHEDHGOCUZFG-INIZCTEOSA-N 2 1 399.366 3.034 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3c(-c4ccccc4)nc4ccccn43)C2)CC1 ZINC000118834678 1413237617 /nfs/dbraw/zinc/23/76/17/1413237617.db2.gz GCFVUENMYRPQIA-OAQYLSRUSA-N 2 1 389.547 3.213 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cccc(C(=O)Nc4ccccc4)c3)C2)CC1 ZINC000118834648 1413237693 /nfs/dbraw/zinc/23/76/93/1413237693.db2.gz XQMVFDPQOXZDMG-QHCPKHFHSA-N 2 1 392.547 3.151 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)CC1 ZINC000118868561 1413254713 /nfs/dbraw/zinc/25/47/13/1413254713.db2.gz FPAUGFZSDLKRMC-UHFFFAOYSA-N 2 1 395.551 3.352 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000118957899 1413275214 /nfs/dbraw/zinc/27/52/14/1413275214.db2.gz UTKGLNUPHDSTFQ-RBUKOAKNSA-N 2 1 392.613 3.237 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000118957899 1413275228 /nfs/dbraw/zinc/27/52/28/1413275228.db2.gz UTKGLNUPHDSTFQ-RBUKOAKNSA-N 2 1 392.613 3.237 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000118957899 1413275247 /nfs/dbraw/zinc/27/52/47/1413275247.db2.gz UTKGLNUPHDSTFQ-RBUKOAKNSA-N 2 1 392.613 3.237 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H]2CCCN(C(=O)OC(C)(C)C)C2)[C@H](C)C1 ZINC000118980074 1413287475 /nfs/dbraw/zinc/28/74/75/1413287475.db2.gz LVZRJOMGYZLEOK-GUDVDZBRSA-N 2 1 383.577 3.113 20 0 GGADMP Cc1c(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)cnn1-c1cc[nH+]cc1 ZINC000119004759 1413301005 /nfs/dbraw/zinc/30/10/05/1413301005.db2.gz ZXQSHJIJVKEAMZ-GOSISDBHSA-N 2 1 381.505 3.204 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(C(=O)NCc2ccc(C)c(F)c2)CC1 ZINC000119159270 1413359545 /nfs/dbraw/zinc/35/95/45/1413359545.db2.gz RWZIPMPMBYPZKT-UHFFFAOYSA-N 2 1 386.515 3.448 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1)c1cccc(OC)c1 ZINC000119190878 1413370709 /nfs/dbraw/zinc/37/07/09/1413370709.db2.gz LQPLMDLISNSCBR-YRISNDGFSA-N 2 1 388.556 3.003 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)C(C)(C)C[NH+](C)C)cc1F ZINC000119415206 1413439824 /nfs/dbraw/zinc/43/98/24/1413439824.db2.gz YDYIPDGUCROORR-AWEZNQCLSA-N 2 1 375.492 3.095 20 0 GGADMP C[C@H](NC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C[NH+](C)C ZINC000119424145 1413442887 /nfs/dbraw/zinc/44/28/87/1413442887.db2.gz KJQIWPJSARIZHE-DLBZAZTESA-N 2 1 380.602 3.236 20 0 GGADMP c1nnc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)n1-c1ccccc1 ZINC000119454809 1413452327 /nfs/dbraw/zinc/45/23/27/1413452327.db2.gz OYCLYBYRQWOBGM-UHFFFAOYSA-N 2 1 377.492 3.032 20 0 GGADMP Cc1cc(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)ccc1Oc1cccnc1 ZINC000119529328 1413476707 /nfs/dbraw/zinc/47/67/07/1413476707.db2.gz NHHDGYNWEGALHK-UHFFFAOYSA-N 2 1 380.536 3.396 20 0 GGADMP CCCOc1ccc(C[N@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)c(OCCC)c1 ZINC000119581915 1413492620 /nfs/dbraw/zinc/49/26/20/1413492620.db2.gz LMHAMGLPZOYAIQ-NRFANRHFSA-N 2 1 389.584 3.476 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cn(C)nc3-c3cc4ccccc4o3)C2)CC1 ZINC000119608553 1413502150 /nfs/dbraw/zinc/50/21/50/1413502150.db2.gz ACIQMCTYMDYFHF-FQEVSTJZSA-N 2 1 393.535 3.045 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000119805801 1413575717 /nfs/dbraw/zinc/57/57/17/1413575717.db2.gz WEGSIBXAGAFVFP-ZVDOUQERSA-N 2 1 387.568 3.004 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000119805801 1413575721 /nfs/dbraw/zinc/57/57/21/1413575721.db2.gz WEGSIBXAGAFVFP-ZVDOUQERSA-N 2 1 387.568 3.004 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000119805801 1413575726 /nfs/dbraw/zinc/57/57/26/1413575726.db2.gz WEGSIBXAGAFVFP-ZVDOUQERSA-N 2 1 387.568 3.004 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000119805801 1413575730 /nfs/dbraw/zinc/57/57/30/1413575730.db2.gz WEGSIBXAGAFVFP-ZVDOUQERSA-N 2 1 387.568 3.004 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NC3CC[NH+](C4CCCC4)CC3)cc2)C[C@@H](C)O1 ZINC000177448829 1428741115 /nfs/dbraw/zinc/74/11/15/1428741115.db2.gz TZBDGQLWJNZUHW-RTBURBONSA-N 2 1 399.579 3.433 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000119982546 1413641605 /nfs/dbraw/zinc/64/16/05/1413641605.db2.gz FKRSJWDEYFOSSI-UHFFFAOYSA-N 2 1 387.503 3.027 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000120099402 1413687483 /nfs/dbraw/zinc/68/74/83/1413687483.db2.gz BLEYKVJIVIBVJJ-PSWRPDDJSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000120099402 1413687487 /nfs/dbraw/zinc/68/74/87/1413687487.db2.gz BLEYKVJIVIBVJJ-PSWRPDDJSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000120099402 1413687492 /nfs/dbraw/zinc/68/74/92/1413687492.db2.gz BLEYKVJIVIBVJJ-PSWRPDDJSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)c1ccco1 ZINC000120153936 1413709160 /nfs/dbraw/zinc/70/91/60/1413709160.db2.gz DHILKVCSBLIJTE-LJQANCHMSA-N 2 1 376.545 3.180 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)NC[C@H](c3ccco3)[NH+](C)C)CC2)CC1 ZINC000120157856 1413710769 /nfs/dbraw/zinc/71/07/69/1413710769.db2.gz LPEMCZWBONXQKN-CTWPCTMYSA-N 2 1 376.545 3.225 20 0 GGADMP CC(C)C[C@@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)N1CCOCC1 ZINC000120231483 1413743001 /nfs/dbraw/zinc/74/30/01/1413743001.db2.gz KGYWCBBGBNNIKZ-QHCPKHFHSA-N 2 1 391.575 3.169 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1OCC(F)F ZINC000120236926 1413745059 /nfs/dbraw/zinc/74/50/59/1413745059.db2.gz FTMROZCVKXRNBN-INIZCTEOSA-N 2 1 398.498 3.210 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](Cc2ccc(F)cc2F)CC1 ZINC000120239182 1413745674 /nfs/dbraw/zinc/74/56/74/1413745674.db2.gz PTCFPRJPBNYINO-UHFFFAOYSA-N 2 1 379.495 3.169 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000120251708 1413752557 /nfs/dbraw/zinc/75/25/57/1413752557.db2.gz RJTJHQPEVRNSID-UHFFFAOYSA-N 2 1 390.597 3.225 20 0 GGADMP CN(C)c1cccc(C[N@H+](C)CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000120289155 1413769421 /nfs/dbraw/zinc/76/94/21/1413769421.db2.gz BPTVUUYXIAQJBD-UHFFFAOYSA-N 2 1 394.563 3.097 20 0 GGADMP CN(C)c1cccc(C[N@@H+](C)CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000120289155 1413769429 /nfs/dbraw/zinc/76/94/29/1413769429.db2.gz BPTVUUYXIAQJBD-UHFFFAOYSA-N 2 1 394.563 3.097 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[N@H+](CCCCn3cc[nH+]c3C)CC2)cc1 ZINC000120352922 1413800273 /nfs/dbraw/zinc/80/02/73/1413800273.db2.gz ODBSBQXNMWOEMO-UHFFFAOYSA-N 2 1 398.551 3.147 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[N@@H+](CCCCn3cc[nH+]c3C)CC2)cc1 ZINC000120352922 1413800274 /nfs/dbraw/zinc/80/02/74/1413800274.db2.gz ODBSBQXNMWOEMO-UHFFFAOYSA-N 2 1 398.551 3.147 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)c1ccccc1 ZINC000120410473 1413812080 /nfs/dbraw/zinc/81/20/80/1413812080.db2.gz FNSYVGDVBNYDBN-OAQYLSRUSA-N 2 1 377.492 3.389 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C)C2)CC[N@H+]1Cc1ccccc1 ZINC000120413167 1413812472 /nfs/dbraw/zinc/81/24/72/1413812472.db2.gz WVKZTJXJFGKJTL-ZHHKINOHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)CC[NH+]1Cc1ccccc1 ZINC000120413167 1413812474 /nfs/dbraw/zinc/81/24/74/1413812474.db2.gz WVKZTJXJFGKJTL-ZHHKINOHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)CC[NH+]1Cc1ccccc1 ZINC000120413167 1413812476 /nfs/dbraw/zinc/81/24/76/1413812476.db2.gz WVKZTJXJFGKJTL-ZHHKINOHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC(CC[NH+]3CCCC[C@H]3C)CC2)C[N@H+]1C1CC1 ZINC000120416697 1413813034 /nfs/dbraw/zinc/81/30/34/1413813034.db2.gz RLRFSHKJOPMZBW-WSTZPKSXSA-N 2 1 376.589 3.298 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C[NH+]1C1CC1 ZINC000120416697 1413813036 /nfs/dbraw/zinc/81/30/36/1413813036.db2.gz RLRFSHKJOPMZBW-WSTZPKSXSA-N 2 1 376.589 3.298 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C[NH+]1C1CC1 ZINC000120416697 1413813038 /nfs/dbraw/zinc/81/30/38/1413813038.db2.gz RLRFSHKJOPMZBW-WSTZPKSXSA-N 2 1 376.589 3.298 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)N(C)[C@@H]3CC[N@@H+](C)C[C@@H]3C)c2)CC1 ZINC000120498571 1413831192 /nfs/dbraw/zinc/83/11/92/1413831192.db2.gz QYBGMWGKQHTLRN-SIKLNZKXSA-N 2 1 386.584 3.400 20 0 GGADMP CC[C@@H](Cc1ccc(OC)c(OC)c1)[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000120648765 1413865273 /nfs/dbraw/zinc/86/52/73/1413865273.db2.gz OHVFHYPXGBZEHD-VXKWHMMOSA-N 2 1 398.547 3.381 20 0 GGADMP CCc1noc(C2CCC([NH2+]Cc3ccccc3C[N@H+]3CC[C@@H](O)C3)CC2)n1 ZINC000120654243 1413866800 /nfs/dbraw/zinc/86/68/00/1413866800.db2.gz IHTNAGSECLXRHK-RRWXTXHCSA-N 2 1 384.524 3.015 20 0 GGADMP CCc1noc(C2CCC([NH2+]Cc3ccccc3C[N@H+]3CC[C@H](O)C3)CC2)n1 ZINC000120654069 1413866909 /nfs/dbraw/zinc/86/69/09/1413866909.db2.gz IHTNAGSECLXRHK-GQOXECLESA-N 2 1 384.524 3.015 20 0 GGADMP Cc1c(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000120673884 1413871759 /nfs/dbraw/zinc/87/17/59/1413871759.db2.gz QGXYSNARDMCMDV-NRFANRHFSA-N 2 1 375.476 3.143 20 0 GGADMP COc1ccc(C[N@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)[C@@H](C)C2CC2)cc1 ZINC000120714532 1413882519 /nfs/dbraw/zinc/88/25/19/1413882519.db2.gz RAPDVPPTIKNJLS-SFHVURJKSA-N 2 1 395.551 3.038 20 0 GGADMP COc1ccc(C[N@@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)[C@@H](C)C2CC2)cc1 ZINC000120714532 1413882523 /nfs/dbraw/zinc/88/25/23/1413882523.db2.gz RAPDVPPTIKNJLS-SFHVURJKSA-N 2 1 395.551 3.038 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCc2ccc(C[NH+](C)C)cc2)C[N@H+]1Cc1ccccc1 ZINC000120713331 1413882760 /nfs/dbraw/zinc/88/27/60/1413882760.db2.gz UWDGZCNGHXXLQF-AVRDEDQJSA-N 2 1 380.536 3.210 20 0 GGADMP C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000120718197 1413883715 /nfs/dbraw/zinc/88/37/15/1413883715.db2.gz ASNPTVUOCCGBBV-HNNXBMFYSA-N 2 1 390.915 3.495 20 0 GGADMP C[NH+](C)[C@H](C(=O)Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccccc1 ZINC000120721709 1413884622 /nfs/dbraw/zinc/88/46/22/1413884622.db2.gz ALVGBYFGJBLATA-QFIPXVFZSA-N 2 1 381.520 3.132 20 0 GGADMP CC(C)c1[nH+]ccn1CCC(=O)Nc1cccc(C[NH+]2CCC(CO)CC2)c1 ZINC000120743655 1413890727 /nfs/dbraw/zinc/89/07/27/1413890727.db2.gz VFGPOIQQOMIHMJ-UHFFFAOYSA-N 2 1 384.524 3.240 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)C1 ZINC000120761254 1413895705 /nfs/dbraw/zinc/89/57/05/1413895705.db2.gz OZHAPFGOMKXHHG-KRWDZBQOSA-N 2 1 384.524 3.306 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+]([C@H](C(=O)N(C)C)c3ccccc3)CC2)C[C@H](C)O1 ZINC000177487939 1428764265 /nfs/dbraw/zinc/76/42/65/1428764265.db2.gz OAXCMKBXDGOBTG-JQVVWYNYSA-N 2 1 387.568 3.027 20 0 GGADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000120792679 1413904634 /nfs/dbraw/zinc/90/46/34/1413904634.db2.gz PFVNJYYGSQTSHH-FQEVSTJZSA-N 2 1 375.520 3.425 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]Cc2coc3ccccc23)c1 ZINC000121049506 1413989075 /nfs/dbraw/zinc/98/90/75/1413989075.db2.gz GIXZQWLXWZBXEO-UHFFFAOYSA-N 2 1 393.487 3.383 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000121114761 1414012841 /nfs/dbraw/zinc/01/28/41/1414012841.db2.gz XBTFFRHKRCYVEE-SFHVURJKSA-N 2 1 389.565 3.110 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](CCC(=O)Nc3ccccc3F)CC2)C[C@H](C)O1 ZINC000177508496 1428775431 /nfs/dbraw/zinc/77/54/31/1428775431.db2.gz DRCNFVWLRQHSQA-HDICACEKSA-N 2 1 391.531 3.366 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000121165087 1414030080 /nfs/dbraw/zinc/03/00/80/1414030080.db2.gz CQOZCFBEHKUKAL-QGZVFWFLSA-N 2 1 381.586 3.242 20 0 GGADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000121165087 1414030086 /nfs/dbraw/zinc/03/00/86/1414030086.db2.gz CQOZCFBEHKUKAL-QGZVFWFLSA-N 2 1 381.586 3.242 20 0 GGADMP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)C[C@H](C)O1 ZINC000177509834 1428775659 /nfs/dbraw/zinc/77/56/59/1428775659.db2.gz KWXHGTOEMOTGJU-HDICACEKSA-N 2 1 384.524 3.448 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)C[C@H](C)O1 ZINC000177509834 1428775666 /nfs/dbraw/zinc/77/56/66/1428775666.db2.gz KWXHGTOEMOTGJU-HDICACEKSA-N 2 1 384.524 3.448 20 0 GGADMP Cc1ccc(C)c(NC(=O)C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000177510038 1428775775 /nfs/dbraw/zinc/77/57/75/1428775775.db2.gz WWCLZMREBDLDDR-PMACEKPBSA-N 2 1 387.568 3.453 20 0 GGADMP Cc1c(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)cnn1-c1cc[nH+]cc1 ZINC000121248909 1414058053 /nfs/dbraw/zinc/05/80/53/1414058053.db2.gz KFRPPHLLZBMQAV-UHFFFAOYSA-N 2 1 375.476 3.102 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000121280187 1414069561 /nfs/dbraw/zinc/06/95/61/1414069561.db2.gz HIVLQZGFZJCNIH-SFHVURJKSA-N 2 1 383.540 3.449 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[C@H](C[N@H+](C)CC)C1 ZINC000177519099 1428779910 /nfs/dbraw/zinc/77/99/10/1428779910.db2.gz VYCWRRGVHBOPPD-GOSISDBHSA-N 2 1 376.545 3.213 20 0 GGADMP O=C(NC[C@H]1CC[N@H+](C2CC2)C1)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000121415778 1414114540 /nfs/dbraw/zinc/11/45/40/1414114540.db2.gz PJYIWEXKMVCZRC-QGZVFWFLSA-N 2 1 390.959 3.088 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+](C3CC3)[C@@H]3CCCc4ccccc43)cn2)CC1 ZINC000121521443 1414160524 /nfs/dbraw/zinc/16/05/24/1414160524.db2.gz IRVDWVNBRQCUAD-JOCHJYFZSA-N 2 1 377.536 3.270 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+](C3CC3)[C@@H]3CCCc4ccccc43)cn2)CC1 ZINC000121521443 1414160531 /nfs/dbraw/zinc/16/05/31/1414160531.db2.gz IRVDWVNBRQCUAD-JOCHJYFZSA-N 2 1 377.536 3.270 20 0 GGADMP Cc1ccccc1O[C@@H]1CCCC[C@@H]1[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000121684702 1414222740 /nfs/dbraw/zinc/22/27/40/1414222740.db2.gz GVSROCJABGQJCN-RBBKRZOGSA-N 2 1 395.551 3.017 20 0 GGADMP CS(=O)(=O)c1ccc(OCC[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC000121701935 1414229347 /nfs/dbraw/zinc/22/93/47/1414229347.db2.gz MPRLQDNULSONAB-UHFFFAOYSA-N 2 1 394.581 3.057 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC000121815462 1414266155 /nfs/dbraw/zinc/26/61/55/1414266155.db2.gz SQBVQCVDOZFXLY-ROUUACIJSA-N 2 1 381.586 3.100 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC000121815291 1414266432 /nfs/dbraw/zinc/26/64/32/1414266432.db2.gz SQBVQCVDOZFXLY-ZWKOTPCHSA-N 2 1 381.586 3.100 20 0 GGADMP COc1ccc(NC(=O)C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1OC ZINC000121823725 1414269674 /nfs/dbraw/zinc/26/96/74/1414269674.db2.gz FSCQAVDKWNCFDT-UHFFFAOYSA-N 2 1 389.540 3.230 20 0 GGADMP Cn1cc[nH+]c1CC1CCN(C(=O)c2ccc(C[NH+]3CCSCC3)cc2)CC1 ZINC000121887999 1414291680 /nfs/dbraw/zinc/29/16/80/1414291680.db2.gz XVOXWXJDDMRUIM-UHFFFAOYSA-N 2 1 398.576 3.064 20 0 GGADMP CS(=O)(=O)c1cccc(OCC[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000121922419 1414308260 /nfs/dbraw/zinc/30/82/60/1414308260.db2.gz DXFLVYKSOFDJCA-UHFFFAOYSA-N 2 1 394.581 3.057 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@@H](C)[NH2+]CC(C)(C)[NH+]2CCCCC2)c1 ZINC000121942896 1414316409 /nfs/dbraw/zinc/31/64/09/1414316409.db2.gz ISBGSLPCGWYNEK-MRXNPFEDSA-N 2 1 377.529 3.275 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H]2CCN(c3ccccc3F)C2=O)CC1 ZINC000122049998 1414349002 /nfs/dbraw/zinc/34/90/02/1414349002.db2.gz YXPKAUKLQMOEJK-NRFANRHFSA-N 2 1 391.531 3.001 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H]2CCN(c3ccccc3F)C2=O)CC1 ZINC000122049998 1414349008 /nfs/dbraw/zinc/34/90/08/1414349008.db2.gz YXPKAUKLQMOEJK-NRFANRHFSA-N 2 1 391.531 3.001 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2cc(F)ccc2F)CC1 ZINC000122118838 1414366480 /nfs/dbraw/zinc/36/64/80/1414366480.db2.gz HQEJTMUSCIBCSX-MRXNPFEDSA-N 2 1 397.510 3.362 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2cc(F)ccc2F)CC1 ZINC000122118838 1414366486 /nfs/dbraw/zinc/36/64/86/1414366486.db2.gz HQEJTMUSCIBCSX-MRXNPFEDSA-N 2 1 397.510 3.362 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(C)c2)CC1 ZINC000122137092 1414370811 /nfs/dbraw/zinc/37/08/11/1414370811.db2.gz YOSXAWRMQBNZMU-IBGZPJMESA-N 2 1 375.557 3.392 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2nc(C)c(C)s2)CC1 ZINC000122186436 1414382901 /nfs/dbraw/zinc/38/29/01/1414382901.db2.gz BBZFDCKZXAPWGX-MRXNPFEDSA-N 2 1 396.601 3.157 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2nc(C)c(C)s2)CC1 ZINC000122186436 1414382911 /nfs/dbraw/zinc/38/29/11/1414382911.db2.gz BBZFDCKZXAPWGX-MRXNPFEDSA-N 2 1 396.601 3.157 20 0 GGADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1 ZINC000122278056 1414409102 /nfs/dbraw/zinc/40/91/02/1414409102.db2.gz LUYZHDUSOFFNOO-YJBOKZPZSA-N 2 1 379.932 3.039 20 0 GGADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1 ZINC000122278056 1414409115 /nfs/dbraw/zinc/40/91/15/1414409115.db2.gz LUYZHDUSOFFNOO-YJBOKZPZSA-N 2 1 379.932 3.039 20 0 GGADMP C[C@H](CC(=O)Nc1cccnc1Cl)[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000122754565 1414557053 /nfs/dbraw/zinc/55/70/53/1414557053.db2.gz VWFLTMOWRXPSRZ-MRXNPFEDSA-N 2 1 386.927 3.490 20 0 GGADMP C[C@H](CC(=O)Nc1cccnc1Cl)[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000122754565 1414557059 /nfs/dbraw/zinc/55/70/59/1414557059.db2.gz VWFLTMOWRXPSRZ-MRXNPFEDSA-N 2 1 386.927 3.490 20 0 GGADMP CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCOCC1 ZINC000122800403 1414568085 /nfs/dbraw/zinc/56/80/85/1414568085.db2.gz WFZXHLNFDAWSTK-VQTJNVASSA-N 2 1 389.540 3.054 20 0 GGADMP CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000122915488 1414595855 /nfs/dbraw/zinc/59/58/55/1414595855.db2.gz XKRNHKCRZUGBIC-QZTJIDSGSA-N 2 1 381.561 3.057 20 0 GGADMP C[NH+](C)CCOc1ccccc1CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000122946966 1414603065 /nfs/dbraw/zinc/60/30/65/1414603065.db2.gz YREOOHKUAJEKTM-JOCHJYFZSA-N 2 1 395.547 3.155 20 0 GGADMP CCOC(=O)c1c(C)[nH]c(C(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)c1C ZINC000123156176 1414655623 /nfs/dbraw/zinc/65/56/23/1414655623.db2.gz PLGAMHTWPJTIEL-UHFFFAOYSA-N 2 1 377.529 3.045 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+]Cc2cc3ccccc3[nH]c2=O)CC1 ZINC000123331533 1414698401 /nfs/dbraw/zinc/69/84/01/1414698401.db2.gz KDMJOBYCPCHVCS-UHFFFAOYSA-N 2 1 390.531 3.368 20 0 GGADMP C[N@@H+](CCCNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)Cc1ccccc1 ZINC000123349461 1414703124 /nfs/dbraw/zinc/70/31/24/1414703124.db2.gz ZHMXOXPITRXBSA-IFMALSPDSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)Cc1ccccc1 ZINC000123349461 1414703133 /nfs/dbraw/zinc/70/31/33/1414703133.db2.gz ZHMXOXPITRXBSA-IFMALSPDSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)Cc1ccccc1 ZINC000123349461 1414703142 /nfs/dbraw/zinc/70/31/42/1414703142.db2.gz ZHMXOXPITRXBSA-IFMALSPDSA-N 2 1 384.568 3.167 20 0 GGADMP C[N@@H+](CCCNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)C1CCCCC1 ZINC000123393606 1414714170 /nfs/dbraw/zinc/71/41/70/1414714170.db2.gz IYZHQYDHJZEEMV-WIYYLYMNSA-N 2 1 376.589 3.299 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C1CCCCC1 ZINC000123393606 1414714185 /nfs/dbraw/zinc/71/41/85/1414714185.db2.gz IYZHQYDHJZEEMV-WIYYLYMNSA-N 2 1 376.589 3.299 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)C1CCCCC1 ZINC000123393606 1414714202 /nfs/dbraw/zinc/71/42/02/1414714202.db2.gz IYZHQYDHJZEEMV-WIYYLYMNSA-N 2 1 376.589 3.299 20 0 GGADMP COc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(CCC[NH+](C)C)CC2)c(OC)c1 ZINC000123408108 1414720895 /nfs/dbraw/zinc/72/08/95/1414720895.db2.gz RADYTCSQBWWMRB-MRXNPFEDSA-N 2 1 377.529 3.085 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3cc4ccccc4[nH]c3=O)c2)CCO1 ZINC000123446060 1414733517 /nfs/dbraw/zinc/73/35/17/1414733517.db2.gz WXUPZBBWYCNMBH-QGZVFWFLSA-N 2 1 377.488 3.451 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3cc4ccccc4[nH]c3=O)c2)CCO1 ZINC000123446060 1414733526 /nfs/dbraw/zinc/73/35/26/1414733526.db2.gz WXUPZBBWYCNMBH-QGZVFWFLSA-N 2 1 377.488 3.451 20 0 GGADMP COc1cc(NC(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)c(OC)cc1Cl ZINC000123512164 1414758195 /nfs/dbraw/zinc/75/81/95/1414758195.db2.gz RQLITIFDKCDFAK-UHFFFAOYSA-N 2 1 397.947 3.350 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000123533149 1414765551 /nfs/dbraw/zinc/76/55/51/1414765551.db2.gz RNPIBOJEKKRZER-MOPGFXCFSA-N 2 1 388.556 3.179 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000123533149 1414765569 /nfs/dbraw/zinc/76/55/69/1414765569.db2.gz RNPIBOJEKKRZER-MOPGFXCFSA-N 2 1 388.556 3.179 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH+]3CCC(CCc4ccccc4)CC3)cn2)CC1 ZINC000123636849 1414801739 /nfs/dbraw/zinc/80/17/39/1414801739.db2.gz OFAJCFISUVISKK-UHFFFAOYSA-N 2 1 379.552 3.073 20 0 GGADMP O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000123740731 1414818351 /nfs/dbraw/zinc/81/83/51/1414818351.db2.gz IXKRDIQKOGWCSO-YMPZKCBVSA-N 2 1 396.579 3.482 20 0 GGADMP O=C(C1CCCCC1)N1CC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000123802432 1414826668 /nfs/dbraw/zinc/82/66/68/1414826668.db2.gz UWNCSPCLLWQWHY-HSZRJFAPSA-N 2 1 383.580 3.464 20 0 GGADMP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](CC(=O)N2CCC(Cc3ccccc3)CC2)C1 ZINC000123826596 1414830121 /nfs/dbraw/zinc/83/01/21/1414830121.db2.gz UVWPTCOCXNAOIP-JOCHJYFZSA-N 2 1 394.563 3.156 20 0 GGADMP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](CC(=O)N2CCC(Cc3ccccc3)CC2)C1 ZINC000123826596 1414830124 /nfs/dbraw/zinc/83/01/24/1414830124.db2.gz UVWPTCOCXNAOIP-JOCHJYFZSA-N 2 1 394.563 3.156 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000123861202 1414837370 /nfs/dbraw/zinc/83/73/70/1414837370.db2.gz HOQITGPRHOELJP-QFIPXVFZSA-N 2 1 386.584 3.450 20 0 GGADMP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2nc(-c3ccccc3)cs2)cc1 ZINC000123871612 1414840189 /nfs/dbraw/zinc/84/01/89/1414840189.db2.gz BUDSCEKLDKTGAN-UHFFFAOYSA-N 2 1 394.544 3.391 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000123956802 1414857173 /nfs/dbraw/zinc/85/71/73/1414857173.db2.gz DQGAJWQGQXLJDJ-CYBMUJFWSA-N 2 1 380.330 3.383 20 0 GGADMP CC(C)[C@H](CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)[NH+]1CCC(C)CC1 ZINC000124003749 1414867014 /nfs/dbraw/zinc/86/70/14/1414867014.db2.gz OADVOVNKXAMBOJ-FQEVSTJZSA-N 2 1 389.588 3.141 20 0 GGADMP C[C@@H](C[NH+]1CCCCC1)NC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000124074987 1414881087 /nfs/dbraw/zinc/88/10/87/1414881087.db2.gz HIKAOQLEXNITSV-INIZCTEOSA-N 2 1 394.510 3.103 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2ccc(OC(F)F)c(Br)c2)CC1 ZINC000124121400 1414889023 /nfs/dbraw/zinc/88/90/23/1414889023.db2.gz ZUDPMMPHLJKDFG-UHFFFAOYSA-N 2 1 393.272 3.251 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]CC2CCN(C(=O)OC(C)(C)C)CC2)C[C@H](C)O1 ZINC000177749853 1428849369 /nfs/dbraw/zinc/84/93/69/1428849369.db2.gz JWWCRKAAXZSSJL-HDICACEKSA-N 2 1 383.577 3.113 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000124462739 1414974468 /nfs/dbraw/zinc/97/44/68/1414974468.db2.gz LBNBNHLTYYLGCG-UHFFFAOYSA-N 2 1 393.019 3.168 20 0 GGADMP COC[C@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000124468899 1414975353 /nfs/dbraw/zinc/97/53/53/1414975353.db2.gz PEQNFYUKDYXZMQ-IBGZPJMESA-N 2 1 387.490 3.256 20 0 GGADMP CCO[C@@H](C)c1nc(CN2CC[NH+](CCCCn3cc[nH+]c3C)CC2)cs1 ZINC000124510217 1414984397 /nfs/dbraw/zinc/98/43/97/1414984397.db2.gz DIINVHJYWYEIDE-KRWDZBQOSA-N 2 1 391.585 3.344 20 0 GGADMP CCN(CC)C(=O)C[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000124643350 1415012266 /nfs/dbraw/zinc/01/22/66/1415012266.db2.gz OLUQCBHVTJUUDP-QRVBRYPASA-N 2 1 375.557 3.032 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000124912305 1415071249 /nfs/dbraw/zinc/07/12/49/1415071249.db2.gz GPTRVFFGKZYZNI-TZIWHRDSSA-N 2 1 376.589 3.157 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000124912783 1415071324 /nfs/dbraw/zinc/07/13/24/1415071324.db2.gz GPTRVFFGKZYZNI-FPOVZHCZSA-N 2 1 376.589 3.157 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)c1 ZINC000124989617 1415087714 /nfs/dbraw/zinc/08/77/14/1415087714.db2.gz GYHTVSQUCIKWDY-JOCHJYFZSA-N 2 1 397.494 3.264 20 0 GGADMP Cc1cccc2c1CC[C@H]2[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000124998688 1415089010 /nfs/dbraw/zinc/08/90/10/1415089010.db2.gz ZTACUBPFVJEYNF-HSZRJFAPSA-N 2 1 393.531 3.433 20 0 GGADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125027009 1415094311 /nfs/dbraw/zinc/09/43/11/1415094311.db2.gz BQAFWBTZNFWVNS-SFHVURJKSA-N 2 1 399.510 3.207 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)c1 ZINC000125042453 1415098277 /nfs/dbraw/zinc/09/82/77/1415098277.db2.gz SEJGGQXWTQVBSB-NHCUHLMSSA-N 2 1 385.552 3.406 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)cc1 ZINC000125047069 1415099114 /nfs/dbraw/zinc/09/91/14/1415099114.db2.gz KZUDCBGMPPFXJK-GOSISDBHSA-N 2 1 397.519 3.207 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000177849137 1428872209 /nfs/dbraw/zinc/87/22/09/1428872209.db2.gz PXCKYPJOVIDHLP-JOCHJYFZSA-N 2 1 386.584 3.402 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH+]1CCN(CCOc2ccccc2Cl)CC1 ZINC000125436147 1415197454 /nfs/dbraw/zinc/19/74/54/1415197454.db2.gz YDLHQKPQAAVOAO-UHFFFAOYSA-N 2 1 376.932 3.322 20 0 GGADMP C[N@@H+](CC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)[C@H]1CCSC1 ZINC000125669202 1415250289 /nfs/dbraw/zinc/25/02/89/1415250289.db2.gz ZSYMGKXSBJSUSX-FQEVSTJZSA-N 2 1 375.582 3.116 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000125720831 1415262434 /nfs/dbraw/zinc/26/24/34/1415262434.db2.gz QTQHQPWZCKRKPU-DLBZAZTESA-N 2 1 377.529 3.131 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)[NH+]2CCCC2)o1 ZINC000125825663 1415291344 /nfs/dbraw/zinc/29/13/44/1415291344.db2.gz SONWMSKGZYGZAC-UXHICEINSA-N 2 1 390.572 3.392 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(OC)c1 ZINC000125899220 1415307801 /nfs/dbraw/zinc/30/78/01/1415307801.db2.gz UOSSQZQFSRQJSR-KSZLIROESA-N 2 1 391.556 3.379 20 0 GGADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1OCC(=O)N(C)C ZINC000125913338 1415311093 /nfs/dbraw/zinc/31/10/93/1415311093.db2.gz DBTFUSOPYOOOEZ-UYAOXDASSA-N 2 1 375.557 3.315 20 0 GGADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1OCC(=O)N(C)C ZINC000125913338 1415311101 /nfs/dbraw/zinc/31/11/01/1415311101.db2.gz DBTFUSOPYOOOEZ-UYAOXDASSA-N 2 1 375.557 3.315 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)N[C@H]2CC[NH+](CC3CC3)C2)CC1 ZINC000125924223 1415314241 /nfs/dbraw/zinc/31/42/41/1415314241.db2.gz AVTWQJBQXNQMQW-QFIPXVFZSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)N[C@H]2CC[N@H+](CC3CC3)C2)CC1 ZINC000125924223 1415314249 /nfs/dbraw/zinc/31/42/49/1415314249.db2.gz AVTWQJBQXNQMQW-QFIPXVFZSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000125924223 1415314256 /nfs/dbraw/zinc/31/42/56/1415314256.db2.gz AVTWQJBQXNQMQW-QFIPXVFZSA-N 2 1 384.568 3.024 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000126028552 1415339929 /nfs/dbraw/zinc/33/99/29/1415339929.db2.gz CDWBDIFFQZFXHL-MRXNPFEDSA-N 2 1 375.904 3.371 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000126028552 1415339932 /nfs/dbraw/zinc/33/99/32/1415339932.db2.gz CDWBDIFFQZFXHL-MRXNPFEDSA-N 2 1 375.904 3.371 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3COC4(CCCCC4)O3)CC2)cc1 ZINC000126209675 1415385155 /nfs/dbraw/zinc/38/51/55/1415385155.db2.gz NIHRXIKUDFEOCA-OAQYLSRUSA-N 2 1 376.516 3.498 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCNS(=O)(=O)c2ccc(C)cc2)cc1 ZINC000177995469 1428921223 /nfs/dbraw/zinc/92/12/23/1428921223.db2.gz MKJIXYCEUMPVJO-KRWDZBQOSA-N 2 1 398.532 3.118 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1[nH]c(C)c(C(C)=O)c1C(C)C ZINC000126298032 1415410000 /nfs/dbraw/zinc/41/00/00/1415410000.db2.gz WNHDXTHOJPVEIC-SFHVURJKSA-N 2 1 390.572 3.137 20 0 GGADMP O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000126364098 1415427605 /nfs/dbraw/zinc/42/76/05/1415427605.db2.gz YRFRQJWOGFXKHR-UZLBHIALSA-N 2 1 390.959 3.260 20 0 GGADMP CN(C(=O)[C@H](c1ccccc1)[NH+](C)C)c1ccc(OCC[NH+]2CCCC2)cc1 ZINC000126381685 1415431871 /nfs/dbraw/zinc/43/18/71/1415431871.db2.gz DYKVVGAFEQMQGS-QFIPXVFZSA-N 2 1 381.520 3.427 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@H](c1ccco1)[NH+](C)C)c1ccsc1 ZINC000126386285 1415433157 /nfs/dbraw/zinc/43/31/57/1415433157.db2.gz QFRPVTYQTFOWAX-IAGOWNOFSA-N 2 1 378.542 3.326 20 0 GGADMP Cc1nc(C)c([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)s1 ZINC000178006547 1428930746 /nfs/dbraw/zinc/93/07/46/1428930746.db2.gz RTLXVNSDDXTEEC-LIRRHRJNSA-N 2 1 386.565 3.308 20 0 GGADMP C[NH+](C)Cc1cccc(NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)c1 ZINC000126508122 1415473800 /nfs/dbraw/zinc/47/38/00/1415473800.db2.gz QAGSABIGUJTLBK-UHFFFAOYSA-N 2 1 382.508 3.267 20 0 GGADMP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc2c(c1)OCCO2 ZINC000126679384 1415524475 /nfs/dbraw/zinc/52/44/75/1415524475.db2.gz KCBSBUSRYJRTBA-QFIPXVFZSA-N 2 1 395.547 3.446 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000126713592 1415536035 /nfs/dbraw/zinc/53/60/35/1415536035.db2.gz SFSYULYRQDDOOU-CLYVBNDRSA-N 2 1 385.577 3.022 20 0 GGADMP O=C(NCCCCC[NH+]1CCCCC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126739323 1415544035 /nfs/dbraw/zinc/54/40/35/1415544035.db2.gz BRALGLYOBSQAJM-FPOVZHCZSA-N 2 1 376.589 3.301 20 0 GGADMP Cc1cccc(NC(=O)C[C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1C ZINC000178036378 1428948658 /nfs/dbraw/zinc/94/86/58/1428948658.db2.gz OZZJFINVIPSFRR-QRVBRYPASA-N 2 1 375.557 3.500 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCC[N@@H+]1CCC[C@H](C)C1)[NH+](C)C ZINC000126750971 1415547412 /nfs/dbraw/zinc/54/74/12/1415547412.db2.gz WJGIGKRKFJPXNY-ICSRJNTNSA-N 2 1 390.572 3.109 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCC[N@H+]1CCC[C@H](C)C1)[NH+](C)C ZINC000126750971 1415547422 /nfs/dbraw/zinc/54/74/22/1415547422.db2.gz WJGIGKRKFJPXNY-ICSRJNTNSA-N 2 1 390.572 3.109 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c2cccs2)CC1 ZINC000126776049 1415555558 /nfs/dbraw/zinc/55/55/58/1415555558.db2.gz QSHGJCBEVXYOGH-IEBWSBKVSA-N 2 1 390.597 3.305 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc(OC)c1OC ZINC000178036158 1428949063 /nfs/dbraw/zinc/94/90/63/1428949063.db2.gz OYSQPOJWUVQUHL-BBWFWOEESA-N 2 1 380.529 3.252 20 0 GGADMP C[C@@H]1C[NH+](CCCC[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C[C@@H](C)O1 ZINC000178036907 1428949386 /nfs/dbraw/zinc/94/93/86/1428949386.db2.gz QSWMBUKASPVDLH-WOJBJXKFSA-N 3 1 391.575 3.312 20 0 GGADMP O=C(C1CCCC1)N1CC[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000126905271 1415601145 /nfs/dbraw/zinc/60/11/45/1415601145.db2.gz YHXKGKBRLPKIEI-JOCHJYFZSA-N 2 1 387.543 3.213 20 0 GGADMP CCN1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)CC1 ZINC000127294894 1415723970 /nfs/dbraw/zinc/72/39/70/1415723970.db2.gz JAACZZAIXBEHBS-ROUUACIJSA-N 2 1 376.564 3.349 20 0 GGADMP O=C(NC1CC[NH+](CCc2ccccc2)CC1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000178121884 1428990848 /nfs/dbraw/zinc/99/08/48/1428990848.db2.gz BYJOKLXHUVTQCT-NRFANRHFSA-N 2 1 383.580 3.464 20 0 GGADMP CCO[C@H]1C[C@@H]([N@@H+](C)CC(=O)NC2CC[NH+](C(C)C)CC2)C12CCCCC2 ZINC000127378004 1415758105 /nfs/dbraw/zinc/75/81/05/1415758105.db2.gz SHHDCWKZOZBBAO-UXHICEINSA-N 2 1 379.589 3.035 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]C3CC(c4ccccc4)C3)c2)C1 ZINC000127512735 1415803296 /nfs/dbraw/zinc/80/32/96/1415803296.db2.gz KGIUUWRZROBXPM-UVKLAMSESA-N 2 1 377.532 3.420 20 0 GGADMP C[C@@H](C[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1ccc(F)cc1 ZINC000127615252 1415820262 /nfs/dbraw/zinc/82/02/62/1415820262.db2.gz BPIFOMWCEYSWIR-SFHVURJKSA-N 2 1 399.510 3.380 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccc(F)cc1 ZINC000127668470 1415829736 /nfs/dbraw/zinc/82/97/36/1415829736.db2.gz XWKUUIDGOHPDMG-DUXKGJEZSA-N 2 1 388.531 3.087 20 0 GGADMP C[NH+](C)CCC(=O)Nc1ccc(NC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1 ZINC000178162523 1429003518 /nfs/dbraw/zinc/00/35/18/1429003518.db2.gz XBDYTGQOYDVECR-QGZVFWFLSA-N 2 1 386.540 3.170 20 0 GGADMP O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000127749157 1415843605 /nfs/dbraw/zinc/84/36/05/1415843605.db2.gz CMBGZQKEVWIWOM-AKIFATBCSA-N 2 1 396.579 3.482 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCc2ccn(-c3ccc(F)cc3)n2)[C@H](C)C1 ZINC000127755401 1415844825 /nfs/dbraw/zinc/84/48/25/1415844825.db2.gz ZWFNNCCHNFOGRI-GCJKJVERSA-N 2 1 388.531 3.281 20 0 GGADMP CCc1ccc([C@H](CNC(=O)N2CCC(Cc3[nH+]ccn3C)CC2)[NH+](C)C)cc1 ZINC000127944295 1415879996 /nfs/dbraw/zinc/87/99/96/1415879996.db2.gz RZATZFPJGLCQFR-NRFANRHFSA-N 2 1 397.567 3.250 20 0 GGADMP CCc1ccc([C@@H](CNC(=O)N2CCC(Cc3[nH+]ccn3C)CC2)[NH+](C)C)cc1 ZINC000127944072 1415880059 /nfs/dbraw/zinc/88/00/59/1415880059.db2.gz RZATZFPJGLCQFR-OAQYLSRUSA-N 2 1 397.567 3.250 20 0 GGADMP Cc1nc(CN2CCCN(CC(C)(C)C[N@@H+](C)Cc3ccccc3)CC2)no1 ZINC000127951912 1415881833 /nfs/dbraw/zinc/88/18/33/1415881833.db2.gz YXZHTOLHYQATJI-UHFFFAOYSA-N 2 1 385.556 3.044 20 0 GGADMP Cc1nc(CN2CCC[NH+](CC(C)(C)C[N@H+](C)Cc3ccccc3)CC2)no1 ZINC000127951912 1415881836 /nfs/dbraw/zinc/88/18/36/1415881836.db2.gz YXZHTOLHYQATJI-UHFFFAOYSA-N 2 1 385.556 3.044 20 0 GGADMP Cc1nc(CN2CCC[NH+](CC(C)(C)C[N@@H+](C)Cc3ccccc3)CC2)no1 ZINC000127951912 1415881837 /nfs/dbraw/zinc/88/18/37/1415881837.db2.gz YXZHTOLHYQATJI-UHFFFAOYSA-N 2 1 385.556 3.044 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC(C[NH+](C)Cc3ccccc3)CC2)C[N@H+]1C1CC1 ZINC000127969284 1415885319 /nfs/dbraw/zinc/88/53/19/1415885319.db2.gz CDZYEZWESHVYKM-GHTZIAJQSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C[NH+]1C1CC1 ZINC000127969284 1415885322 /nfs/dbraw/zinc/88/53/22/1415885322.db2.gz CDZYEZWESHVYKM-GHTZIAJQSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C[NH+]1C1CC1 ZINC000127969284 1415885323 /nfs/dbraw/zinc/88/53/23/1415885323.db2.gz CDZYEZWESHVYKM-GHTZIAJQSA-N 2 1 384.568 3.165 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000127987441 1415888483 /nfs/dbraw/zinc/88/84/83/1415888483.db2.gz OHCUUQXDWDLRDC-ROUUACIJSA-N 2 1 398.576 3.365 20 0 GGADMP C[NH+](C)CCCOc1ccc(CNC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)cc1 ZINC000178203048 1429017525 /nfs/dbraw/zinc/01/75/25/1429017525.db2.gz ZQOLETMTJQPWRX-FQEVSTJZSA-N 2 1 387.568 3.288 20 0 GGADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1 ZINC000128140976 1415922652 /nfs/dbraw/zinc/92/26/52/1415922652.db2.gz MQXKQLFEANYXEP-YJBOKZPZSA-N 2 1 386.565 3.357 20 0 GGADMP O=C(NCc1ccco1)[C@@H]1CCC[N@@H+]1Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000128267691 1415951012 /nfs/dbraw/zinc/95/10/12/1415951012.db2.gz JQELBCLJDYJSGH-QFIPXVFZSA-N 2 1 397.519 3.035 20 0 GGADMP O=C(NCc1ccco1)[C@@H]1CCC[N@H+]1Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000128267691 1415951024 /nfs/dbraw/zinc/95/10/24/1415951024.db2.gz JQELBCLJDYJSGH-QFIPXVFZSA-N 2 1 397.519 3.035 20 0 GGADMP COCCOc1ccc(C[N@@H+]2CC[C@H](CNc3cccc(C)[nH+]3)C2)cc1OC ZINC000128287897 1415955522 /nfs/dbraw/zinc/95/55/22/1415955522.db2.gz MFABLJHLPHAKHM-LJQANCHMSA-N 2 1 385.508 3.358 20 0 GGADMP COCCOc1ccc(C[N@H+]2CC[C@H](CNc3cccc(C)[nH+]3)C2)cc1OC ZINC000128287897 1415955525 /nfs/dbraw/zinc/95/55/25/1415955525.db2.gz MFABLJHLPHAKHM-LJQANCHMSA-N 2 1 385.508 3.358 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000128780123 1416067295 /nfs/dbraw/zinc/06/72/95/1416067295.db2.gz PLOXKBGGDZDHIP-IFMALSPDSA-N 2 1 384.568 3.297 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000128780123 1416067305 /nfs/dbraw/zinc/06/73/05/1416067305.db2.gz PLOXKBGGDZDHIP-IFMALSPDSA-N 2 1 384.568 3.297 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000128780123 1416067314 /nfs/dbraw/zinc/06/73/14/1416067314.db2.gz PLOXKBGGDZDHIP-IFMALSPDSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@H](O)COc2cccc3[nH]ccc32)C1 ZINC000128974888 1416117133 /nfs/dbraw/zinc/11/71/33/1416117133.db2.gz AZXMUHMGMBBZDO-AQNXPRMDSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@H](O)COc2cccc3[nH]ccc32)C1 ZINC000128974888 1416117144 /nfs/dbraw/zinc/11/71/44/1416117144.db2.gz AZXMUHMGMBBZDO-AQNXPRMDSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@H](O)COc2cccc3[nH]ccc32)C1 ZINC000128974888 1416117152 /nfs/dbraw/zinc/11/71/52/1416117152.db2.gz AZXMUHMGMBBZDO-AQNXPRMDSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc3[nH]ccc32)C1 ZINC000128974888 1416117164 /nfs/dbraw/zinc/11/71/64/1416117164.db2.gz AZXMUHMGMBBZDO-AQNXPRMDSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@H](NC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)C(C)(C)C[NH+](C)C ZINC000129078872 1416139638 /nfs/dbraw/zinc/13/96/38/1416139638.db2.gz WKZOTWDQEZKHOA-IRXDYDNUSA-N 2 1 376.545 3.178 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCc3ccc(C[NH+](C)C)cc3)CC2)cs1 ZINC000129136084 1416153742 /nfs/dbraw/zinc/15/37/42/1416153742.db2.gz QAWXJMISSFGHNY-UHFFFAOYSA-N 2 1 386.565 3.042 20 0 GGADMP Cc1c(C(=O)NC[C@@H](c2ccc(C)cc2)[NH+]2CCCC2)cnn1-c1cc[nH+]cc1 ZINC000129358756 1416196454 /nfs/dbraw/zinc/19/64/54/1416196454.db2.gz DYOGWVVQMWLWQQ-QFIPXVFZSA-N 2 1 389.503 3.451 20 0 GGADMP C[C@@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(Cl)c(Cl)c1 ZINC000129588371 1416233158 /nfs/dbraw/zinc/23/31/58/1416233158.db2.gz KYZXBBFDDDEXAD-CYBMUJFWSA-N 2 1 380.323 3.386 20 0 GGADMP C[C@H]1CC[N@@H+](CCCC[NH+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129658934 1416244578 /nfs/dbraw/zinc/24/45/78/1416244578.db2.gz WSEOMDFXEQCRAB-MYGLTJDJSA-N 2 1 384.572 3.326 20 0 GGADMP C[C@H]1CC[NH+](CCCC[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129658934 1416244585 /nfs/dbraw/zinc/24/45/85/1416244585.db2.gz WSEOMDFXEQCRAB-MYGLTJDJSA-N 2 1 384.572 3.326 20 0 GGADMP C[C@H]1CC[NH+](CCCC[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129658934 1416244586 /nfs/dbraw/zinc/24/45/86/1416244586.db2.gz WSEOMDFXEQCRAB-MYGLTJDJSA-N 2 1 384.572 3.326 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)CCOC(c1ccccc1)c1ccccc1 ZINC000129789842 1416263992 /nfs/dbraw/zinc/26/39/92/1416263992.db2.gz YZYGYRSEBVXACD-UHFFFAOYSA-N 2 1 381.564 3.362 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)CC1 ZINC000129881471 1416279264 /nfs/dbraw/zinc/27/92/64/1416279264.db2.gz JRPAYLFJHGJOKL-UHFFFAOYSA-N 2 1 392.547 3.314 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)CC1 ZINC000129881471 1416279268 /nfs/dbraw/zinc/27/92/68/1416279268.db2.gz JRPAYLFJHGJOKL-UHFFFAOYSA-N 2 1 392.547 3.314 20 0 GGADMP O=C1C[C@@H]([NH+]2CCC(CCC[NH+]3CCCC3)CC2)C(=O)N1c1ccccc1F ZINC000130057393 1416309883 /nfs/dbraw/zinc/30/98/83/1416309883.db2.gz AFDXGDDOBBAMBD-HXUWFJFHSA-N 2 1 387.499 3.046 20 0 GGADMP O=C(c1ccco1)N1CCC([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000130252883 1416346623 /nfs/dbraw/zinc/34/66/23/1416346623.db2.gz HONNPPUZADZLAD-UHFFFAOYSA-N 2 1 399.510 3.320 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C[N@H+]1C1CC1 ZINC000130255053 1416347120 /nfs/dbraw/zinc/34/71/20/1416347120.db2.gz BHRYCJULUIGJSK-BAYUQKDNSA-N 2 1 384.568 3.306 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[NH+]1C1CC1 ZINC000130255053 1416347125 /nfs/dbraw/zinc/34/71/25/1416347125.db2.gz BHRYCJULUIGJSK-BAYUQKDNSA-N 2 1 384.568 3.306 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[NH+]1C1CC1 ZINC000130255053 1416347131 /nfs/dbraw/zinc/34/71/31/1416347131.db2.gz BHRYCJULUIGJSK-BAYUQKDNSA-N 2 1 384.568 3.306 20 0 GGADMP c1ccc(COc2ccccc2C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)nc1 ZINC000130352559 1416363341 /nfs/dbraw/zinc/36/33/41/1416363341.db2.gz IPOVYHQZLCDFRA-LJQANCHMSA-N 2 1 381.520 3.251 20 0 GGADMP CCCOc1ccc(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1OCC ZINC000130387092 1416368887 /nfs/dbraw/zinc/36/88/87/1416368887.db2.gz QUWRKROJSTWANJ-IBGZPJMESA-N 2 1 376.541 3.465 20 0 GGADMP c1cc(COc2ccc(C[NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)cc2)ccn1 ZINC000130402776 1416372206 /nfs/dbraw/zinc/37/22/06/1416372206.db2.gz IUPBSVACPUPRBO-OAQYLSRUSA-N 2 1 381.520 3.251 20 0 GGADMP CC[C@H](C)Oc1cc(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)ccc1OC ZINC000130405420 1416372517 /nfs/dbraw/zinc/37/25/17/1416372517.db2.gz SLPMHHYEVLMMKQ-HKUYNNGSSA-N 2 1 376.541 3.463 20 0 GGADMP C[NH+](C)C[C@H]1CCN(C(=O)NC[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)C1 ZINC000130480873 1416385211 /nfs/dbraw/zinc/38/52/11/1416385211.db2.gz GURZXWGTIDHHJU-OGWOLHLISA-N 2 1 396.938 3.065 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[N@@H+]1CCC[C@H](C)C1 ZINC000130671062 1416422269 /nfs/dbraw/zinc/42/22/69/1416422269.db2.gz ZHTAVFZFSKKHPQ-ROUUACIJSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[N@H+]1CCC[C@H](C)C1 ZINC000130671062 1416422270 /nfs/dbraw/zinc/42/22/70/1416422270.db2.gz ZHTAVFZFSKKHPQ-ROUUACIJSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@@H](C[NH+]1CCCCC1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000130685762 1416424813 /nfs/dbraw/zinc/42/48/13/1416424813.db2.gz LLJRXDGFZIFILU-KRWDZBQOSA-N 2 1 376.570 3.231 20 0 GGADMP CCCCc1nc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)cs1 ZINC000130685663 1416425011 /nfs/dbraw/zinc/42/50/11/1416425011.db2.gz LKVDVLFSMIWCGF-UHFFFAOYSA-N 2 1 394.629 3.402 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2ccccc2F)C1 ZINC000130790620 1416451666 /nfs/dbraw/zinc/45/16/66/1416451666.db2.gz IGPMNGLSIHECMJ-LJQANCHMSA-N 2 1 392.563 3.267 20 0 GGADMP C[C@H](C(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000130832573 1416462912 /nfs/dbraw/zinc/46/29/12/1416462912.db2.gz XVLRNOSJIYNSJG-LJQANCHMSA-N 2 1 392.547 3.203 20 0 GGADMP C[C@H](C(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000130832573 1416462917 /nfs/dbraw/zinc/46/29/17/1416462917.db2.gz XVLRNOSJIYNSJG-LJQANCHMSA-N 2 1 392.547 3.203 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000130872876 1416472897 /nfs/dbraw/zinc/47/28/97/1416472897.db2.gz QXTLEWFZWGIHKI-GOSISDBHSA-N 2 1 392.450 3.310 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000130872876 1416472905 /nfs/dbraw/zinc/47/29/05/1416472905.db2.gz QXTLEWFZWGIHKI-GOSISDBHSA-N 2 1 392.450 3.310 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)[C@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC000130884437 1416475321 /nfs/dbraw/zinc/47/53/21/1416475321.db2.gz SDGXFKVUKHZFLV-HSZRJFAPSA-N 2 1 395.547 3.046 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC000130884437 1416475329 /nfs/dbraw/zinc/47/53/29/1416475329.db2.gz SDGXFKVUKHZFLV-HSZRJFAPSA-N 2 1 395.547 3.046 20 0 GGADMP CCc1ccc(C[NH+]2CCC(C(=O)NCC[N@@H+](C)Cc3ccccc3)CC2)o1 ZINC000130905342 1416478949 /nfs/dbraw/zinc/47/89/49/1416478949.db2.gz WSSOUHFTIAKOPR-UHFFFAOYSA-N 2 1 383.536 3.302 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@H+](C)CCCn3cc[nH+]c3C)cc(=O)oc2c1 ZINC000130927823 1416483017 /nfs/dbraw/zinc/48/30/17/1416483017.db2.gz CXXXLDWKXNVLBS-UHFFFAOYSA-N 2 1 398.463 3.388 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@@H+](C)CCCn3cc[nH+]c3C)cc(=O)oc2c1 ZINC000130927823 1416483018 /nfs/dbraw/zinc/48/30/18/1416483018.db2.gz CXXXLDWKXNVLBS-UHFFFAOYSA-N 2 1 398.463 3.388 20 0 GGADMP CC[NH+](CC)Cc1ccccc1CNC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000130947245 1416485785 /nfs/dbraw/zinc/48/57/85/1416485785.db2.gz QCBZIOCRAQPSJJ-QHCPKHFHSA-N 2 1 395.547 3.046 20 0 GGADMP CC[NH+](CC)Cc1ccccc1CNC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000130947245 1416485788 /nfs/dbraw/zinc/48/57/88/1416485788.db2.gz QCBZIOCRAQPSJJ-QHCPKHFHSA-N 2 1 395.547 3.046 20 0 GGADMP O=C([C@@H](c1ccccc1)[NH+]1CCSCC1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000131397175 1416550732 /nfs/dbraw/zinc/55/07/32/1416550732.db2.gz KAKZQABBFSUOJY-LEWJYISDSA-N 2 1 387.593 3.253 20 0 GGADMP CC[NH+](CC)CCC[NH2+][C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000131457683 1416560658 /nfs/dbraw/zinc/56/06/58/1416560658.db2.gz XJJZWJKIZDQCOK-SFHVURJKSA-N 2 1 381.586 3.244 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)NCC2CC[NH+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000131650785 1416590802 /nfs/dbraw/zinc/59/08/02/1416590802.db2.gz ZMRJOUSMLJIHNU-QFBILLFUSA-N 2 1 396.938 3.113 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N(CC[NH+](C)C)Cc2ccco2)CC[N@H+]1Cc1ccccc1 ZINC000131699194 1416599512 /nfs/dbraw/zinc/59/95/12/1416599512.db2.gz RPWMWIPZXKTYNX-PZJWPPBQSA-N 2 1 398.551 3.406 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1NC(C)=O ZINC000131925687 1416652865 /nfs/dbraw/zinc/65/28/65/1416652865.db2.gz IIIYBRHCMOEXIM-UHFFFAOYSA-N 2 1 381.520 3.450 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NCc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000132115876 1416699596 /nfs/dbraw/zinc/69/95/96/1416699596.db2.gz RNAOLMYZDVQSSY-UHFFFAOYSA-N 2 1 396.535 3.273 20 0 GGADMP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000132166720 1416710849 /nfs/dbraw/zinc/71/08/49/1416710849.db2.gz GYLMHLJJUUMEHH-KRWDZBQOSA-N 2 1 381.586 3.100 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000132376727 1416748643 /nfs/dbraw/zinc/74/86/43/1416748643.db2.gz MPQGEKFGENFOKT-OAQYLSRUSA-N 2 1 375.532 3.371 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000132376727 1416748651 /nfs/dbraw/zinc/74/86/51/1416748651.db2.gz MPQGEKFGENFOKT-OAQYLSRUSA-N 2 1 375.532 3.371 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCc2ccsc2C1 ZINC000132585994 1416788748 /nfs/dbraw/zinc/78/87/48/1416788748.db2.gz LYQBAXYYFJQRMA-QGZVFWFLSA-N 2 1 383.561 3.276 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCc2ccsc2C1 ZINC000132585994 1416788751 /nfs/dbraw/zinc/78/87/51/1416788751.db2.gz LYQBAXYYFJQRMA-QGZVFWFLSA-N 2 1 383.561 3.276 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCc2ccsc2C1 ZINC000132585780 1416789173 /nfs/dbraw/zinc/78/91/73/1416789173.db2.gz LYQBAXYYFJQRMA-KRWDZBQOSA-N 2 1 383.561 3.276 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCc2ccsc2C1 ZINC000132585780 1416789175 /nfs/dbraw/zinc/78/91/75/1416789175.db2.gz LYQBAXYYFJQRMA-KRWDZBQOSA-N 2 1 383.561 3.276 20 0 GGADMP COc1ccccc1-c1ccc([C@H](C)[NH2+]CCC(=O)N2CC[NH+](C)CC2)cc1 ZINC000178669768 1429134094 /nfs/dbraw/zinc/13/40/94/1429134094.db2.gz HGNKOPCJTCLYLU-SFHVURJKSA-N 2 1 381.520 3.177 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000132861325 1416824418 /nfs/dbraw/zinc/82/44/18/1416824418.db2.gz NVEFXRXRTFUFDA-FHWLQOOXSA-N 2 1 387.572 3.027 20 0 GGADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cnn1-c1ccc(F)cc1 ZINC000132886714 1416827152 /nfs/dbraw/zinc/82/71/52/1416827152.db2.gz FEOSVKXVOAYJDU-SJLPKXTDSA-N 2 1 386.515 3.471 20 0 GGADMP Cc1cccc(N2CCC(NC(=O)NC[C@@H]3CCCC[N@H+]3CC(C)C)CC2)[nH+]1 ZINC000132941438 1416833728 /nfs/dbraw/zinc/83/37/28/1416833728.db2.gz OIVWJRBMPLAFQR-FQEVSTJZSA-N 2 1 387.572 3.169 20 0 GGADMP Cc1cccc(N2CCC(NC(=O)NC[C@@H]3CCCC[N@@H+]3CC(C)C)CC2)[nH+]1 ZINC000132941438 1416833729 /nfs/dbraw/zinc/83/37/29/1416833729.db2.gz OIVWJRBMPLAFQR-FQEVSTJZSA-N 2 1 387.572 3.169 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)[nH+]c1 ZINC000132951835 1416835204 /nfs/dbraw/zinc/83/52/04/1416835204.db2.gz VOUXTLOGNUNAFT-SFHVURJKSA-N 2 1 396.539 3.112 20 0 GGADMP COC(=O)c1ccc(-c2ccc(C[NH2+]C[C@@H](C(C)C)N3CC[NH+](C)CC3)o2)cc1 ZINC000132965534 1416836696 /nfs/dbraw/zinc/83/66/96/1416836696.db2.gz CLZFAOPVFYLRJW-NRFANRHFSA-N 2 1 399.535 3.095 20 0 GGADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCC(=O)N1CC[NH+](C)CC1 ZINC000178667269 1429133243 /nfs/dbraw/zinc/13/32/43/1429133243.db2.gz DRBOZLHSOWMDFB-MRXNPFEDSA-N 2 1 386.565 3.242 20 0 GGADMP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC(=O)N2CC[NH+](C)CC2)CCC3)cc1 ZINC000178668635 1429133427 /nfs/dbraw/zinc/13/34/27/1429133427.db2.gz OHVWDPRWNKWDIK-SFHVURJKSA-N 2 1 398.576 3.250 20 0 GGADMP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000178666812 1429133550 /nfs/dbraw/zinc/13/35/50/1429133550.db2.gz PMSPQLOGFBWEPA-IBGZPJMESA-N 2 1 381.520 3.080 20 0 GGADMP CCCn1nc(C)c(C[NH2+]Cc2ccccc2C[NH+]2CCN(CC)CC2)c1C ZINC000133042433 1416845191 /nfs/dbraw/zinc/84/51/91/1416845191.db2.gz ZZONMAHSYWCAMX-UHFFFAOYSA-N 2 1 383.584 3.337 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)CC[N@H+]1C ZINC000133076622 1416849434 /nfs/dbraw/zinc/84/94/34/1416849434.db2.gz KTPOXKYPUBTGRO-LZQZEXGQSA-N 2 1 385.474 3.151 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000133422727 1416888448 /nfs/dbraw/zinc/88/84/48/1416888448.db2.gz ZFMQNMWOPPYGFW-PGRDOPGGSA-N 2 1 399.583 3.171 20 0 GGADMP Cc1c(C(=O)NC[C@@H]2CCC[N@@H+]2CC2CCCCC2)cnn1-c1cc[nH+]cc1 ZINC000133452790 1416891216 /nfs/dbraw/zinc/89/12/16/1416891216.db2.gz FOCDYVMRIVQBAK-FQEVSTJZSA-N 2 1 381.524 3.350 20 0 GGADMP Cc1c(C(=O)NC[C@@H]2CCC[N@H+]2CC2CCCCC2)cnn1-c1cc[nH+]cc1 ZINC000133452790 1416891221 /nfs/dbraw/zinc/89/12/21/1416891221.db2.gz FOCDYVMRIVQBAK-FQEVSTJZSA-N 2 1 381.524 3.350 20 0 GGADMP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CCC(=O)N2CC[NH+](C)CC2)cc1 ZINC000178669783 1429134431 /nfs/dbraw/zinc/13/44/31/1429134431.db2.gz HGNKOPCJTCLYLU-GOSISDBHSA-N 2 1 381.520 3.177 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CC[C@@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000133834382 1416972510 /nfs/dbraw/zinc/97/25/10/1416972510.db2.gz ZHBRPRWXHFPQSG-IRLDBZIGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000133834382 1416972518 /nfs/dbraw/zinc/97/25/18/1416972518.db2.gz ZHBRPRWXHFPQSG-IRLDBZIGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)C1 ZINC000133834382 1416972525 /nfs/dbraw/zinc/97/25/25/1416972525.db2.gz ZHBRPRWXHFPQSG-IRLDBZIGSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)C1 ZINC000133846062 1416976507 /nfs/dbraw/zinc/97/65/07/1416976507.db2.gz VWEVNNQDXIWBOM-YLJYHZDGSA-N 2 1 393.597 3.070 20 0 GGADMP COC(=O)c1ccccc1-c1ccc(C[NH2+]CC2CCN(CC[NH+](C)C)CC2)o1 ZINC000133899420 1416990798 /nfs/dbraw/zinc/99/07/98/1416990798.db2.gz YRZCAWLWCHDPPS-UHFFFAOYSA-N 2 1 399.535 3.096 20 0 GGADMP COC(=O)c1ccc(-c2ccc(C[NH2+]CC3CCN(CC[NH+](C)C)CC3)o2)cc1 ZINC000133900445 1416991219 /nfs/dbraw/zinc/99/12/19/1416991219.db2.gz AHIPKVFPJIZEMF-UHFFFAOYSA-N 2 1 399.535 3.096 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000134040060 1417013364 /nfs/dbraw/zinc/01/33/64/1417013364.db2.gz MCHDILFPPYSIKM-JOCHJYFZSA-N 2 1 386.584 3.450 20 0 GGADMP CC(C)Oc1ccc(CC[C@@H](C)[NH2+]Cc2cnc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000134109024 1417023164 /nfs/dbraw/zinc/02/31/64/1417023164.db2.gz NXTHYUCDAZJMRN-LJQANCHMSA-N 2 1 397.567 3.127 20 0 GGADMP CC(C)Oc1ccc(CC[C@H](C)[NH2+]Cc2cnc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000134109204 1417023361 /nfs/dbraw/zinc/02/33/61/1417023361.db2.gz NXTHYUCDAZJMRN-IBGZPJMESA-N 2 1 397.567 3.127 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)C1 ZINC000134136836 1417027318 /nfs/dbraw/zinc/02/73/18/1417027318.db2.gz NXAANNGKERHJGN-SFTDATJTSA-N 2 1 378.605 3.118 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)C1 ZINC000134137488 1417027869 /nfs/dbraw/zinc/02/78/69/1417027869.db2.gz NXAANNGKERHJGN-NHCUHLMSSA-N 2 1 378.605 3.118 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)NC[C@H](C(C)C)[NH+]2CCOCC2)cc1)C(C)C ZINC000134153807 1417030396 /nfs/dbraw/zinc/03/03/96/1417030396.db2.gz MJKYNYMEBPHVBS-OAQYLSRUSA-N 2 1 375.557 3.004 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC[C@H](C(C)C)[NH+]2CCOCC2)cc1)C(C)C ZINC000134153807 1417030401 /nfs/dbraw/zinc/03/04/01/1417030401.db2.gz MJKYNYMEBPHVBS-OAQYLSRUSA-N 2 1 375.557 3.004 20 0 GGADMP C[C@H](COc1ccc(C(C)(C)C)cc1)[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000134220710 1417039794 /nfs/dbraw/zinc/03/97/94/1417039794.db2.gz SHXGUTFWJXHSLL-GOSISDBHSA-N 2 1 397.567 3.083 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]Cc3ccc(Oc4ccccc4)cc3)cn2)CC1 ZINC000134264871 1417046062 /nfs/dbraw/zinc/04/60/62/1417046062.db2.gz ZJOPFONVAUPIJC-UHFFFAOYSA-N 2 1 389.503 3.311 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+][C@H]3CCCC[C@@H]3Cc3ccccc3)cn2)CC1 ZINC000134277780 1417048837 /nfs/dbraw/zinc/04/88/37/1417048837.db2.gz UPPZTGPOAIICGT-YADHBBJMSA-N 2 1 379.552 3.120 20 0 GGADMP CCCC[C@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(OC)cc1 ZINC000134278701 1417048874 /nfs/dbraw/zinc/04/88/74/1417048874.db2.gz MHFJZAKPQUYDDV-NRFANRHFSA-N 2 1 383.540 3.258 20 0 GGADMP CC(C)COc1ccc(C(C)(C)[NH2+]Cc2cnc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000134299232 1417052206 /nfs/dbraw/zinc/05/22/06/1417052206.db2.gz AYYGSLRYMVFDCI-UHFFFAOYSA-N 2 1 397.567 3.288 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@@H](C)[N@@H+]1CCc2ccccc2C1 ZINC000134498338 1417077217 /nfs/dbraw/zinc/07/72/17/1417077217.db2.gz MNAMXXQYPXRXAG-LJQANCHMSA-N 2 1 392.547 3.132 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@@H](C)[N@H+]1CCc2ccccc2C1 ZINC000134498338 1417077218 /nfs/dbraw/zinc/07/72/18/1417077218.db2.gz MNAMXXQYPXRXAG-LJQANCHMSA-N 2 1 392.547 3.132 20 0 GGADMP CS[C@H]1CCCC[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000134561168 1417087524 /nfs/dbraw/zinc/08/75/24/1417087524.db2.gz GBKMLCSPUTYFBC-FQEVSTJZSA-N 2 1 375.582 3.116 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000134630409 1417101455 /nfs/dbraw/zinc/10/14/55/1417101455.db2.gz SFIGFUFCYLLHAT-GGPKGHCWSA-N 2 1 398.551 3.338 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134879441 1417138711 /nfs/dbraw/zinc/13/87/11/1417138711.db2.gz JYCPHTHWAFMFGY-NZRJUOQRSA-N 2 1 384.564 3.390 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134879441 1417138713 /nfs/dbraw/zinc/13/87/13/1417138713.db2.gz JYCPHTHWAFMFGY-NZRJUOQRSA-N 2 1 384.564 3.390 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134879441 1417138718 /nfs/dbraw/zinc/13/87/18/1417138718.db2.gz JYCPHTHWAFMFGY-NZRJUOQRSA-N 2 1 384.564 3.390 20 0 GGADMP O=C(CC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)NCc1ccccc1Cl ZINC000134888574 1417140051 /nfs/dbraw/zinc/14/00/51/1417140051.db2.gz SKHDHAXHVGGHHP-YLJYHZDGSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)NCc1ccccc1Cl ZINC000134888574 1417140059 /nfs/dbraw/zinc/14/00/59/1417140059.db2.gz SKHDHAXHVGGHHP-YLJYHZDGSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)NCc1ccccc1Cl ZINC000134888574 1417140061 /nfs/dbraw/zinc/14/00/61/1417140061.db2.gz SKHDHAXHVGGHHP-YLJYHZDGSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)NCc1ccccc1Cl ZINC000134888574 1417140064 /nfs/dbraw/zinc/14/00/64/1417140064.db2.gz SKHDHAXHVGGHHP-YLJYHZDGSA-N 2 1 375.944 3.295 20 0 GGADMP Cc1cc(C)c(CCNC(=O)CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(C)c1 ZINC000134904470 1417142359 /nfs/dbraw/zinc/14/23/59/1417142359.db2.gz GIJYTBQRVWGDMQ-OFNKIYASSA-N 2 1 383.580 3.219 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc12 ZINC000134926981 1417146559 /nfs/dbraw/zinc/14/65/59/1417146559.db2.gz DNBJFBSHIYPIHG-DYESRHJHSA-N 2 1 382.504 3.429 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)ccc12 ZINC000134926981 1417146563 /nfs/dbraw/zinc/14/65/63/1417146563.db2.gz DNBJFBSHIYPIHG-DYESRHJHSA-N 2 1 382.504 3.429 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)ccc12 ZINC000134926981 1417146567 /nfs/dbraw/zinc/14/65/67/1417146567.db2.gz DNBJFBSHIYPIHG-DYESRHJHSA-N 2 1 382.504 3.429 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc12 ZINC000134927001 1417146685 /nfs/dbraw/zinc/14/66/85/1417146685.db2.gz DNBJFBSHIYPIHG-UTKZUKDTSA-N 2 1 382.504 3.429 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)ccc12 ZINC000134927001 1417146693 /nfs/dbraw/zinc/14/66/93/1417146693.db2.gz DNBJFBSHIYPIHG-UTKZUKDTSA-N 2 1 382.504 3.429 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)ccc12 ZINC000134927001 1417146698 /nfs/dbraw/zinc/14/66/98/1417146698.db2.gz DNBJFBSHIYPIHG-UTKZUKDTSA-N 2 1 382.504 3.429 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)[NH+](C)C1CC1 ZINC000135653268 1417254388 /nfs/dbraw/zinc/25/43/88/1417254388.db2.gz AWYPVXYCHJLCEE-ZXYWRSMDSA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1)[N@H+](C)C1CC1 ZINC000135653268 1417254400 /nfs/dbraw/zinc/25/44/00/1417254400.db2.gz AWYPVXYCHJLCEE-ZXYWRSMDSA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1)[N@@H+](C)C1CC1 ZINC000135653268 1417254412 /nfs/dbraw/zinc/25/44/12/1417254412.db2.gz AWYPVXYCHJLCEE-ZXYWRSMDSA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C[N@H+]1Cc1ccccc1 ZINC000136170255 1417297734 /nfs/dbraw/zinc/29/77/34/1417297734.db2.gz ZKGLRXRXWLJATD-UWJYYQICSA-N 2 1 398.526 3.350 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)c1 ZINC000136249221 1417305079 /nfs/dbraw/zinc/30/50/79/1417305079.db2.gz NPUKZBKSOFOZBF-UHFFFAOYSA-N 2 1 386.515 3.338 20 0 GGADMP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000136577606 1417328850 /nfs/dbraw/zinc/32/88/50/1417328850.db2.gz WLLHYZFOONTMHO-UHFFFAOYSA-N 2 1 395.551 3.264 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1 ZINC000136586204 1417330216 /nfs/dbraw/zinc/33/02/16/1417330216.db2.gz ZABNOUXSSAPVFJ-XZOQPEGZSA-N 2 1 382.552 3.347 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)ccc1OC(C)C ZINC000136595685 1417330372 /nfs/dbraw/zinc/33/03/72/1417330372.db2.gz LFHWELPRTJTPQG-PMACEKPBSA-N 2 1 376.541 3.340 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)ccc1OC(C)C ZINC000136595720 1417330623 /nfs/dbraw/zinc/33/06/23/1417330623.db2.gz LFHWELPRTJTPQG-WOJBJXKFSA-N 2 1 376.541 3.340 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@@H]1CCCc2sccc21 ZINC000136623630 1417333172 /nfs/dbraw/zinc/33/31/72/1417333172.db2.gz DWHPLMGEFJTLFD-FUHWJXTLSA-N 2 1 378.586 3.183 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)NC1CC[NH+](CCOc2ccc(Cl)cc2)CC1 ZINC000136694656 1417339252 /nfs/dbraw/zinc/33/92/52/1417339252.db2.gz AWGPEQBRXRUHLJ-HXUWFJFHSA-N 2 1 393.959 3.174 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)N2CCC[N@H+](C3CCCC3)CC2)CC1 ZINC000178808630 1429177072 /nfs/dbraw/zinc/17/70/72/1429177072.db2.gz JPLHBMJIIARBMC-LJQANCHMSA-N 2 1 399.583 3.267 20 0 GGADMP CCN(C)C(=O)CC[NH+]1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000136964430 1417358515 /nfs/dbraw/zinc/35/85/15/1417358515.db2.gz GMHXLUPACJTCSL-UHFFFAOYSA-N 2 1 385.474 3.470 20 0 GGADMP CCN(C)C(=O)CC[NH+]1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000136964430 1417358519 /nfs/dbraw/zinc/35/85/19/1417358519.db2.gz GMHXLUPACJTCSL-UHFFFAOYSA-N 2 1 385.474 3.470 20 0 GGADMP Cc1ccc(N2CCC([NH2+][C@H](C)CCCOc3ccccc3C(N)=O)CC2)[nH+]c1 ZINC000137481600 1417388129 /nfs/dbraw/zinc/38/81/29/1417388129.db2.gz CSOYRXFWTTXCDS-GOSISDBHSA-N 2 1 396.535 3.295 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NCC3CC[NH+](Cc4cccs4)CC3)CC[C@@H]21 ZINC000138044773 1417403274 /nfs/dbraw/zinc/40/32/74/1417403274.db2.gz BYNWJMAGDQCLIR-QUCCMNQESA-N 2 1 390.597 3.086 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(C(=O)NCC3CC[NH+](Cc4cccs4)CC3)CC[C@@H]21 ZINC000138044684 1417403451 /nfs/dbraw/zinc/40/34/51/1417403451.db2.gz BYNWJMAGDQCLIR-ICSRJNTNSA-N 2 1 390.597 3.086 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)C[C@@H]2COCCN2C(=O)OC(C)(C)C)C1 ZINC000138912501 1417442212 /nfs/dbraw/zinc/44/22/12/1417442212.db2.gz AULGVFAICONKBE-XUVXKRRUSA-N 2 1 397.604 3.359 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[NH+]1CCC(C)CC1 ZINC000139859288 1417477618 /nfs/dbraw/zinc/47/76/18/1417477618.db2.gz WMERHXXYEXAUKJ-GOSISDBHSA-N 2 1 390.597 3.477 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000178847930 1429193657 /nfs/dbraw/zinc/19/36/57/1429193657.db2.gz HZWMXZSVUWJROW-FQEVSTJZSA-N 2 1 386.584 3.450 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@H](CNC(=O)NC[C@@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000178862526 1429200450 /nfs/dbraw/zinc/20/04/50/1429200450.db2.gz VKXYBZVCBPSPGQ-QZTJIDSGSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000178862526 1429200467 /nfs/dbraw/zinc/20/04/67/1429200467.db2.gz VKXYBZVCBPSPGQ-QZTJIDSGSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)C1 ZINC000178862526 1429200483 /nfs/dbraw/zinc/20/04/83/1429200483.db2.gz VKXYBZVCBPSPGQ-QZTJIDSGSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)C1 ZINC000178862526 1429200505 /nfs/dbraw/zinc/20/05/05/1429200505.db2.gz VKXYBZVCBPSPGQ-QZTJIDSGSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000150736824 1417794753 /nfs/dbraw/zinc/79/47/53/1417794753.db2.gz KHQKDOJTWLBODI-IRLDBZIGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000150736824 1417794755 /nfs/dbraw/zinc/79/47/55/1417794755.db2.gz KHQKDOJTWLBODI-IRLDBZIGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000150736824 1417794759 /nfs/dbraw/zinc/79/47/59/1417794759.db2.gz KHQKDOJTWLBODI-IRLDBZIGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)C1 ZINC000150746039 1417796302 /nfs/dbraw/zinc/79/63/02/1417796302.db2.gz IXESIPMKEDIQKN-GOSISDBHSA-N 2 1 396.526 3.016 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCC2)CC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000178883011 1429210577 /nfs/dbraw/zinc/21/05/77/1429210577.db2.gz KQCUQLBSQJIHPO-SIKLNZKXSA-N 2 1 388.600 3.299 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C1 ZINC000150762563 1417802036 /nfs/dbraw/zinc/80/20/36/1417802036.db2.gz SRHNTUGMGOOWOT-IBGZPJMESA-N 2 1 394.991 3.391 20 0 GGADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(S(=O)(=O)C(F)F)c(OC)c2)C1 ZINC000151122064 1417876765 /nfs/dbraw/zinc/87/67/65/1417876765.db2.gz KWEHQAOHUQEYJS-UONOGXRCSA-N 2 1 390.496 3.074 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(S(=O)(=O)C(F)F)c(OC)c2)C1 ZINC000151122064 1417876767 /nfs/dbraw/zinc/87/67/67/1417876767.db2.gz KWEHQAOHUQEYJS-UONOGXRCSA-N 2 1 390.496 3.074 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCc2nc3ccccc3c(=O)[nH]2)CC1 ZINC000151139209 1417880390 /nfs/dbraw/zinc/88/03/90/1417880390.db2.gz GMEBMHQXJIPTJP-GOSISDBHSA-N 2 1 382.552 3.442 20 0 GGADMP Cc1cccn2c(=O)cc(C[NH+]3CCC(CC[N@@H+]4CCCC[C@H]4C)CC3)nc12 ZINC000151148223 1417882435 /nfs/dbraw/zinc/88/24/35/1417882435.db2.gz VBHKCODXJLYABF-LJQANCHMSA-N 2 1 382.552 3.479 20 0 GGADMP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CCC[NH+]2CCC(O)CC2)cc1 ZINC000151354382 1417934207 /nfs/dbraw/zinc/93/42/07/1417934207.db2.gz BCVGQFHCBKJUNU-KRWDZBQOSA-N 2 1 376.545 3.058 20 0 GGADMP COc1ccc(C[C@@H]([NH2+]CCC[NH+]2CCC(O)CC2)c2ccc(OC)cc2)cc1 ZINC000151363798 1417937150 /nfs/dbraw/zinc/93/71/50/1417937150.db2.gz QOSDDELKVYBRQS-XMMPIXPASA-N 2 1 398.547 3.424 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)[C@H](c1ccccc1)[NH+]1CCC(O)CC1)CC(C)C ZINC000151391688 1417946671 /nfs/dbraw/zinc/94/66/71/1417946671.db2.gz PFZYGJOXAQHZDQ-UNMCSNQZSA-N 2 1 389.584 3.057 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(F)c4cccnc34)cc2)CC1 ZINC000151399492 1417949668 /nfs/dbraw/zinc/94/96/68/1417949668.db2.gz QSMHWZGKRMUIPT-UHFFFAOYSA-N 2 1 378.495 3.411 20 0 GGADMP CC[C@@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000151488604 1418000648 /nfs/dbraw/zinc/00/06/48/1418000648.db2.gz XEMONXXOOICZOS-DHIUTWEWSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000151488604 1418000658 /nfs/dbraw/zinc/00/06/58/1418000658.db2.gz XEMONXXOOICZOS-DHIUTWEWSA-N 2 1 395.547 3.158 20 0 GGADMP O=C(NC[C@H](c1ccco1)N1CCCCC1)N1CC[C@@H](Oc2ccncc2)C1 ZINC000151649581 1418049752 /nfs/dbraw/zinc/04/97/52/1418049752.db2.gz QBQRZHWACQYOAJ-RTBURBONSA-N 2 1 384.480 3.065 20 0 GGADMP C[C@H]1CCN(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)C[C@@H]1n1ccnc1 ZINC000151650108 1418049779 /nfs/dbraw/zinc/04/97/79/1418049779.db2.gz WKVSQCDWSZFTMW-FHWLQOOXSA-N 2 1 385.512 3.296 20 0 GGADMP C[C@@H]1CCN(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)C[C@H]1n1ccnc1 ZINC000151650179 1418050046 /nfs/dbraw/zinc/05/00/46/1418050046.db2.gz WKVSQCDWSZFTMW-CEXWTWQISA-N 2 1 385.512 3.296 20 0 GGADMP O=C(NC[C@H](c1ccco1)N1CCCCC1)N1CC[C@H](Oc2ccncc2)C1 ZINC000151649422 1418050213 /nfs/dbraw/zinc/05/02/13/1418050213.db2.gz QBQRZHWACQYOAJ-RBUKOAKNSA-N 2 1 384.480 3.065 20 0 GGADMP CC[N@@H+](CC(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCCC2)cc1)C1CC1 ZINC000152052038 1418130839 /nfs/dbraw/zinc/13/08/39/1418130839.db2.gz YVLYJXLVUYQAFK-UHFFFAOYSA-N 2 1 386.540 3.314 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)C1 ZINC000152071974 1418137636 /nfs/dbraw/zinc/13/76/36/1418137636.db2.gz GQYBVWUZETWVKM-OALUTQOASA-N 2 1 387.572 3.027 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)CC2)[nH+]c1 ZINC000178993413 1429237393 /nfs/dbraw/zinc/23/73/93/1429237393.db2.gz QBHDCLPDNQVKJY-TZIWHRDSSA-N 2 1 382.552 3.082 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)CC2)[nH+]c1 ZINC000178993413 1429237419 /nfs/dbraw/zinc/23/74/19/1429237419.db2.gz QBHDCLPDNQVKJY-TZIWHRDSSA-N 2 1 382.552 3.082 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000179011037 1429241947 /nfs/dbraw/zinc/24/19/47/1429241947.db2.gz RUKCJYKJMIQXHO-KKXNLOMOSA-N 2 1 375.561 3.170 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)CC2)[nH+]c1 ZINC000178993426 1429237456 /nfs/dbraw/zinc/23/74/56/1429237456.db2.gz QBHDCLPDNQVKJY-CTNGQTDRSA-N 2 1 382.552 3.082 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)CC2)[nH+]c1 ZINC000178993426 1429237460 /nfs/dbraw/zinc/23/74/60/1429237460.db2.gz QBHDCLPDNQVKJY-CTNGQTDRSA-N 2 1 382.552 3.082 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NCCC[NH+]2C[C@@H](C)C[C@H](C)C2)C1 ZINC000152195503 1418170280 /nfs/dbraw/zinc/17/02/80/1418170280.db2.gz ZUUUBPDIPLHWAE-GBESFXJTSA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NC[C@H](C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000152304211 1418199280 /nfs/dbraw/zinc/19/92/80/1418199280.db2.gz FXIIGWIUEOFTMA-RXVVDRJESA-N 2 1 395.551 3.239 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)C1 ZINC000152304211 1418199283 /nfs/dbraw/zinc/19/92/83/1418199283.db2.gz FXIIGWIUEOFTMA-RXVVDRJESA-N 2 1 395.551 3.239 20 0 GGADMP O=C1C[C@@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000179061969 1429252271 /nfs/dbraw/zinc/25/22/71/1429252271.db2.gz RQRKURDFGLNUDQ-QFIPXVFZSA-N 2 1 377.532 3.289 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(Cl)nc1 ZINC000179123668 1429269499 /nfs/dbraw/zinc/26/94/99/1429269499.db2.gz LZFOSUABJNRBRM-BEFAXECRSA-N 2 1 386.927 3.283 20 0 GGADMP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CCS(=O)(=O)c1ccccc1 ZINC000179389531 1429354526 /nfs/dbraw/zinc/35/45/26/1429354526.db2.gz MPKNUKXLUBLVJS-UHFFFAOYSA-N 2 1 387.549 3.094 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CCS(=O)(=O)c1ccccc1 ZINC000179389531 1429354533 /nfs/dbraw/zinc/35/45/33/1429354533.db2.gz MPKNUKXLUBLVJS-UHFFFAOYSA-N 2 1 387.549 3.094 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1F)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179391753 1429356090 /nfs/dbraw/zinc/35/60/90/1429356090.db2.gz RWDNENSKUNTWOU-GOSISDBHSA-N 2 1 398.526 3.464 20 0 GGADMP C[C@H](C(=O)NCc1ccc(F)cc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179392437 1429356252 /nfs/dbraw/zinc/35/62/52/1429356252.db2.gz UODYUCODAWEFRK-GOSISDBHSA-N 2 1 398.526 3.464 20 0 GGADMP CC(C)n1nccc1NC(=O)[C@H](C)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179393239 1429356798 /nfs/dbraw/zinc/35/67/98/1429356798.db2.gz YZJXIBQACGNLFF-SFHVURJKSA-N 2 1 398.555 3.425 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H](O)COc1ccc(F)cc1 ZINC000179396743 1429358157 /nfs/dbraw/zinc/35/81/57/1429358157.db2.gz YYISDOOTRLZLGD-NRFANRHFSA-N 2 1 387.499 3.199 20 0 GGADMP CC(=O)c1ccc(NC(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000179396295 1429358295 /nfs/dbraw/zinc/35/82/95/1429358295.db2.gz TYYLGDSFNQHIHE-UHFFFAOYSA-N 2 1 394.519 3.461 20 0 GGADMP CC(=O)c1ccc(NC(=O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000179396295 1429358298 /nfs/dbraw/zinc/35/82/98/1429358298.db2.gz TYYLGDSFNQHIHE-UHFFFAOYSA-N 2 1 394.519 3.461 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)Nc1cccnc1Cl ZINC000179396541 1429358416 /nfs/dbraw/zinc/35/84/16/1429358416.db2.gz PDXUFAMIHIFDNQ-UHFFFAOYSA-N 2 1 387.915 3.307 20 0 GGADMP Cc1cc2ncc([C@H](C)[NH2+]Cc3cccc(C[N@@H+]4CCO[C@H](C)C4)c3)c(C)n2n1 ZINC000179407415 1429362623 /nfs/dbraw/zinc/36/26/23/1429362623.db2.gz CEZVATXHIMGLLW-MSOLQXFVSA-N 2 1 393.535 3.418 20 0 GGADMP Cc1cc2ncc([C@H](C)[NH2+]Cc3cccc(C[N@H+]4CCO[C@H](C)C4)c3)c(C)n2n1 ZINC000179407415 1429362632 /nfs/dbraw/zinc/36/26/32/1429362632.db2.gz CEZVATXHIMGLLW-MSOLQXFVSA-N 2 1 393.535 3.418 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1 ZINC000179509928 1429402560 /nfs/dbraw/zinc/40/25/60/1429402560.db2.gz ZURWFJYSONCPPZ-KRWDZBQOSA-N 3 1 379.508 3.367 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000179556930 1429431388 /nfs/dbraw/zinc/43/13/88/1429431388.db2.gz SSPDQAZHGGNCFY-QFIPXVFZSA-N 2 1 396.510 3.218 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000179556930 1429431403 /nfs/dbraw/zinc/43/14/03/1429431403.db2.gz SSPDQAZHGGNCFY-QFIPXVFZSA-N 2 1 396.510 3.218 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000179555624 1429429710 /nfs/dbraw/zinc/42/97/10/1429429710.db2.gz AVBLVYUWYRPDCQ-QFIPXVFZSA-N 2 1 392.547 3.326 20 0 GGADMP CCOC(=O)N1CCC([NH2+]CC2CC[NH+](Cc3csc(CC)n3)CC2)CC1 ZINC000152312459 1422069808 /nfs/dbraw/zinc/06/98/08/1422069808.db2.gz VUWCLAPTOQSDHB-UHFFFAOYSA-N 2 1 394.585 3.128 20 0 GGADMP COC(=O)[C@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)c1cccnc1 ZINC000152329802 1422074588 /nfs/dbraw/zinc/07/45/88/1422074588.db2.gz DCJMNPWGHISKTF-OAQYLSRUSA-N 2 1 382.508 3.186 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](CCc2cccc(F)c2)C2CCCC2)CC1 ZINC000152615545 1422166373 /nfs/dbraw/zinc/16/63/73/1422166373.db2.gz FMEFTLCBIKRTRI-UHFFFAOYSA-N 2 1 375.532 3.213 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000152708900 1422218275 /nfs/dbraw/zinc/21/82/75/1422218275.db2.gz ZUIFBNFEQGSDEB-VFUGHAIPSA-N 2 1 376.589 3.298 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N(C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000152769196 1422242129 /nfs/dbraw/zinc/24/21/29/1422242129.db2.gz GYKNJMHFKFGSTL-CEMLEFRQSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000152769196 1422242145 /nfs/dbraw/zinc/24/21/45/1422242145.db2.gz GYKNJMHFKFGSTL-CEMLEFRQSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000152769196 1422242154 /nfs/dbraw/zinc/24/21/54/1422242154.db2.gz GYKNJMHFKFGSTL-CEMLEFRQSA-N 2 1 386.584 3.413 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCN(c3ccc(F)cc3)C2)[C@H](C)C1 ZINC000152781086 1422245892 /nfs/dbraw/zinc/24/58/92/1422245892.db2.gz GNJRZLANMOBFPD-DXIQSLLYSA-N 2 1 377.548 3.379 20 0 GGADMP Cn1cc[nH+]c1CC1CC[NH+](C[C@H](O)Cc2ccccc2C(F)(F)F)CC1 ZINC000152951774 1422305667 /nfs/dbraw/zinc/30/56/67/1422305667.db2.gz DNXGIMJYHMOBMF-QGZVFWFLSA-N 2 1 381.442 3.297 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCN(CC(F)(F)F)CC3)c2)CCO1 ZINC000153462595 1422550049 /nfs/dbraw/zinc/55/00/49/1422550049.db2.gz GVCMZJRNYHWTTN-INIZCTEOSA-N 2 1 385.474 3.024 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCN(CC(F)(F)F)CC3)c2)CCO1 ZINC000153462595 1422550054 /nfs/dbraw/zinc/55/00/54/1422550054.db2.gz GVCMZJRNYHWTTN-INIZCTEOSA-N 2 1 385.474 3.024 20 0 GGADMP Cc1cc(-c2nnc(C[NH+]3CCC(C[NH+]4C[C@H](C)O[C@@H](C)C4)CC3)o2)c(C)o1 ZINC000153461505 1422550180 /nfs/dbraw/zinc/55/01/80/1422550180.db2.gz ULIKHPLKLUDNAN-HOTGVXAUSA-N 2 1 388.512 3.268 20 0 GGADMP CC[N@H+]1CCCN(C(=O)NC[C@@H]2CC[NH+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000153565234 1422619490 /nfs/dbraw/zinc/61/94/90/1422619490.db2.gz VRZLCGLRWGOGQA-QFBILLFUSA-N 2 1 396.938 3.209 20 0 GGADMP CC[NH+]1CCCN(C(=O)NC[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000153565234 1422619497 /nfs/dbraw/zinc/61/94/97/1422619497.db2.gz VRZLCGLRWGOGQA-QFBILLFUSA-N 2 1 396.938 3.209 20 0 GGADMP CC[NH+]1CCCN(C(=O)NC[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000153565234 1422619504 /nfs/dbraw/zinc/61/95/04/1422619504.db2.gz VRZLCGLRWGOGQA-QFBILLFUSA-N 2 1 396.938 3.209 20 0 GGADMP O=C(c1ccc(C[NH+]2CCSCC2)cc1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000153652950 1422678522 /nfs/dbraw/zinc/67/85/22/1422678522.db2.gz BIBZJXKEEMLWCL-RBBKRZOGSA-N 2 1 399.604 3.324 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccc(-n3cnnn3)cc2)cc1F ZINC000153728832 1422726555 /nfs/dbraw/zinc/72/65/55/1422726555.db2.gz RIOWOGNEZOVNON-CQSZACIVSA-N 2 1 377.427 3.146 20 0 GGADMP O=C([C@H]1C[N@H+](Cc2ccccc2)CCO1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000153917791 1422810331 /nfs/dbraw/zinc/81/03/31/1422810331.db2.gz OZCOTWWSZWMQDL-HSZRJFAPSA-N 2 1 399.579 3.002 20 0 GGADMP O=C([C@H]1C[N@@H+](Cc2ccccc2)CCO1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000153917791 1422810333 /nfs/dbraw/zinc/81/03/33/1422810333.db2.gz OZCOTWWSZWMQDL-HSZRJFAPSA-N 2 1 399.579 3.002 20 0 GGADMP O=C([C@@H]1C[N@H+](Cc2ccccc2)CCO1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000153917661 1422810345 /nfs/dbraw/zinc/81/03/45/1422810345.db2.gz OZCOTWWSZWMQDL-QHCPKHFHSA-N 2 1 399.579 3.002 20 0 GGADMP O=C([C@@H]1C[N@@H+](Cc2ccccc2)CCO1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000153917661 1422810347 /nfs/dbraw/zinc/81/03/47/1422810347.db2.gz OZCOTWWSZWMQDL-QHCPKHFHSA-N 2 1 399.579 3.002 20 0 GGADMP CC[N@@H+](CC(=O)Nc1c(C)cnn1[C@H]1CC[NH+](Cc2ccccc2)C1)C1CC1 ZINC000154054547 1422832476 /nfs/dbraw/zinc/83/24/76/1422832476.db2.gz SYQRJOFTMMBGAJ-FQEVSTJZSA-N 2 1 381.524 3.061 20 0 GGADMP CC[NH+](CC(=O)Nc1c(C)cnn1[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CC1 ZINC000154054547 1422832479 /nfs/dbraw/zinc/83/24/79/1422832479.db2.gz SYQRJOFTMMBGAJ-FQEVSTJZSA-N 2 1 381.524 3.061 20 0 GGADMP CC[NH+](CC(=O)Nc1c(C)cnn1[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000154054547 1422832480 /nfs/dbraw/zinc/83/24/80/1422832480.db2.gz SYQRJOFTMMBGAJ-FQEVSTJZSA-N 2 1 381.524 3.061 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000154089647 1422839153 /nfs/dbraw/zinc/83/91/53/1422839153.db2.gz BPAPXLZQKJFJCQ-GOSISDBHSA-N 2 1 376.545 3.150 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@H]3CCCC[N@H+]3CC(C)C)CC2)cs1 ZINC000154148512 1422846810 /nfs/dbraw/zinc/84/68/10/1422846810.db2.gz LJNNNQLGNSENLB-HXUWFJFHSA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@H]3CCCC[N@@H+]3CC(C)C)CC2)cs1 ZINC000154148512 1422846812 /nfs/dbraw/zinc/84/68/12/1422846812.db2.gz LJNNNQLGNSENLB-HXUWFJFHSA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nccn1C[C@@H](C)CNC(=O)N1CCC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000154370387 1422879875 /nfs/dbraw/zinc/87/98/75/1422879875.db2.gz RJVWKOJGPVAXST-OALUTQOASA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000154370387 1422879878 /nfs/dbraw/zinc/87/98/78/1422879878.db2.gz RJVWKOJGPVAXST-OALUTQOASA-N 2 1 383.540 3.134 20 0 GGADMP CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000154381746 1422881201 /nfs/dbraw/zinc/88/12/01/1422881201.db2.gz DVRRYKYDTFFJKM-QHCPKHFHSA-N 2 1 392.547 3.421 20 0 GGADMP C[C@@H]([NH2+]C1(CNC(=O)C[N@@H+](C)[C@@H]2CCSC2)CCCC1)c1ccccc1 ZINC000154508177 1422898243 /nfs/dbraw/zinc/89/82/43/1422898243.db2.gz XYRGTWJNFCZURU-IEBWSBKVSA-N 2 1 375.582 3.204 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[NH+](C4CCCCC4)CC3)cc2)C[C@@H](C)O1 ZINC000154593258 1422950976 /nfs/dbraw/zinc/95/09/76/1422950976.db2.gz WCLIVONPZOAPIT-WOJBJXKFSA-N 2 1 399.579 3.386 20 0 GGADMP CN(C)Cc1ccc(CNC(=O)[C@H]2CCCN2Cc2ccc(F)cc2)cc1F ZINC000154640791 1422977326 /nfs/dbraw/zinc/97/73/26/1422977326.db2.gz IMUIHPRZMIYTNB-OAQYLSRUSA-N 2 1 387.474 3.307 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCN1CCN(c2ccccc2Cl)CC1 ZINC000154660919 1422989132 /nfs/dbraw/zinc/98/91/32/1422989132.db2.gz XXMPOCQDWVNRLT-WSTZPKSXSA-N 2 1 378.992 3.170 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCC(=O)Nc3ccc4c(c3)OCO4)C2)CC1 ZINC000154709754 1423008662 /nfs/dbraw/zinc/00/86/62/1423008662.db2.gz PXQFBEAKFYKPLA-GOSISDBHSA-N 2 1 387.524 3.188 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCC(=O)NC(=O)Nc3ccccc3)C2)CC1 ZINC000154742280 1423018697 /nfs/dbraw/zinc/01/86/97/1423018697.db2.gz WUUJDHIGTMDYFM-IBGZPJMESA-N 2 1 386.540 3.169 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCNC(=O)c2cccc(O)c2)cc1 ZINC000155061272 1423140933 /nfs/dbraw/zinc/14/09/33/1423140933.db2.gz MDBIBFLSXMLPNG-INIZCTEOSA-N 2 1 378.476 3.357 20 0 GGADMP O=C1CN(c2ccccc2)C(=O)N1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000155083473 1423152796 /nfs/dbraw/zinc/15/27/96/1423152796.db2.gz MJGKJCGNMURVFY-UHFFFAOYSA-N 2 1 384.524 3.001 20 0 GGADMP CCN(CC)[C@H](CNC(=O)C[C@H]1CN(Cc2ccccc2)CCO1)c1ccco1 ZINC000155411693 1423353167 /nfs/dbraw/zinc/35/31/67/1423353167.db2.gz RHDWLSVVHNWJPP-LEWJYISDSA-N 2 1 399.535 3.070 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000155599797 1423438416 /nfs/dbraw/zinc/43/84/16/1423438416.db2.gz PQQJIJZPVMTWLG-RBUKOAKNSA-N 2 1 392.547 3.170 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000155599797 1423438429 /nfs/dbraw/zinc/43/84/29/1423438429.db2.gz PQQJIJZPVMTWLG-RBUKOAKNSA-N 2 1 392.547 3.170 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H](C)[N@@H+]2CCc3ccccc3C2)CC1 ZINC000155600032 1423439431 /nfs/dbraw/zinc/43/94/31/1423439431.db2.gz PQQJIJZPVMTWLG-OALUTQOASA-N 2 1 392.547 3.170 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H](C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000155600032 1423439440 /nfs/dbraw/zinc/43/94/40/1423439440.db2.gz PQQJIJZPVMTWLG-OALUTQOASA-N 2 1 392.547 3.170 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC000155619330 1423450238 /nfs/dbraw/zinc/45/02/38/1423450238.db2.gz CGVUYZOKSYEPQE-QUCCMNQESA-N 2 1 384.568 3.378 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]C3CCC4(CC3)OCCO4)CC2)cs1 ZINC000155785833 1423533706 /nfs/dbraw/zinc/53/37/06/1423533706.db2.gz MHLUJNBNMCFFKE-UHFFFAOYSA-N 2 1 379.570 3.193 20 0 GGADMP C[C@H]1C[C@@H](N(C)C(=O)NC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000155793454 1423536738 /nfs/dbraw/zinc/53/67/38/1423536738.db2.gz FTDUKCZZFLUKPU-AVRDEDQJSA-N 2 1 384.568 3.308 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)NC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000155793330 1423537131 /nfs/dbraw/zinc/53/71/31/1423537131.db2.gz FTDUKCZZFLUKPU-GCJKJVERSA-N 2 1 384.568 3.308 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]C[C@H](C)[N@@H+]2CCC[C@H](C)C2)c(OC)c1 ZINC000155949444 1423605931 /nfs/dbraw/zinc/60/59/31/1423605931.db2.gz LGOFVAOHPZGFNF-ULQDDVLXSA-N 2 1 377.529 3.131 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]C[C@H](C)[N@H+]2CCC[C@H](C)C2)c(OC)c1 ZINC000155949444 1423605938 /nfs/dbraw/zinc/60/59/38/1423605938.db2.gz LGOFVAOHPZGFNF-ULQDDVLXSA-N 2 1 377.529 3.131 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc([S@@](C)=O)cc3)CC2)cs1 ZINC000156055975 1423654077 /nfs/dbraw/zinc/65/40/77/1423654077.db2.gz XYJBJIQHALVEME-SANMLTNESA-N 2 1 391.606 3.445 20 0 GGADMP C[NH+](C)Cc1cccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)c(Cl)c2)c1 ZINC000156072200 1423660165 /nfs/dbraw/zinc/66/01/65/1423660165.db2.gz MDKLMRCPXZEBOR-UHFFFAOYSA-N 2 1 386.927 3.406 20 0 GGADMP O=C1[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000179972402 1429669575 /nfs/dbraw/zinc/66/95/75/1429669575.db2.gz LFGKBIILQBEWHD-IPMKNSEASA-N 2 1 395.469 3.413 20 0 GGADMP O=C1[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000179972402 1429669586 /nfs/dbraw/zinc/66/95/86/1429669586.db2.gz LFGKBIILQBEWHD-IPMKNSEASA-N 2 1 395.469 3.413 20 0 GGADMP O=C1[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000179972372 1429669826 /nfs/dbraw/zinc/66/98/26/1429669826.db2.gz LFGKBIILQBEWHD-GUDVDZBRSA-N 2 1 395.469 3.413 20 0 GGADMP O=C1[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000179972372 1429669830 /nfs/dbraw/zinc/66/98/30/1429669830.db2.gz LFGKBIILQBEWHD-GUDVDZBRSA-N 2 1 395.469 3.413 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)C1 ZINC000156480974 1423815816 /nfs/dbraw/zinc/81/58/16/1423815816.db2.gz FWJYQGFSOYJNIX-HBMCJLEFSA-N 2 1 378.605 3.404 20 0 GGADMP Cc1cnn(-c2cc[nH+]cc2NC(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000156626163 1423837897 /nfs/dbraw/zinc/83/78/97/1423837897.db2.gz ZJTBWRZUWQMXDD-IBGZPJMESA-N 2 1 375.476 3.426 20 0 GGADMP Cc1cnn(-c2cc[nH+]cc2NC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000156626163 1423837898 /nfs/dbraw/zinc/83/78/98/1423837898.db2.gz ZJTBWRZUWQMXDD-IBGZPJMESA-N 2 1 375.476 3.426 20 0 GGADMP C[C@H]1C[C@@H](N(C)C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000156680801 1423847074 /nfs/dbraw/zinc/84/70/74/1423847074.db2.gz UPQVACTVCLWYEX-VCOUNFBDSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@@H](N(C)C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000156680801 1423847076 /nfs/dbraw/zinc/84/70/76/1423847076.db2.gz UPQVACTVCLWYEX-VCOUNFBDSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@@H](N(C)C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000156680801 1423847083 /nfs/dbraw/zinc/84/70/83/1423847083.db2.gz UPQVACTVCLWYEX-VCOUNFBDSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000156680661 1423847302 /nfs/dbraw/zinc/84/73/02/1423847302.db2.gz UPQVACTVCLWYEX-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000156680661 1423847306 /nfs/dbraw/zinc/84/73/06/1423847306.db2.gz UPQVACTVCLWYEX-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000156680661 1423847308 /nfs/dbraw/zinc/84/73/08/1423847308.db2.gz UPQVACTVCLWYEX-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000156785668 1423864603 /nfs/dbraw/zinc/86/46/03/1423864603.db2.gz BQBDMDYMMWDMGG-DENIHFKCSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000156785373 1423864633 /nfs/dbraw/zinc/86/46/33/1423864633.db2.gz BQBDMDYMMWDMGG-KNQAVFIVSA-N 2 1 384.568 3.093 20 0 GGADMP O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000156791804 1423865878 /nfs/dbraw/zinc/86/58/78/1423865878.db2.gz WOWMRZDZTQQHJO-YADHBBJMSA-N 2 1 384.568 3.311 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000156815243 1423869308 /nfs/dbraw/zinc/86/93/08/1423869308.db2.gz TZYMBBITQKCWLI-FCHUYYIVSA-N 2 1 380.536 3.485 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000156815243 1423869309 /nfs/dbraw/zinc/86/93/09/1423869309.db2.gz TZYMBBITQKCWLI-FCHUYYIVSA-N 2 1 380.536 3.485 20 0 GGADMP COc1ccccc1C[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156893585 1423882020 /nfs/dbraw/zinc/88/20/20/1423882020.db2.gz CRXNRVSKESCNMP-AVRDEDQJSA-N 2 1 395.547 3.113 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4ccccc4C3)c2)C1 ZINC000156903434 1423883093 /nfs/dbraw/zinc/88/30/93/1423883093.db2.gz HSCVGEZPDFUTKZ-XZOQPEGZSA-N 2 1 377.532 3.031 20 0 GGADMP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156911794 1423884969 /nfs/dbraw/zinc/88/49/69/1423884969.db2.gz FWVLCBNMXSOIPA-FHZYATBESA-N 2 1 377.532 3.407 20 0 GGADMP C[C@@H](CSC(C)(C)C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156920515 1423885983 /nfs/dbraw/zinc/88/59/83/1423885983.db2.gz XHWBOCZWMTVOED-LPHOPBHVSA-N 2 1 377.598 3.394 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccnc(Cl)c1 ZINC000156930626 1423888296 /nfs/dbraw/zinc/88/82/96/1423888296.db2.gz OTDOMDXIMMKKMJ-BEFAXECRSA-N 2 1 386.927 3.283 20 0 GGADMP Cc1nc2c(s1)[C@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c1)CCC2 ZINC000156941907 1423890245 /nfs/dbraw/zinc/89/02/45/1423890245.db2.gz DRMXFKNOFUGEIA-RBUKOAKNSA-N 2 1 398.576 3.316 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000156949439 1423892057 /nfs/dbraw/zinc/89/20/57/1423892057.db2.gz CNPAHJPERKAYOI-UWJYYQICSA-N 2 1 381.520 3.243 20 0 GGADMP CC(C)n1cc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cn1 ZINC000156958469 1423893116 /nfs/dbraw/zinc/89/31/16/1423893116.db2.gz SQSSSOKJRUNHFE-PXNSSMCTSA-N 2 1 383.540 3.012 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(N3CCOC3=O)c2)[C@H](C)C1 ZINC000156982790 1423897313 /nfs/dbraw/zinc/89/73/13/1423897313.db2.gz PSURZWVQTGBJQU-LQWHRVPQSA-N 2 1 389.540 3.431 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)[nH+]c1 ZINC000157050517 1423910632 /nfs/dbraw/zinc/91/06/32/1423910632.db2.gz IBZQDWPOGSXNGU-UHFFFAOYSA-N 2 1 387.572 3.490 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(OC)c1 ZINC000157154806 1423939110 /nfs/dbraw/zinc/93/91/10/1423939110.db2.gz GBAPHEUPCMUMAK-PQUYRQHNSA-N 2 1 388.552 3.418 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(OC)c1 ZINC000157154806 1423939116 /nfs/dbraw/zinc/93/91/16/1423939116.db2.gz GBAPHEUPCMUMAK-PQUYRQHNSA-N 2 1 388.552 3.418 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)cc1F ZINC000157716879 1424072902 /nfs/dbraw/zinc/07/29/02/1424072902.db2.gz UMOPCSOPGNXHSI-LJQANCHMSA-N 2 1 399.514 3.480 20 0 GGADMP C(CN1CCC[C@@H]1C[NH+]1CCCCC1)C[N@@H+]1CCC[C@H]1CN1CCCCC1 ZINC000157813414 1424094140 /nfs/dbraw/zinc/09/41/40/1424094140.db2.gz XCTXALRGXARTFV-ZRZAMGCNSA-N 2 1 376.633 3.277 20 0 GGADMP C(CN1CCC[C@@H]1C[NH+]1CCCCC1)C[N@H+]1CCC[C@H]1CN1CCCCC1 ZINC000157813414 1424094142 /nfs/dbraw/zinc/09/41/42/1424094142.db2.gz XCTXALRGXARTFV-ZRZAMGCNSA-N 2 1 376.633 3.277 20 0 GGADMP C(CN1CCC[C@H]1C[NH+]1CCCCC1)C[N@@H+]1CCC[C@@H]1CN1CCCCC1 ZINC000157813414 1424094145 /nfs/dbraw/zinc/09/41/45/1424094145.db2.gz XCTXALRGXARTFV-ZRZAMGCNSA-N 2 1 376.633 3.277 20 0 GGADMP C(CN1CCC[C@H]1C[NH+]1CCCCC1)C[N@H+]1CCC[C@@H]1CN1CCCCC1 ZINC000157813414 1424094148 /nfs/dbraw/zinc/09/41/48/1424094148.db2.gz XCTXALRGXARTFV-ZRZAMGCNSA-N 2 1 376.633 3.277 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)CC1 ZINC000157817764 1424094406 /nfs/dbraw/zinc/09/44/06/1424094406.db2.gz ONGFAACYSQYHPL-FQEVSTJZSA-N 2 1 386.584 3.237 20 0 GGADMP CCOc1cc(F)ccc1NC(=O)N(CC[NH+](C)C)C[C@@H]1CCC[N@H+]1CC ZINC000157970001 1424131599 /nfs/dbraw/zinc/13/15/99/1424131599.db2.gz OCKOFNMLGBVYMP-KRWDZBQOSA-N 2 1 380.508 3.104 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(Cl)c1OC ZINC000158060799 1424153279 /nfs/dbraw/zinc/15/32/79/1424153279.db2.gz FSFHADFZTKFPBR-OAHLLOKOSA-N 2 1 382.936 3.228 20 0 GGADMP CC(C)OCC[NH+]1CCC([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000158063863 1424154479 /nfs/dbraw/zinc/15/44/79/1424154479.db2.gz MSZGYSQOBKQVLD-UHFFFAOYSA-N 2 1 390.528 3.043 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000158099659 1424167385 /nfs/dbraw/zinc/16/73/85/1424167385.db2.gz UETSTTZFSKNODO-UHFFFAOYSA-N 2 1 375.561 3.269 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(C)C)cc1F ZINC000158116065 1424170593 /nfs/dbraw/zinc/17/05/93/1424170593.db2.gz TZZUEXJZYOLSLK-KRWDZBQOSA-N 2 1 394.535 3.493 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+]([C@H]2CCCN(CC(F)(F)F)C2=O)CC1 ZINC000158142775 1424177833 /nfs/dbraw/zinc/17/78/33/1424177833.db2.gz ICRHJDZWXULDRI-IBGZPJMESA-N 2 1 397.485 3.384 20 0 GGADMP Cc1ccc(NC(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)c(OCC[NH+](C)C)c1 ZINC000158149934 1424180182 /nfs/dbraw/zinc/18/01/82/1424180182.db2.gz GVHUOGMVVRYFJZ-LJQANCHMSA-N 2 1 390.572 3.425 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)CC1 ZINC000158197943 1424192306 /nfs/dbraw/zinc/19/23/06/1424192306.db2.gz ZOBXAMOPHMIUBQ-SFHVURJKSA-N 2 1 388.556 3.418 20 0 GGADMP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000158391092 1424242749 /nfs/dbraw/zinc/24/27/49/1424242749.db2.gz GYFUGSPCKGGWRL-AWEZNQCLSA-N 2 1 394.350 3.256 20 0 GGADMP Cc1[nH+]c(N2CCOCC2)ccc1N[C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000180045151 1429711595 /nfs/dbraw/zinc/71/15/95/1429711595.db2.gz DXVCWKPCYCGPPU-KRWDZBQOSA-N 2 1 384.524 3.340 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158457559 1424260621 /nfs/dbraw/zinc/26/06/21/1424260621.db2.gz ZIVVPSRKDVJALF-QUCCMNQESA-N 2 1 388.556 3.355 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000158457840 1424260851 /nfs/dbraw/zinc/26/08/51/1424260851.db2.gz ZIVVPSRKDVJALF-ICSRJNTNSA-N 2 1 388.556 3.355 20 0 GGADMP O=C(NC1CC[NH+](C2CC2)CC1)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000158507891 1424275198 /nfs/dbraw/zinc/27/51/98/1424275198.db2.gz XGBHAQHNJYBEEC-REWPJTCUSA-N 2 1 396.579 3.309 20 0 GGADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000158579351 1424294858 /nfs/dbraw/zinc/29/48/58/1424294858.db2.gz KCPOEHLYFDPMPK-KSZLIROESA-N 2 1 381.586 3.467 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)CC1 ZINC000158611666 1424301743 /nfs/dbraw/zinc/30/17/43/1424301743.db2.gz BEIDCNISIRWLQS-UHFFFAOYSA-N 2 1 390.547 3.308 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)CC1 ZINC000158611666 1424301752 /nfs/dbraw/zinc/30/17/52/1424301752.db2.gz BEIDCNISIRWLQS-UHFFFAOYSA-N 2 1 390.547 3.308 20 0 GGADMP C[C@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000158654307 1424311211 /nfs/dbraw/zinc/31/12/11/1424311211.db2.gz UVQORYCNALGZDI-QRVBRYPASA-N 2 1 393.597 3.245 20 0 GGADMP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000158665873 1424313614 /nfs/dbraw/zinc/31/36/14/1424313614.db2.gz OBMYPBRUTYXLHW-FGTMMUONSA-N 2 1 381.586 3.467 20 0 GGADMP C[C@H]1C[C@H](N(C)C(=O)NCCC2CC[NH+](C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000158978923 1424385758 /nfs/dbraw/zinc/38/57/58/1424385758.db2.gz RYWVAAJLHVOEGI-SIKLNZKXSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H]1C[C@@H](N(C)C(=O)NCCC2CC[NH+](C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000158979187 1424386973 /nfs/dbraw/zinc/38/69/73/1424386973.db2.gz RYWVAAJLHVOEGI-UGKGYDQZSA-N 2 1 386.584 3.413 20 0 GGADMP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCOC)CC2)cc1 ZINC000159034808 1424400945 /nfs/dbraw/zinc/40/09/45/1424400945.db2.gz MQIUVBUGEZSQQB-QGZVFWFLSA-N 2 1 376.545 3.322 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](CN2C[C@@H](c3ccccc3)CC2=O)CC1 ZINC000159871283 1424545672 /nfs/dbraw/zinc/54/56/72/1424545672.db2.gz LCXNCAXFNKNZPU-QFIPXVFZSA-N 2 1 387.568 3.030 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](Cn2c3ccc(Cl)cc3oc2=O)CC1 ZINC000159868817 1424546661 /nfs/dbraw/zinc/54/66/61/1424546661.db2.gz PZBBRDGSZZINKS-UHFFFAOYSA-N 2 1 395.931 3.276 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cn2c3ccc(Cl)cc3oc2=O)CC1 ZINC000159868817 1424546670 /nfs/dbraw/zinc/54/66/70/1424546670.db2.gz PZBBRDGSZZINKS-UHFFFAOYSA-N 2 1 395.931 3.276 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000160578324 1424615431 /nfs/dbraw/zinc/61/54/31/1424615431.db2.gz KIQNRTQFOYNCNR-GOSISDBHSA-N 2 1 395.503 3.326 20 0 GGADMP CN(C(=O)NCCSC(C)(C)C)[C@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000160609697 1424618307 /nfs/dbraw/zinc/61/83/07/1424618307.db2.gz ZZNGRJBUCASNLX-MOPGFXCFSA-N 2 1 398.661 3.497 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cnn(CCC(C)C)c1C ZINC000162030222 1424810334 /nfs/dbraw/zinc/81/03/34/1424810334.db2.gz UYGUCCWLZZRMPO-IBGZPJMESA-N 2 1 392.592 3.117 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(F)c(Cl)c3)c2)C1 ZINC000162078022 1424814263 /nfs/dbraw/zinc/81/42/63/1424814263.db2.gz BFAVUEXKRBQGRF-SFHVURJKSA-N 2 1 389.902 3.466 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)CC2)nc(C)[nH+]1 ZINC000162225029 1424828336 /nfs/dbraw/zinc/82/83/36/1424828336.db2.gz UQHNOVXTBUIRAF-SFHVURJKSA-N 3 1 397.567 3.353 20 0 GGADMP O=C(NCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000162365633 1424842057 /nfs/dbraw/zinc/84/20/57/1424842057.db2.gz ZCHDJDRRNAFJON-UHFFFAOYSA-N 2 1 385.939 3.367 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000162416553 1424848926 /nfs/dbraw/zinc/84/89/26/1424848926.db2.gz ZOUMNFDEGKJUEK-OALUTQOASA-N 2 1 376.545 3.084 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(-n4cncn4)cc3)CC2)oc1C ZINC000162788151 1424890454 /nfs/dbraw/zinc/89/04/54/1424890454.db2.gz ZXTJISDRVYTXPC-QGZVFWFLSA-N 2 1 394.523 3.435 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCC2([NH+]3CCSCC3)CCCCC2)[C@H](C)C1 ZINC000163031839 1424926884 /nfs/dbraw/zinc/92/68/84/1424926884.db2.gz IYHOWYQCUGFXIR-RTWAWAEBSA-N 2 1 397.673 3.465 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(N3CCSCC3)CCCCC2)[C@H](C)C1 ZINC000163031839 1424926890 /nfs/dbraw/zinc/92/68/90/1424926890.db2.gz IYHOWYQCUGFXIR-RTWAWAEBSA-N 2 1 397.673 3.465 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC2(N3CCSCC3)CCCCC2)[C@H](C)C1 ZINC000163031839 1424926897 /nfs/dbraw/zinc/92/68/97/1424926897.db2.gz IYHOWYQCUGFXIR-RTWAWAEBSA-N 2 1 397.673 3.465 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NCC2([NH+]3CCSCC3)CCCCC2)[C@H](C)C1 ZINC000163031952 1424927056 /nfs/dbraw/zinc/92/70/56/1424927056.db2.gz IYHOWYQCUGFXIR-NHCUHLMSSA-N 2 1 397.673 3.465 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(N3CCSCC3)CCCCC2)[C@H](C)C1 ZINC000163031952 1424927061 /nfs/dbraw/zinc/92/70/61/1424927061.db2.gz IYHOWYQCUGFXIR-NHCUHLMSSA-N 2 1 397.673 3.465 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CC2(N3CCSCC3)CCCCC2)[C@H](C)C1 ZINC000163031952 1424927070 /nfs/dbraw/zinc/92/70/70/1424927070.db2.gz IYHOWYQCUGFXIR-NHCUHLMSSA-N 2 1 397.673 3.465 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC[N@@H+]1C ZINC000163038893 1424929086 /nfs/dbraw/zinc/92/90/86/1424929086.db2.gz PFEGTEZZRZOAJY-RXVVDRJESA-N 2 1 397.542 3.120 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC[N@H+]1C ZINC000163038893 1424929095 /nfs/dbraw/zinc/92/90/95/1424929095.db2.gz PFEGTEZZRZOAJY-RXVVDRJESA-N 2 1 397.542 3.120 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccc2)CC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000163239869 1424965311 /nfs/dbraw/zinc/96/53/11/1424965311.db2.gz UZJIGKBXDRRZIT-OFNKIYASSA-N 2 1 396.579 3.309 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccc2)CC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000163239950 1424965446 /nfs/dbraw/zinc/96/54/46/1424965446.db2.gz UZJIGKBXDRRZIT-NZQKXSOJSA-N 2 1 396.579 3.309 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1cncs1 ZINC000163954360 1425061893 /nfs/dbraw/zinc/06/18/93/1425061893.db2.gz CSLNAUFUXNQGTI-MRXNPFEDSA-N 2 1 375.538 3.484 20 0 GGADMP CC[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)[C@@H]1CCOC1 ZINC000163968439 1425064141 /nfs/dbraw/zinc/06/41/41/1425064141.db2.gz ZMLYIQMNBNCOSJ-DENIHFKCSA-N 2 1 376.541 3.081 20 0 GGADMP CCC[NH+]1CCC([NH2+]Cc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)CC1 ZINC000163995592 1425066755 /nfs/dbraw/zinc/06/67/55/1425066755.db2.gz PWBIDICMKGWQLH-SFHVURJKSA-N 2 1 393.597 3.071 20 0 GGADMP O=C([C@H]1Cc2ccccc2CN1)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000164019467 1425068465 /nfs/dbraw/zinc/06/84/65/1425068465.db2.gz XHSOSWCGORJGNE-OAQYLSRUSA-N 2 1 383.923 3.089 20 0 GGADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)CC1 ZINC000164464641 1425114543 /nfs/dbraw/zinc/11/45/43/1425114543.db2.gz BUAHNUWMTBYUNG-KRWDZBQOSA-N 2 1 379.570 3.142 20 0 GGADMP CC(C)(C)OC(=O)N1CC[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000164530792 1425120899 /nfs/dbraw/zinc/12/08/99/1425120899.db2.gz OWAFNNIKOVUGAJ-HXUWFJFHSA-N 2 1 391.531 3.432 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000164590677 1425126195 /nfs/dbraw/zinc/12/61/95/1425126195.db2.gz OZRASJCDHWHEHH-VGOFRKELSA-N 2 1 381.520 3.386 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)NCc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000164590677 1425126210 /nfs/dbraw/zinc/12/62/10/1425126210.db2.gz OZRASJCDHWHEHH-VGOFRKELSA-N 2 1 381.520 3.386 20 0 GGADMP Cc1ccc([C@H](C[NH2+]C2CC[NH+](C3CCCCC3)CC2)N2CCOCC2)o1 ZINC000164600270 1425127131 /nfs/dbraw/zinc/12/71/31/1425127131.db2.gz CRKKFQYEPOFANY-NRFANRHFSA-N 2 1 375.557 3.348 20 0 GGADMP Cc1ccc([C@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)N2CCOCC2)o1 ZINC000164630146 1425130979 /nfs/dbraw/zinc/13/09/79/1425130979.db2.gz XRDKBFXANMPHQS-QHCPKHFHSA-N 2 1 397.563 3.258 20 0 GGADMP CC[NH+](CC)CCOc1ccc(CN[C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1OC ZINC000164923701 1425151922 /nfs/dbraw/zinc/15/19/22/1425151922.db2.gz GSHAJDQTUHCZGL-CMKODMSKSA-N 2 1 377.573 3.234 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)cc1OC ZINC000164923701 1425151932 /nfs/dbraw/zinc/15/19/32/1425151932.db2.gz GSHAJDQTUHCZGL-CMKODMSKSA-N 3 1 377.573 3.234 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1OC ZINC000164923701 1425151938 /nfs/dbraw/zinc/15/19/38/1425151938.db2.gz GSHAJDQTUHCZGL-CMKODMSKSA-N 3 1 377.573 3.234 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)CC2)c1 ZINC000165037663 1425159175 /nfs/dbraw/zinc/15/91/75/1425159175.db2.gz OFXIWVFULMNMIE-UHFFFAOYSA-N 2 1 392.547 3.341 20 0 GGADMP O=C(c1ccoc1)N1CCC([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000165297606 1425174554 /nfs/dbraw/zinc/17/45/54/1425174554.db2.gz QFWIPKSDYZPZJO-FQEVSTJZSA-N 2 1 381.520 3.038 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165338616 1425175022 /nfs/dbraw/zinc/17/50/22/1425175022.db2.gz OYWDBGIAYFVFTE-VTZPFEBOSA-N 2 1 392.591 3.446 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000165342929 1425176510 /nfs/dbraw/zinc/17/65/10/1425176510.db2.gz OECMQKPORDXYMM-ICSRJNTNSA-N 2 1 386.561 3.305 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000165342929 1425176515 /nfs/dbraw/zinc/17/65/15/1425176515.db2.gz OECMQKPORDXYMM-ICSRJNTNSA-N 2 1 386.561 3.305 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1NCc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000165587099 1425186175 /nfs/dbraw/zinc/18/61/75/1425186175.db2.gz FYHOVVDUMSIGBQ-GJYPPUQNSA-N 2 1 398.517 3.276 20 0 GGADMP C[C@@H]1C[C@H](NCc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)CC[N@H+]1C ZINC000165579377 1425186646 /nfs/dbraw/zinc/18/66/46/1425186646.db2.gz HRFHGQVQMILADD-CRAIPNDOSA-N 2 1 384.490 3.030 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](C)c1cccc(F)c1F ZINC000165763132 1425195921 /nfs/dbraw/zinc/19/59/21/1425195921.db2.gz XXEKAJWRRZKGKP-HOTGVXAUSA-N 2 1 382.499 3.083 20 0 GGADMP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1OCC(=O)N1CCCC1 ZINC000166225581 1425208779 /nfs/dbraw/zinc/20/87/79/1425208779.db2.gz BKKLAVOLGIUKLP-ZVDOUQERSA-N 2 1 385.552 3.355 20 0 GGADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1OCC(=O)N1CCCC1 ZINC000166225581 1425208787 /nfs/dbraw/zinc/20/87/87/1425208787.db2.gz BKKLAVOLGIUKLP-ZVDOUQERSA-N 2 1 385.552 3.355 20 0 GGADMP Clc1ccccc1N1CCN(CCC[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000166317763 1425210939 /nfs/dbraw/zinc/21/09/39/1425210939.db2.gz NYFLIZYQNZQXTQ-RBUKOAKNSA-N 2 1 376.976 3.069 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)NCc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000166421829 1425213252 /nfs/dbraw/zinc/21/32/52/1425213252.db2.gz ZKPQLVRTVVVKIQ-JOCHJYFZSA-N 2 1 381.520 3.243 20 0 GGADMP O=C(NCc1ccncc1)Nc1cccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000166603700 1425214592 /nfs/dbraw/zinc/21/45/92/1425214592.db2.gz QJKVYGMXUJVCJT-PZJWPPBQSA-N 2 1 379.508 3.120 20 0 GGADMP O=C(NCc1ccncc1)Nc1cccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000166603700 1425214598 /nfs/dbraw/zinc/21/45/98/1425214598.db2.gz QJKVYGMXUJVCJT-PZJWPPBQSA-N 2 1 379.508 3.120 20 0 GGADMP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000166701507 1425216574 /nfs/dbraw/zinc/21/65/74/1425216574.db2.gz MBNOYFHCUBBFNP-RBUKOAKNSA-N 2 1 396.501 3.174 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)CC[N@@H+]1C ZINC000167889769 1425233409 /nfs/dbraw/zinc/23/34/09/1425233409.db2.gz OOKXBDRUECDWTH-PXNSSMCTSA-N 2 1 398.551 3.014 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)CC[N@H+]1C ZINC000167889769 1425233420 /nfs/dbraw/zinc/23/34/20/1425233420.db2.gz OOKXBDRUECDWTH-PXNSSMCTSA-N 2 1 398.551 3.014 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)CC[N@@H+]1C ZINC000167889557 1425233458 /nfs/dbraw/zinc/23/34/58/1425233458.db2.gz OOKXBDRUECDWTH-FXAWDEMLSA-N 2 1 398.551 3.014 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)CC[N@H+]1C ZINC000167889557 1425233470 /nfs/dbraw/zinc/23/34/70/1425233470.db2.gz OOKXBDRUECDWTH-FXAWDEMLSA-N 2 1 398.551 3.014 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@H]3CCN(c4ncccc4F)C3)CC2)cc1 ZINC000168165392 1425235861 /nfs/dbraw/zinc/23/58/61/1425235861.db2.gz MYFPNGJVTQAUCT-FQEVSTJZSA-N 2 1 386.490 3.235 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@@H]3CCCCCC[C@@H]3[NH3+])CC2)cs1 ZINC000168630337 1425239280 /nfs/dbraw/zinc/23/92/80/1425239280.db2.gz SIAMDQZQNQZAMV-MOPGFXCFSA-N 2 1 392.613 3.331 20 0 GGADMP C[C@H](CC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)[C@@H]1CCC[NH2+]C1 ZINC000168952505 1425240682 /nfs/dbraw/zinc/24/06/82/1425240682.db2.gz ICRQSLNIWHNTGA-SZVBFZGTSA-N 2 1 397.485 3.422 20 0 GGADMP C[C@H](CC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)C1CC[NH2+]CC1 ZINC000168953900 1425241055 /nfs/dbraw/zinc/24/10/55/1425241055.db2.gz NGAUQFHOXTYNCW-BEFAXECRSA-N 2 1 397.485 3.422 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)[nH+]c1 ZINC000170894342 1425383343 /nfs/dbraw/zinc/38/33/43/1425383343.db2.gz HHBPLARWPCZNOS-HXUWFJFHSA-N 2 1 387.572 3.346 20 0 GGADMP CCCO[C@H]1CCC[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000170989147 1425425246 /nfs/dbraw/zinc/42/52/46/1425425246.db2.gz PYXUDXGYVXHSLC-QFIPXVFZSA-N 2 1 387.568 3.180 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)CC1 ZINC000171003237 1425432115 /nfs/dbraw/zinc/43/21/15/1425432115.db2.gz HPLBDGOEVJYGFV-UHFFFAOYSA-N 2 1 386.584 3.209 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC2CC[NH+](CCCOC)CC2)cc1)C(C)C ZINC000171122839 1425493231 /nfs/dbraw/zinc/49/32/31/1425493231.db2.gz YFZMHFGRDBRXBR-UHFFFAOYSA-N 2 1 375.557 3.148 20 0 GGADMP C[NH+](C)Cc1cccc(NC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000171138943 1425502689 /nfs/dbraw/zinc/50/26/89/1425502689.db2.gz UJGWBICMWMUFKG-NRFANRHFSA-N 2 1 380.536 3.434 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000171212133 1425542607 /nfs/dbraw/zinc/54/26/07/1425542607.db2.gz WRWDVUVGGSRXHE-INIZCTEOSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000171212594 1425542662 /nfs/dbraw/zinc/54/26/62/1425542662.db2.gz BVVMNRBVLSIYSC-AEFFLSMTSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000171212594 1425542665 /nfs/dbraw/zinc/54/26/65/1425542665.db2.gz BVVMNRBVLSIYSC-AEFFLSMTSA-N 2 1 389.569 3.101 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CCC(=O)Nc3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000171304579 1425605865 /nfs/dbraw/zinc/60/58/65/1425605865.db2.gz IGGPOXUIFIBKLY-CALCHBBNSA-N 2 1 393.959 3.490 20 0 GGADMP CCc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000171305691 1425607015 /nfs/dbraw/zinc/60/70/15/1425607015.db2.gz LORJHKODUVCHGQ-QRVBRYPASA-N 2 1 387.568 3.397 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NCCCNc1ccc(C)c[nH+]1 ZINC000171307991 1425607713 /nfs/dbraw/zinc/60/77/13/1425607713.db2.gz AMOAVOKITUSSPD-UHFFFAOYSA-N 2 1 383.540 3.485 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000171362688 1425641415 /nfs/dbraw/zinc/64/14/15/1425641415.db2.gz BXCVTISWSBCYJF-AZUAARDMSA-N 2 1 375.561 3.125 20 0 GGADMP Cn1c(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)nc2ccccc2c1=O ZINC000171384652 1425653905 /nfs/dbraw/zinc/65/39/05/1425653905.db2.gz XOMLIGKQLNJKCU-UHFFFAOYSA-N 2 1 390.531 3.278 20 0 GGADMP Cn1c(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)nc2ccccc2c1=O ZINC000171384652 1425653910 /nfs/dbraw/zinc/65/39/10/1425653910.db2.gz XOMLIGKQLNJKCU-UHFFFAOYSA-N 2 1 390.531 3.278 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cccc(OCc4ccccc4)c3)C2)CC1 ZINC000171526731 1425717489 /nfs/dbraw/zinc/71/74/89/1425717489.db2.gz MNRSSHIOYGNUDN-QHCPKHFHSA-N 2 1 379.548 3.477 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000171611968 1425758342 /nfs/dbraw/zinc/75/83/42/1425758342.db2.gz NZCDGWXIXPOFQD-OAQYLSRUSA-N 2 1 386.584 3.113 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000171611974 1425758636 /nfs/dbraw/zinc/75/86/36/1425758636.db2.gz NZCDGWXIXPOFQD-NRFANRHFSA-N 2 1 386.584 3.113 20 0 GGADMP CC1(C)CN(C(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000171644892 1425770297 /nfs/dbraw/zinc/77/02/97/1425770297.db2.gz OOVACSRJIBNMGZ-UHFFFAOYSA-N 2 1 384.568 3.167 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000171662244 1425780177 /nfs/dbraw/zinc/78/01/77/1425780177.db2.gz VMXDKVUANLVJHK-QFIPXVFZSA-N 2 1 386.584 3.318 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@@H+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000172416050 1426033760 /nfs/dbraw/zinc/03/37/60/1426033760.db2.gz NDQDZRVVXJOPFM-PMACEKPBSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@H+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000172416050 1426033769 /nfs/dbraw/zinc/03/37/69/1426033769.db2.gz NDQDZRVVXJOPFM-PMACEKPBSA-N 2 1 399.579 3.386 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH+](CC3CCOCC3)CC2)cc1)C(C)C ZINC000172461103 1426049404 /nfs/dbraw/zinc/04/94/04/1426049404.db2.gz DDCLGKCYRBTSSN-UHFFFAOYSA-N 2 1 387.568 3.101 20 0 GGADMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172514274 1426066776 /nfs/dbraw/zinc/06/67/76/1426066776.db2.gz HBCBXDDCJCULOM-FQEVSTJZSA-N 2 1 388.556 3.467 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)N1CCC[NH+](C2CCCC2)CC1 ZINC000172542610 1426080302 /nfs/dbraw/zinc/08/03/02/1426080302.db2.gz NZLGMTBRLAHLBO-UHFFFAOYSA-N 2 1 384.568 3.095 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000172542610 1426080313 /nfs/dbraw/zinc/08/03/13/1426080313.db2.gz NZLGMTBRLAHLBO-UHFFFAOYSA-N 2 1 384.568 3.095 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172542610 1426080319 /nfs/dbraw/zinc/08/03/19/1426080319.db2.gz NZLGMTBRLAHLBO-UHFFFAOYSA-N 2 1 384.568 3.095 20 0 GGADMP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CCC[N@H+](C3CCCC3)CC2)C1 ZINC000172544365 1426080886 /nfs/dbraw/zinc/08/08/86/1426080886.db2.gz IIADMUGKARGSIR-PMACEKPBSA-N 2 1 378.605 3.404 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@@H+]1CCc2sccc2C1 ZINC000172550469 1426082930 /nfs/dbraw/zinc/08/29/30/1426082930.db2.gz MDUUWDPIZRSPNN-MJGOQNOKSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2sccc2C1 ZINC000172550469 1426082937 /nfs/dbraw/zinc/08/29/37/1426082937.db2.gz MDUUWDPIZRSPNN-MJGOQNOKSA-N 2 1 390.597 3.155 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)c1ccco1 ZINC000172569027 1426091887 /nfs/dbraw/zinc/09/18/87/1426091887.db2.gz NNQIKFVDQBUCME-IBGZPJMESA-N 2 1 376.545 3.322 20 0 GGADMP CCCOc1ccccc1NC(=O)N(CC[NH+](C)C)C[C@H]1CCC[N@H+]1CC ZINC000172655413 1426129658 /nfs/dbraw/zinc/12/96/58/1426129658.db2.gz CRNKCAZSFHHAHS-GOSISDBHSA-N 2 1 376.545 3.355 20 0 GGADMP C(CN1CCC[NH+](C2CCCC2)CC1)CN1CCC[N@H+](C2CCCC2)CC1 ZINC000172659085 1426131118 /nfs/dbraw/zinc/13/11/18/1426131118.db2.gz NIVAMQDRIPRMEA-UHFFFAOYSA-N 2 1 376.633 3.277 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000172694749 1426147211 /nfs/dbraw/zinc/14/72/11/1426147211.db2.gz ISNSWGOCIZZTDV-LJQANCHMSA-N 2 1 384.568 3.167 20 0 GGADMP CC[NH+](CC)CCSCC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000172783828 1426186230 /nfs/dbraw/zinc/18/62/30/1426186230.db2.gz CHMUXDGNCXPOAV-QGZVFWFLSA-N 2 1 379.570 3.093 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000173323579 1426505825 /nfs/dbraw/zinc/50/58/25/1426505825.db2.gz GZKORVOZBUCXRA-JTHBVZDNSA-N 2 1 394.563 3.453 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173325121 1426507173 /nfs/dbraw/zinc/50/71/73/1426507173.db2.gz IBSBIEDMYHNRCT-ROUUACIJSA-N 2 1 381.586 3.100 20 0 GGADMP CCC[NH+]1CCC([N@@H+](C)CCC(=O)Nc2cc(OC)c(Cl)cc2OC)CC1 ZINC000173367721 1426540632 /nfs/dbraw/zinc/54/06/32/1426540632.db2.gz UCUBENFNVWSLRK-UHFFFAOYSA-N 2 1 397.947 3.492 20 0 GGADMP CN(CC1CC[NH+](C)CC1)C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000173414730 1426597056 /nfs/dbraw/zinc/59/70/56/1426597056.db2.gz IDZLUYZWPKLFEP-UHFFFAOYSA-N 2 1 398.551 3.395 20 0 GGADMP CN(CC1CC[NH+](C)CC1)C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000173414730 1426597069 /nfs/dbraw/zinc/59/70/69/1426597069.db2.gz IDZLUYZWPKLFEP-UHFFFAOYSA-N 2 1 398.551 3.395 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000173425656 1426608116 /nfs/dbraw/zinc/60/81/16/1426608116.db2.gz YEYMBYOQCOJFSL-OAQYLSRUSA-N 2 1 383.540 3.135 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000173425656 1426608120 /nfs/dbraw/zinc/60/81/20/1426608120.db2.gz YEYMBYOQCOJFSL-OAQYLSRUSA-N 2 1 383.540 3.135 20 0 GGADMP COc1cccc([C@@H](CNC(=O)NCCCCn2cc[nH+]c2C)[NH+]2CCCC2)c1 ZINC000173426994 1426608491 /nfs/dbraw/zinc/60/84/91/1426608491.db2.gz LGHWYBQGXGSLNK-OAQYLSRUSA-N 2 1 399.539 3.117 20 0 GGADMP Cc1csc(C(C)(C)[NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)n1 ZINC000173426719 1426609031 /nfs/dbraw/zinc/60/90/31/1426609031.db2.gz HPTMDQJTWMRXCQ-UHFFFAOYSA-N 2 1 386.565 3.188 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000173430988 1426611839 /nfs/dbraw/zinc/61/18/39/1426611839.db2.gz PMKNDUYQUGJDBZ-UHFFFAOYSA-N 2 1 383.540 3.457 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cn2ccc(=O)c3cccc(Br)c32)C1 ZINC000173446037 1426625644 /nfs/dbraw/zinc/62/56/44/1426625644.db2.gz INCRHTVDXMADGM-HNNXBMFYSA-N 2 1 392.341 3.385 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cn2ccc(=O)c3cccc(Br)c32)C1 ZINC000173446037 1426625647 /nfs/dbraw/zinc/62/56/47/1426625647.db2.gz INCRHTVDXMADGM-HNNXBMFYSA-N 2 1 392.341 3.385 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cn2ccc(=O)c3cccc(Br)c32)C1 ZINC000173446037 1426625654 /nfs/dbraw/zinc/62/56/54/1426625654.db2.gz INCRHTVDXMADGM-HNNXBMFYSA-N 2 1 392.341 3.385 20 0 GGADMP CC[C@](C)([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1nccs1 ZINC000173500284 1426669670 /nfs/dbraw/zinc/66/96/70/1426669670.db2.gz FPUUTVDFVADOPE-NRFANRHFSA-N 2 1 386.565 3.270 20 0 GGADMP O=C([C@H]1CCCC[N@H+]1Cc1ccccc1)N1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173503326 1426672799 /nfs/dbraw/zinc/67/27/99/1426672799.db2.gz IHGTUJXCRJZXAL-HSZRJFAPSA-N 2 1 399.579 3.145 20 0 GGADMP C[C@@H](CCNC(=O)CC1([NH+]2CCOCC2)CCCC1)[N@@H+](C)Cc1ccccc1 ZINC000173615593 1426794297 /nfs/dbraw/zinc/79/42/97/1426794297.db2.gz SVZSEFGTEOKXFK-FQEVSTJZSA-N 2 1 387.568 3.048 20 0 GGADMP COc1cc(NC(=O)CC[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c(OC)cc1Cl ZINC000173643896 1426808091 /nfs/dbraw/zinc/80/80/91/1426808091.db2.gz SCIADWARPCUUFF-OAHLLOKOSA-N 2 1 397.947 3.492 20 0 GGADMP COc1cc(NC(=O)CC[NH+](C)CC[C@H]2CCCC[N@@H+]2C)c(OC)cc1Cl ZINC000173643896 1426808092 /nfs/dbraw/zinc/80/80/92/1426808092.db2.gz SCIADWARPCUUFF-OAHLLOKOSA-N 2 1 397.947 3.492 20 0 GGADMP COc1cc(NC(=O)CC[NH+](C)CC[C@H]2CCCC[N@H+]2C)c(OC)cc1Cl ZINC000173643896 1426808094 /nfs/dbraw/zinc/80/80/94/1426808094.db2.gz SCIADWARPCUUFF-OAHLLOKOSA-N 2 1 397.947 3.492 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)CC1([NH+]2CCOCC2)CCCC1)c1ccccc1Cl ZINC000173663884 1426813847 /nfs/dbraw/zinc/81/38/47/1426813847.db2.gz VFQQFHOLTRCPTD-LJQANCHMSA-N 2 1 393.959 3.094 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(OC)c1 ZINC000173870431 1426877242 /nfs/dbraw/zinc/87/72/42/1426877242.db2.gz GPURWVWOJANTIQ-UBDMCOMYSA-N 2 1 388.552 3.276 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(OC)c1 ZINC000173870431 1426877244 /nfs/dbraw/zinc/87/72/44/1426877244.db2.gz GPURWVWOJANTIQ-UBDMCOMYSA-N 2 1 388.552 3.276 20 0 GGADMP COc1ccc([C@@H](CNC(=O)NCCCCn2cc[nH+]c2C)[NH+]2CCCC2)cc1 ZINC000173900132 1426884985 /nfs/dbraw/zinc/88/49/85/1426884985.db2.gz UIBCYOLKOSKKRE-OAQYLSRUSA-N 2 1 399.539 3.117 20 0 GGADMP Clc1cccc(-c2nnc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)o2)c1 ZINC000173954634 1426907610 /nfs/dbraw/zinc/90/76/10/1426907610.db2.gz QUJRGWGJDUZGHR-UHFFFAOYSA-N 2 1 390.915 3.467 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CC[NH+](C2CC2)C1 ZINC000173964244 1426913232 /nfs/dbraw/zinc/91/32/32/1426913232.db2.gz QYSWTEDGNFFEOF-LEWJYISDSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000173964244 1426913240 /nfs/dbraw/zinc/91/32/40/1426913240.db2.gz QYSWTEDGNFFEOF-LEWJYISDSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000173964244 1426913247 /nfs/dbraw/zinc/91/32/47/1426913247.db2.gz QYSWTEDGNFFEOF-LEWJYISDSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1cccc(F)c1 ZINC000173974384 1426919862 /nfs/dbraw/zinc/91/98/62/1426919862.db2.gz VHJCCDKOBVXWED-KRWDZBQOSA-N 2 1 385.483 3.337 20 0 GGADMP C[NH+]1CCC(C(=O)NC[C@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CC1 ZINC000173991206 1426929723 /nfs/dbraw/zinc/92/97/23/1426929723.db2.gz UWANETOJIPHYAB-HXUWFJFHSA-N 2 1 383.561 3.306 20 0 GGADMP C[NH+]1CCC(C(=O)NC[C@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CC1 ZINC000173991206 1426929729 /nfs/dbraw/zinc/92/97/29/1426929729.db2.gz UWANETOJIPHYAB-HXUWFJFHSA-N 2 1 383.561 3.306 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000174119183 1427009955 /nfs/dbraw/zinc/00/99/55/1427009955.db2.gz PYEOEXYQJXCAOF-OAQYLSRUSA-N 2 1 390.547 3.306 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)c1ccccc1Cl ZINC000174119556 1427010437 /nfs/dbraw/zinc/01/04/37/1427010437.db2.gz BPGAXQTUATXXNG-QFBILLFUSA-N 2 1 378.948 3.070 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)c1ccccc1Cl ZINC000174119516 1427010528 /nfs/dbraw/zinc/01/05/28/1427010528.db2.gz BPGAXQTUATXXNG-APWZRJJASA-N 2 1 378.948 3.070 20 0 GGADMP CN(C(=O)NC1CC[NH+](CC2CC2)CC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174185268 1427037923 /nfs/dbraw/zinc/03/79/23/1427037923.db2.gz GLYXPUWCCKABNU-JOCHJYFZSA-N 2 1 384.568 3.167 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000174217656 1427056032 /nfs/dbraw/zinc/05/60/32/1427056032.db2.gz IFBKMLUDAIFCEG-RTBURBONSA-N 2 1 390.597 3.087 20 0 GGADMP O=C(C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)Nc1ccc(C(F)(F)F)cc1 ZINC000174240252 1427065020 /nfs/dbraw/zinc/06/50/20/1427065020.db2.gz WYICGZWHCFFBED-UHFFFAOYSA-N 2 1 399.457 3.221 20 0 GGADMP Cc1ccc(Cl)cc1NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174242012 1427065444 /nfs/dbraw/zinc/06/54/44/1427065444.db2.gz YEVOBNCTOSRXAT-UHFFFAOYSA-N 2 1 379.932 3.164 20 0 GGADMP OCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)o1 ZINC000174266768 1427076428 /nfs/dbraw/zinc/07/64/28/1427076428.db2.gz DXRJLMFCYKKQFE-UHFFFAOYSA-N 2 1 391.515 3.384 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174288585 1427087038 /nfs/dbraw/zinc/08/70/38/1427087038.db2.gz MOVRVSLKZRCDQF-NRFANRHFSA-N 2 1 383.540 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174288585 1427087042 /nfs/dbraw/zinc/08/70/42/1427087042.db2.gz MOVRVSLKZRCDQF-NRFANRHFSA-N 2 1 383.540 3.278 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)C1 ZINC000174335566 1427107377 /nfs/dbraw/zinc/10/73/77/1427107377.db2.gz PRGWSZYTNZHMMS-GOSISDBHSA-N 2 1 387.503 3.193 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)C1 ZINC000174335566 1427107380 /nfs/dbraw/zinc/10/73/80/1427107380.db2.gz PRGWSZYTNZHMMS-GOSISDBHSA-N 2 1 387.503 3.193 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)cc1F ZINC000174335783 1427107726 /nfs/dbraw/zinc/10/77/26/1427107726.db2.gz LSGXMKHQPLULQD-SFHVURJKSA-N 2 1 387.503 3.336 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1F ZINC000174335783 1427107733 /nfs/dbraw/zinc/10/77/33/1427107733.db2.gz LSGXMKHQPLULQD-SFHVURJKSA-N 2 1 387.503 3.336 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000174496747 1427183043 /nfs/dbraw/zinc/18/30/43/1427183043.db2.gz LPCHPXIAXZDMBC-RTBURBONSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CC[C@@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC000174496747 1427183049 /nfs/dbraw/zinc/18/30/49/1427183049.db2.gz LPCHPXIAXZDMBC-RTBURBONSA-N 2 1 383.540 3.134 20 0 GGADMP CC[NH+]1CCN(c2ccccc2NC(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000174635733 1427279474 /nfs/dbraw/zinc/27/94/74/1427279474.db2.gz WNRBLLFUMOENHE-FQEVSTJZSA-N 2 1 399.583 3.215 20 0 GGADMP C[C@H](CNC(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1)[NH+](C)C1CC1 ZINC000174734139 1427337894 /nfs/dbraw/zinc/33/78/94/1427337894.db2.gz HLKFZTNBHGKBKL-QGZVFWFLSA-N 2 1 384.524 3.194 20 0 GGADMP C[C@H](CNC(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1)[NH+](C)C1CC1 ZINC000174734139 1427337896 /nfs/dbraw/zinc/33/78/96/1427337896.db2.gz HLKFZTNBHGKBKL-QGZVFWFLSA-N 2 1 384.524 3.194 20 0 GGADMP C[C@H](CNC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1)[N@H+](C)C1CC1 ZINC000174734139 1427337900 /nfs/dbraw/zinc/33/79/00/1427337900.db2.gz HLKFZTNBHGKBKL-QGZVFWFLSA-N 2 1 384.524 3.194 20 0 GGADMP C[C@H](CNC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1)[N@@H+](C)C1CC1 ZINC000174734139 1427337907 /nfs/dbraw/zinc/33/79/07/1427337907.db2.gz HLKFZTNBHGKBKL-QGZVFWFLSA-N 2 1 384.524 3.194 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C3CC[NH+](C(C)C)CC3)CC2)cs1 ZINC000174789375 1427369022 /nfs/dbraw/zinc/36/90/22/1427369022.db2.gz KIHXYMPKCQFOEX-UHFFFAOYSA-N 2 1 392.613 3.154 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCC2([NH+]3CCSCC3)CCCCC2)C1 ZINC000174862477 1427414943 /nfs/dbraw/zinc/41/49/43/1427414943.db2.gz STZCOZPLEAUHOK-IBGZPJMESA-N 2 1 396.645 3.111 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NCC1([NH+]2CCSCC2)CCCCC1 ZINC000174862591 1427415148 /nfs/dbraw/zinc/41/51/48/1427415148.db2.gz FQBTVBSRKNUDNI-UHFFFAOYSA-N 2 1 393.601 3.023 20 0 GGADMP C[NH+]1CCN(c2ccc(NC(=O)[C@H]3CCC[N@@H+]3Cc3ccc(F)cc3)cc2)CC1 ZINC000174900617 1427435065 /nfs/dbraw/zinc/43/50/65/1427435065.db2.gz KJBPWBUTSDCBAR-JOCHJYFZSA-N 2 1 396.510 3.181 20 0 GGADMP C[NH+]1CCN(c2ccc(NC(=O)[C@H]3CCC[N@H+]3Cc3ccc(F)cc3)cc2)CC1 ZINC000174900617 1427435068 /nfs/dbraw/zinc/43/50/68/1427435068.db2.gz KJBPWBUTSDCBAR-JOCHJYFZSA-N 2 1 396.510 3.181 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000175060065 1427525089 /nfs/dbraw/zinc/52/50/89/1427525089.db2.gz CPHFYSRAUSSUNG-HSZRJFAPSA-N 2 1 398.595 3.257 20 0 GGADMP C[C@@H](CCNC(=O)NCc1ccc(C[NH+](C)C)cc1)[N@@H+](C)Cc1ccccc1 ZINC000175202673 1427597489 /nfs/dbraw/zinc/59/74/89/1427597489.db2.gz BQJZNAXRUBQSJU-IBGZPJMESA-N 2 1 382.552 3.458 20 0 GGADMP C[C@H](CCNC(=O)NCc1ccc(C[NH+](C)C)cc1)[N@@H+](C)Cc1ccccc1 ZINC000175202689 1427597529 /nfs/dbraw/zinc/59/75/29/1427597529.db2.gz BQJZNAXRUBQSJU-LJQANCHMSA-N 2 1 382.552 3.458 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)CC1 ZINC000175354876 1427701371 /nfs/dbraw/zinc/70/13/71/1427701371.db2.gz JOWUIAXLMGRJDV-FQEVSTJZSA-N 2 1 386.584 3.413 20 0 GGADMP CCOc1ccc(NC(=O)N(CC[NH+](C)C)C[C@H]2CCC[N@H+]2CC)cc1F ZINC000175404786 1427735683 /nfs/dbraw/zinc/73/56/83/1427735683.db2.gz WDASQGAZGNMXSU-QGZVFWFLSA-N 2 1 380.508 3.104 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000175418376 1427744270 /nfs/dbraw/zinc/74/42/70/1427744270.db2.gz MJBJQHXUSFQLCI-PGRDOPGGSA-N 2 1 384.568 3.213 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]([NH+]2CCCC2)C1 ZINC000175455032 1427762948 /nfs/dbraw/zinc/76/29/48/1427762948.db2.gz LOXUGHGSBXNGLA-NRFANRHFSA-N 2 1 396.535 3.291 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]([NH+]2CCCC2)C1 ZINC000175455032 1427762950 /nfs/dbraw/zinc/76/29/50/1427762950.db2.gz LOXUGHGSBXNGLA-NRFANRHFSA-N 2 1 396.535 3.291 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000175463177 1427768214 /nfs/dbraw/zinc/76/82/14/1427768214.db2.gz ZMPPDYDXZAIBIR-UHFFFAOYSA-N 2 1 383.540 3.278 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCCC[NH+]3C[C@H](C)C[C@@H](C)C3)CC2)[nH+]c1 ZINC000175485142 1427781076 /nfs/dbraw/zinc/78/10/76/1427781076.db2.gz GDWULOYDCDFRQA-RTBURBONSA-N 2 1 387.572 3.026 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)c1ccco1 ZINC000175542028 1427809656 /nfs/dbraw/zinc/80/96/56/1427809656.db2.gz ROQJYDVYUIQBMO-HXUWFJFHSA-N 2 1 384.524 3.188 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175578243 1427820671 /nfs/dbraw/zinc/82/06/71/1427820671.db2.gz GHBSREWNWNNHKI-WIYYLYMNSA-N 2 1 383.540 3.324 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175578243 1427820675 /nfs/dbraw/zinc/82/06/75/1427820675.db2.gz GHBSREWNWNNHKI-WIYYLYMNSA-N 2 1 383.540 3.324 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000175632440 1427838368 /nfs/dbraw/zinc/83/83/68/1427838368.db2.gz STNZSXQEGHTJMS-CEMLEFRQSA-N 2 1 384.568 3.167 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(OC)ccc1Cl ZINC000175671131 1427851494 /nfs/dbraw/zinc/85/14/94/1427851494.db2.gz QKUWSGWJDRVFMC-OAHLLOKOSA-N 2 1 382.936 3.228 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(OC)ccc1Cl ZINC000175671152 1427851517 /nfs/dbraw/zinc/85/15/17/1427851517.db2.gz QKUWSGWJDRVFMC-HNNXBMFYSA-N 2 1 382.936 3.228 20 0 GGADMP C[NH+](C)CCC1CC[NH+](Cc2csc(CNC(=O)c3ccccc3)n2)CC1 ZINC000175683795 1427856173 /nfs/dbraw/zinc/85/61/73/1427856173.db2.gz CMOLCWUTCJHWEP-UHFFFAOYSA-N 2 1 386.565 3.237 20 0 GGADMP O=C(C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000175766421 1427884723 /nfs/dbraw/zinc/88/47/23/1427884723.db2.gz XIBOZMKMZWSTIJ-HSZRJFAPSA-N 2 1 399.579 3.048 20 0 GGADMP O=C(C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000175766421 1427884727 /nfs/dbraw/zinc/88/47/27/1427884727.db2.gz XIBOZMKMZWSTIJ-HSZRJFAPSA-N 2 1 399.579 3.048 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+](C)Cc1ccccc1 ZINC000175816064 1427907283 /nfs/dbraw/zinc/90/72/83/1427907283.db2.gz PYPHHLDCFJGSHQ-HSZRJFAPSA-N 2 1 394.563 3.282 20 0 GGADMP CN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@H+](C)Cc1ccccc1 ZINC000175816064 1427907291 /nfs/dbraw/zinc/90/72/91/1427907291.db2.gz PYPHHLDCFJGSHQ-HSZRJFAPSA-N 2 1 394.563 3.282 20 0 GGADMP CN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000175816064 1427907297 /nfs/dbraw/zinc/90/72/97/1427907297.db2.gz PYPHHLDCFJGSHQ-HSZRJFAPSA-N 2 1 394.563 3.282 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)[nH+]c1 ZINC000175823735 1427912757 /nfs/dbraw/zinc/91/27/57/1427912757.db2.gz FVBVESASCFRQCW-UHFFFAOYSA-N 2 1 395.551 3.498 20 0 GGADMP C[NH+](C)[C@H]1CCC[C@@H](NC(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)C1 ZINC000175923417 1427974452 /nfs/dbraw/zinc/97/44/52/1427974452.db2.gz LKXQTLNVIIKSFD-MSOLQXFVSA-N 2 1 394.510 3.101 20 0 GGADMP C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)C1 ZINC000175923405 1427974703 /nfs/dbraw/zinc/97/47/03/1427974703.db2.gz LKXQTLNVIIKSFD-QZTJIDSGSA-N 2 1 394.510 3.101 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000175971647 1428006149 /nfs/dbraw/zinc/00/61/49/1428006149.db2.gz VFVZZULCFAQKLI-WOJBJXKFSA-N 2 1 386.584 3.413 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000176015764 1428028295 /nfs/dbraw/zinc/02/82/95/1428028295.db2.gz HMQOTIMDUSEVBO-OAQYLSRUSA-N 2 1 376.589 3.205 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(CCSC)cc1 ZINC000176022537 1428031634 /nfs/dbraw/zinc/03/16/34/1428031634.db2.gz BPAFQAYMYNSWPK-FQEVSTJZSA-N 2 1 392.613 3.472 20 0 GGADMP C[NH+](C)CCOc1ccccc1CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000176146358 1428117147 /nfs/dbraw/zinc/11/71/47/1428117147.db2.gz VZNXZSORJDMRNS-NRFANRHFSA-N 2 1 399.510 3.047 20 0 GGADMP C[NH+](C)CCOc1ccccc1CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000176146358 1428117149 /nfs/dbraw/zinc/11/71/49/1428117149.db2.gz VZNXZSORJDMRNS-NRFANRHFSA-N 2 1 399.510 3.047 20 0 GGADMP C[NH+](C)CCOc1ccc(CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)cc1 ZINC000176205184 1428166779 /nfs/dbraw/zinc/16/67/79/1428166779.db2.gz PMFCVFVNOMFAIL-JOCHJYFZSA-N 2 1 399.510 3.047 20 0 GGADMP C[NH+](C)CCOc1ccc(CNC(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)cc1 ZINC000176205184 1428166790 /nfs/dbraw/zinc/16/67/90/1428166790.db2.gz PMFCVFVNOMFAIL-JOCHJYFZSA-N 2 1 399.510 3.047 20 0 GGADMP FC(F)(F)CC[NH+]1CCC(NCC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC000180172495 1429779372 /nfs/dbraw/zinc/77/93/72/1429779372.db2.gz PLYVXQQSHCRKMH-UHFFFAOYSA-N 2 1 377.495 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2C)cn1 ZINC000180176531 1429782457 /nfs/dbraw/zinc/78/24/57/1429782457.db2.gz OARXCHLZSTYINE-QAPCUYQASA-N 2 1 385.512 3.311 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)cn1 ZINC000180176820 1429782732 /nfs/dbraw/zinc/78/27/32/1429782732.db2.gz WEWRNZPAHGWFPD-ROUUACIJSA-N 2 1 385.512 3.359 20 0 GGADMP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1nc2ccc(Cl)cc2n1C ZINC000180210644 1429802740 /nfs/dbraw/zinc/80/27/40/1429802740.db2.gz QAQNAHUXAJAQPG-CQSZACIVSA-N 2 1 387.915 3.413 20 0 GGADMP C[C@H]1CCC[N@@H+](CCNC(=O)N(C)CCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180289531 1429826102 /nfs/dbraw/zinc/82/61/02/1429826102.db2.gz KXXQGCXEIJDGJL-IBGZPJMESA-N 2 1 387.572 3.061 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000180301959 1429830336 /nfs/dbraw/zinc/83/03/36/1429830336.db2.gz ZOHDXCWBFUEBFA-BJLQDIEVSA-N 2 1 388.556 3.369 20 0 GGADMP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)NCC[N@@H+](C)C1CCCC1 ZINC000180350785 1429842907 /nfs/dbraw/zinc/84/29/07/1429842907.db2.gz QPYNYKLULTVWBS-UHFFFAOYSA-N 2 1 387.572 3.204 20 0 GGADMP CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000180665363 1429963908 /nfs/dbraw/zinc/96/39/08/1429963908.db2.gz RVCZBPNWIQCOJW-HXUWFJFHSA-N 2 1 390.597 3.082 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]C2CC(c3ccccc3)C2)c1 ZINC000180708828 1429990574 /nfs/dbraw/zinc/99/05/74/1429990574.db2.gz KMEXMASPTARDNT-UHFFFAOYSA-N 2 1 393.531 3.383 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H](c3cnn(C)c3)c3cccc(F)c3)CC2)nc(C)[nH+]1 ZINC000180724030 1430001749 /nfs/dbraw/zinc/00/17/49/1430001749.db2.gz XSEZFBKXRGGTRW-QFIPXVFZSA-N 2 1 394.498 3.314 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]CC2([NH+]3CCCCC3)CCOCC2)cc1 ZINC000180741270 1430011272 /nfs/dbraw/zinc/01/12/72/1430011272.db2.gz BZRAWYXHCARDNN-GOSISDBHSA-N 2 1 389.540 3.037 20 0 GGADMP O=C([C@@H]1CCC[N@H+]1Cc1ccccc1)N1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000180748406 1430016301 /nfs/dbraw/zinc/01/63/01/1430016301.db2.gz LSVLMCAXUNGMHK-QHCPKHFHSA-N 2 1 399.579 3.002 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)N1CCC(CCC[NH+]2CCOCC2)CC1)c1ccccc1 ZINC000180749000 1430016471 /nfs/dbraw/zinc/01/64/71/1430016471.db2.gz YAZCYLLYHFNOBK-QFIPXVFZSA-N 2 1 387.568 3.030 20 0 GGADMP Cc1nc(COc2ccc(C[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)no1 ZINC000180785533 1430038752 /nfs/dbraw/zinc/03/87/52/1430038752.db2.gz DSWFKCMDFNSBFD-WIYYLYMNSA-N 2 1 382.508 3.406 20 0 GGADMP Cc1nc(COc2ccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2)no1 ZINC000180785533 1430038757 /nfs/dbraw/zinc/03/87/57/1430038757.db2.gz DSWFKCMDFNSBFD-WIYYLYMNSA-N 2 1 382.508 3.406 20 0 GGADMP Cc1nc(COc2ccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2)no1 ZINC000180785533 1430038762 /nfs/dbraw/zinc/03/87/62/1430038762.db2.gz DSWFKCMDFNSBFD-WIYYLYMNSA-N 2 1 382.508 3.406 20 0 GGADMP CC(C)(C)OC(=O)NC1CCC([NH2+]CC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC000180879418 1430084721 /nfs/dbraw/zinc/08/47/21/1430084721.db2.gz BTACEUHPAHXVSW-UHFFFAOYSA-N 2 1 395.588 3.447 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000181288185 1430263370 /nfs/dbraw/zinc/26/33/70/1430263370.db2.gz DCHVEVSJNTUGGX-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000181288185 1430263374 /nfs/dbraw/zinc/26/33/74/1430263374.db2.gz DCHVEVSJNTUGGX-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000181288185 1430263379 /nfs/dbraw/zinc/26/33/79/1430263379.db2.gz DCHVEVSJNTUGGX-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000181305053 1430268083 /nfs/dbraw/zinc/26/80/83/1430268083.db2.gz JWWYZHFSOMVIAC-LJQANCHMSA-N 2 1 395.551 3.118 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCCCC[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000181369183 1430282952 /nfs/dbraw/zinc/28/29/52/1430282952.db2.gz ZJZYRCIPJPFLLD-IBGZPJMESA-N 2 1 383.536 3.261 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccc(N2CCCC2=O)c1 ZINC000181415087 1430292484 /nfs/dbraw/zinc/29/24/84/1430292484.db2.gz HCAYCTBMQMIFRV-HSQYWUDLSA-N 2 1 385.552 3.232 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+](CN2C(=O)CN(c3ccccc3)C2=O)CC1 ZINC000181457415 1430304226 /nfs/dbraw/zinc/30/42/26/1430304226.db2.gz MPZMGDSPUGFIJV-UHFFFAOYSA-N 2 1 386.540 3.247 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000181525705 1430314972 /nfs/dbraw/zinc/31/49/72/1430314972.db2.gz MJBSHSNZKIATHC-DYVFJYSZSA-N 2 1 380.414 3.385 20 0 GGADMP Cc1ccc(C[N@H+]2CCCN(C(=O)C[NH2+][C@H](C)c3cccc(O)c3)CC2)cc1 ZINC000181577531 1430322608 /nfs/dbraw/zinc/32/26/08/1430322608.db2.gz NSYBFIVMZWYCNT-LJQANCHMSA-N 2 1 381.520 3.086 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)C[NH2+][C@H](C)c3cccc(O)c3)CC2)cc1 ZINC000181577531 1430322611 /nfs/dbraw/zinc/32/26/11/1430322611.db2.gz NSYBFIVMZWYCNT-LJQANCHMSA-N 2 1 381.520 3.086 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N[C@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)CC2)[nH+]c1 ZINC000181644347 1430333762 /nfs/dbraw/zinc/33/37/62/1430333762.db2.gz GFRRRFJBSQXYEG-QUCCMNQESA-N 2 1 384.568 3.376 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N[C@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)CC2)[nH+]c1 ZINC000181644347 1430333765 /nfs/dbraw/zinc/33/37/65/1430333765.db2.gz GFRRRFJBSQXYEG-QUCCMNQESA-N 2 1 384.568 3.376 20 0 GGADMP C[C@@H](CCNC(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCCCC1 ZINC000181703340 1430344145 /nfs/dbraw/zinc/34/41/45/1430344145.db2.gz ZKSNUTLYUIDPKM-UNMCSNQZSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@@H](CCNC(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCCCC1 ZINC000181703381 1430344164 /nfs/dbraw/zinc/34/41/64/1430344164.db2.gz ZKSNUTLYUIDPKM-RBBKRZOGSA-N 2 1 386.584 3.115 20 0 GGADMP CN(C)C(=O)N1CCC([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)CC1 ZINC000181840463 1430370489 /nfs/dbraw/zinc/37/04/89/1430370489.db2.gz UTRCXVQIDWBSQC-UHFFFAOYSA-N 2 1 384.524 3.147 20 0 GGADMP CCOC(=O)c1nn(-c2ccccc2)cc1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000181890842 1430378710 /nfs/dbraw/zinc/37/87/10/1430378710.db2.gz LBSTZFCEGPPCBY-UHFFFAOYSA-N 2 1 392.503 3.400 20 0 GGADMP COC(=O)c1ccc(Cl)c(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000181962275 1430389151 /nfs/dbraw/zinc/38/91/51/1430389151.db2.gz NALOFJAVBROCAT-UHFFFAOYSA-N 2 1 380.916 3.203 20 0 GGADMP COc1ccc([C@H]2CCC[N@@H+]2CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1 ZINC000182013210 1430396323 /nfs/dbraw/zinc/39/63/23/1430396323.db2.gz LCEWCNQKFWCBDQ-FGZHOGPDSA-N 2 1 381.520 3.251 20 0 GGADMP COc1ccc([C@H]2CCC[N@H+]2CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1 ZINC000182013210 1430396328 /nfs/dbraw/zinc/39/63/28/1430396328.db2.gz LCEWCNQKFWCBDQ-FGZHOGPDSA-N 2 1 381.520 3.251 20 0 GGADMP CO[C@]1(C)C[C@@H]([N@@H+](C)CC2(C[NH+](C)[C@H]3C[C@@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000182205204 1430429903 /nfs/dbraw/zinc/42/99/03/1430429903.db2.gz JSMLUQMHMHVNHK-GMQQQROESA-N 2 1 396.616 3.274 20 0 GGADMP CO[C@]1(C)C[C@@H]([NH+](C)CC2(C[N@H+](C)[C@H]3C[C@@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000182205204 1430429904 /nfs/dbraw/zinc/42/99/04/1430429904.db2.gz JSMLUQMHMHVNHK-GMQQQROESA-N 2 1 396.616 3.274 20 0 GGADMP CO[C@]1(C)C[C@@H]([NH+](C)CC2(C[N@@H+](C)[C@H]3C[C@@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000182205204 1430429905 /nfs/dbraw/zinc/42/99/05/1430429905.db2.gz JSMLUQMHMHVNHK-GMQQQROESA-N 2 1 396.616 3.274 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc([S@@](C)=O)cc1 ZINC000182235437 1430434652 /nfs/dbraw/zinc/43/46/52/1430434652.db2.gz BRWLWVHTOQOPDS-OYBFMBOMSA-N 2 1 386.561 3.232 20 0 GGADMP C[C@H](CCNC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)[NH+]1CCCCC1 ZINC000182243386 1430435756 /nfs/dbraw/zinc/43/57/56/1430435756.db2.gz ZCHOCRMCZGJAJS-VAMGGRTRSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1nc2ccccc2n1C ZINC000182247789 1430436679 /nfs/dbraw/zinc/43/66/79/1430436679.db2.gz YMAJKVLTQUTUBB-FXAWDEMLSA-N 2 1 378.520 3.381 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1nc2ccccc2n1C ZINC000182247789 1430436682 /nfs/dbraw/zinc/43/66/82/1430436682.db2.gz YMAJKVLTQUTUBB-FXAWDEMLSA-N 2 1 378.520 3.381 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1nc2ccccc2n1C ZINC000182247811 1430436780 /nfs/dbraw/zinc/43/67/80/1430436780.db2.gz YMAJKVLTQUTUBB-YLJYHZDGSA-N 2 1 378.520 3.381 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1nc2ccccc2n1C ZINC000182247811 1430436781 /nfs/dbraw/zinc/43/67/81/1430436781.db2.gz YMAJKVLTQUTUBB-YLJYHZDGSA-N 2 1 378.520 3.381 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)c(F)c1 ZINC000182256931 1430438420 /nfs/dbraw/zinc/43/84/20/1430438420.db2.gz RAAVDASMDYQWIW-RXVVDRJESA-N 2 1 376.447 3.009 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(F)c(F)c1 ZINC000182256931 1430438422 /nfs/dbraw/zinc/43/84/22/1430438422.db2.gz RAAVDASMDYQWIW-RXVVDRJESA-N 2 1 376.447 3.009 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(-n2ccnc2)cc1 ZINC000182268552 1430439987 /nfs/dbraw/zinc/43/99/87/1430439987.db2.gz QGLUALXMFYLDRM-JPYJTQIMSA-N 2 1 376.504 3.290 20 0 GGADMP CC[C@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)[C@@H]1CCCO1 ZINC000182271531 1430440890 /nfs/dbraw/zinc/44/08/90/1430440890.db2.gz MFUZYUMLCMTTRT-UFYCRDLUSA-N 2 1 393.959 3.140 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)CC1 ZINC000182302337 1430445075 /nfs/dbraw/zinc/44/50/75/1430445075.db2.gz SGUIEGBXNZQKMC-IRLDBZIGSA-N 2 1 384.568 3.085 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1cccc(F)c1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182363473 1430453721 /nfs/dbraw/zinc/45/37/21/1430453721.db2.gz BRESNHLXKXOMQT-CDXJDZJCSA-N 2 1 390.547 3.381 20 0 GGADMP C[C@@H](NC(=O)NCCCC[NH+]1CCC(C)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182407179 1430462093 /nfs/dbraw/zinc/46/20/93/1430462093.db2.gz IRVZCTBEJWLUBK-UXHICEINSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1Nc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000182632600 1430506186 /nfs/dbraw/zinc/50/61/86/1430506186.db2.gz RNEGHJQYKFLIAE-CVDCTZTESA-N 2 1 379.552 3.156 20 0 GGADMP C[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)[C@@H]1CCCCN1C(=O)OC(C)(C)C ZINC000182633470 1430506310 /nfs/dbraw/zinc/50/63/10/1430506310.db2.gz OEXPTPMYNZOSEU-QUCCMNQESA-N 2 1 396.620 3.028 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)[NH+](C)Cc1ccccc1 ZINC000182634972 1430506755 /nfs/dbraw/zinc/50/67/55/1430506755.db2.gz ZTWGYCJPLGLTCT-SVFBPWRDSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1)[N@H+](C)Cc1ccccc1 ZINC000182634972 1430506757 /nfs/dbraw/zinc/50/67/57/1430506757.db2.gz ZTWGYCJPLGLTCT-SVFBPWRDSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000182634972 1430506759 /nfs/dbraw/zinc/50/67/59/1430506759.db2.gz ZTWGYCJPLGLTCT-SVFBPWRDSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H](CCNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCCCC1 ZINC000182712830 1430524418 /nfs/dbraw/zinc/52/44/18/1430524418.db2.gz YSCGEGDFXBWAHU-RBBKRZOGSA-N 2 1 386.584 3.414 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+](CC(=O)Nc2cccc(NC(C)=O)c2)CC1 ZINC000182795154 1430541561 /nfs/dbraw/zinc/54/15/61/1430541561.db2.gz MVJLXQGDEPORED-UHFFFAOYSA-N 2 1 388.556 3.418 20 0 GGADMP C[NH+]1CCN(C(=O)CC[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000182819025 1430546241 /nfs/dbraw/zinc/54/62/41/1430546241.db2.gz OHIWVJQXQRVTAB-KRWDZBQOSA-N 2 1 383.508 3.132 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000182837055 1430550567 /nfs/dbraw/zinc/55/05/67/1430550567.db2.gz KDHCRVOVNWOKNN-RBBKRZOGSA-N 2 1 398.595 3.475 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)CC1 ZINC000182837055 1430550569 /nfs/dbraw/zinc/55/05/69/1430550569.db2.gz KDHCRVOVNWOKNN-RBBKRZOGSA-N 2 1 398.595 3.475 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000182837120 1430550705 /nfs/dbraw/zinc/55/07/05/1430550705.db2.gz KDHCRVOVNWOKNN-IRLDBZIGSA-N 2 1 398.595 3.475 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)CC1 ZINC000182837120 1430550711 /nfs/dbraw/zinc/55/07/11/1430550711.db2.gz KDHCRVOVNWOKNN-IRLDBZIGSA-N 2 1 398.595 3.475 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182856896 1430554891 /nfs/dbraw/zinc/55/48/91/1430554891.db2.gz TVPOXAKYTNPZJL-RTBURBONSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCN(CCc2ccccc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182885613 1430561964 /nfs/dbraw/zinc/56/19/64/1430561964.db2.gz UIEITMHVEBIDLU-RBBKRZOGSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182885613 1430561969 /nfs/dbraw/zinc/56/19/69/1430561969.db2.gz UIEITMHVEBIDLU-RBBKRZOGSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182885613 1430561977 /nfs/dbraw/zinc/56/19/77/1430561977.db2.gz UIEITMHVEBIDLU-RBBKRZOGSA-N 2 1 398.595 3.209 20 0 GGADMP CS(=O)(=O)[C@@H]1CCCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000182884735 1430561996 /nfs/dbraw/zinc/56/19/96/1430561996.db2.gz ROIHWAOJMNLHLO-VQTJNVASSA-N 2 1 399.000 3.497 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182896395 1430565088 /nfs/dbraw/zinc/56/50/88/1430565088.db2.gz SVYJDZDBRVXSLN-ZJOUEHCJSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182896348 1430565257 /nfs/dbraw/zinc/56/52/57/1430565257.db2.gz SVYJDZDBRVXSLN-ZVDOUQERSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1cccs1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182913985 1430570014 /nfs/dbraw/zinc/57/00/14/1430570014.db2.gz TUBUGNKQHRJHOS-ZWKOTPCHSA-N 2 1 392.613 3.474 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182924590 1430572960 /nfs/dbraw/zinc/57/29/60/1430572960.db2.gz WRPRBIOWIXRIKC-TZIWHRDSSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182924590 1430572964 /nfs/dbraw/zinc/57/29/64/1430572964.db2.gz WRPRBIOWIXRIKC-TZIWHRDSSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1ccco1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182930850 1430574568 /nfs/dbraw/zinc/57/45/68/1430574568.db2.gz HDRURKBZHWHPGZ-ROUUACIJSA-N 2 1 376.545 3.006 20 0 GGADMP CC[NH+](CC)Cc1cc([C@H](C)NCC2([NH+](C)C)CCOCC2)ccc1OC ZINC000182967525 1430582313 /nfs/dbraw/zinc/58/23/13/1430582313.db2.gz IEIWQMZOWMIHIT-SFHVURJKSA-N 2 1 377.573 3.298 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cn(Cc3cccnc3)nn2)CC1 ZINC000183040398 1430598533 /nfs/dbraw/zinc/59/85/33/1430598533.db2.gz DDDNKUNYIDIYEQ-UHFFFAOYSA-N 2 1 390.535 3.065 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cn(Cc3cccnc3)nn2)CC1 ZINC000183040398 1430598536 /nfs/dbraw/zinc/59/85/36/1430598536.db2.gz DDDNKUNYIDIYEQ-UHFFFAOYSA-N 2 1 390.535 3.065 20 0 GGADMP CNC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000183132472 1430624246 /nfs/dbraw/zinc/62/42/46/1430624246.db2.gz LWBQWVVOSHSCHH-RJGXRXQPSA-N 2 1 377.532 3.437 20 0 GGADMP CN(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183138699 1430626056 /nfs/dbraw/zinc/62/60/56/1430626056.db2.gz FYRTVKQEWXDYRP-DSNGMDLFSA-N 3 1 398.639 3.150 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183138699 1430626059 /nfs/dbraw/zinc/62/60/59/1430626059.db2.gz FYRTVKQEWXDYRP-DSNGMDLFSA-N 3 1 398.639 3.150 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183138699 1430626061 /nfs/dbraw/zinc/62/60/61/1430626061.db2.gz FYRTVKQEWXDYRP-DSNGMDLFSA-N 3 1 398.639 3.150 20 0 GGADMP COc1cc([C@@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000183184521 1430641857 /nfs/dbraw/zinc/64/18/57/1430641857.db2.gz OYNNFVDVHWSWKE-SOLBZPMBSA-N 2 1 394.581 3.402 20 0 GGADMP COc1cc([C@@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000183184521 1430641859 /nfs/dbraw/zinc/64/18/59/1430641859.db2.gz OYNNFVDVHWSWKE-SOLBZPMBSA-N 2 1 394.581 3.402 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183189185 1430643059 /nfs/dbraw/zinc/64/30/59/1430643059.db2.gz YTOCVRUREQPYNL-YQVWRLOYSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000183191325 1430643474 /nfs/dbraw/zinc/64/34/74/1430643474.db2.gz NTQOREFCAJXEKV-SOLBZPMBSA-N 2 1 379.570 3.362 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000183197575 1430645585 /nfs/dbraw/zinc/64/55/85/1430645585.db2.gz DRYPZUBVQCTVNF-JENIJYKNSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000183197575 1430645593 /nfs/dbraw/zinc/64/55/93/1430645593.db2.gz DRYPZUBVQCTVNF-JENIJYKNSA-N 2 1 393.597 3.241 20 0 GGADMP C[N@@H+]1CCC[C@@H]1CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000183201251 1430646580 /nfs/dbraw/zinc/64/65/80/1430646580.db2.gz ARWKYWMNXHOXHI-GOSISDBHSA-N 2 1 399.366 3.351 20 0 GGADMP C[N@H+]1CCC[C@@H]1CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000183201251 1430646588 /nfs/dbraw/zinc/64/65/88/1430646588.db2.gz ARWKYWMNXHOXHI-GOSISDBHSA-N 2 1 399.366 3.351 20 0 GGADMP Cn1ccnc1[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)C1CC1 ZINC000183268149 1430665466 /nfs/dbraw/zinc/66/54/66/1430665466.db2.gz JRYIXXXKIJYXNH-JOCHJYFZSA-N 2 1 398.551 3.151 20 0 GGADMP Cn1ccnc1[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)C1CC1 ZINC000183268149 1430665469 /nfs/dbraw/zinc/66/54/69/1430665469.db2.gz JRYIXXXKIJYXNH-JOCHJYFZSA-N 2 1 398.551 3.151 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@H]4C[N@@H+](C)CC[C@H]43)CC2)CC1 ZINC000183376423 1430694644 /nfs/dbraw/zinc/69/46/44/1430694644.db2.gz SJVVISBRHXMHLZ-GKYDQMIMSA-N 2 1 376.589 3.155 20 0 GGADMP CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000183504472 1430730202 /nfs/dbraw/zinc/73/02/02/1430730202.db2.gz VYQXIZNJCCTOCM-CJNGLKHVSA-N 2 1 395.569 3.190 20 0 GGADMP C[C@H](CCNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1)[NH+]1CCCCC1 ZINC000183677822 1430770262 /nfs/dbraw/zinc/77/02/62/1430770262.db2.gz WGZATYWKVRREQX-RTBURBONSA-N 2 1 388.556 3.466 20 0 GGADMP C[C@@H](CC[NH2+][C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)[NH+]1CCCCC1 ZINC000184502477 1430895740 /nfs/dbraw/zinc/89/57/40/1430895740.db2.gz LVCCRPWOVWLTII-ROUUACIJSA-N 2 1 379.570 3.142 20 0 GGADMP O=C1C[C@@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)CN1Cc1ccccc1C(F)(F)F ZINC000184670688 1430937727 /nfs/dbraw/zinc/93/77/27/1430937727.db2.gz YKSNBGJCLBUYRV-BRWVUGGUSA-N 2 1 381.442 3.023 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 ZINC000184672318 1430938089 /nfs/dbraw/zinc/93/80/89/1430938089.db2.gz IBTPXJLTSRPOOM-SZXPJGKVSA-N 2 1 383.458 3.125 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)N1CCc2ccccc21 ZINC000184753520 1430966716 /nfs/dbraw/zinc/96/67/16/1430966716.db2.gz HFFMXMROKXMLRO-OALUTQOASA-N 2 1 377.532 3.322 20 0 GGADMP C[C@@H](CCNC(=O)NC[C@H](C)[N@@H+]1CCc2sccc2C1)[NH+]1CCCCC1 ZINC000184869427 1431008154 /nfs/dbraw/zinc/00/81/54/1431008154.db2.gz SPKGBJACIWKWAS-IRXDYDNUSA-N 2 1 378.586 3.058 20 0 GGADMP C[C@@H](CCNC(=O)NC[C@H](C)[N@H+]1CCc2sccc2C1)[NH+]1CCCCC1 ZINC000184869427 1431008161 /nfs/dbraw/zinc/00/81/61/1431008161.db2.gz SPKGBJACIWKWAS-IRXDYDNUSA-N 2 1 378.586 3.058 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C[NH+]1CCC(OCc2ccccc2)CC1)c1ccccc1 ZINC000184930197 1431024266 /nfs/dbraw/zinc/02/42/66/1431024266.db2.gz UDTJGDATAHEJKV-HSZRJFAPSA-N 2 1 395.547 3.087 20 0 GGADMP CCC[C@@H]([NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1cccnc1 ZINC000185080558 1431056122 /nfs/dbraw/zinc/05/61/22/1431056122.db2.gz NHVINBUVUWDXEP-JOCHJYFZSA-N 2 1 396.535 3.373 20 0 GGADMP Cc1ccc(NCc2c[nH+]ccc2N(C)C)cc1NC(=O)C[NH+]1CCCCC1 ZINC000185217013 1431087393 /nfs/dbraw/zinc/08/73/93/1431087393.db2.gz GXTIMSRAIWEMJO-UHFFFAOYSA-N 2 1 381.524 3.493 20 0 GGADMP CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)C1(C)C ZINC000185223007 1431088452 /nfs/dbraw/zinc/08/84/52/1431088452.db2.gz VPAHZDDEQDMTTO-PWRODBHTSA-N 2 1 387.568 3.066 20 0 GGADMP Cc1c(C(=O)NC[C@@H](C2CC2)[N@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000185332570 1431117131 /nfs/dbraw/zinc/11/71/31/1431117131.db2.gz VELPYTSXCLKEGU-QFIPXVFZSA-N 2 1 389.503 3.216 20 0 GGADMP Cc1c(C(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000185332570 1431117138 /nfs/dbraw/zinc/11/71/38/1431117138.db2.gz VELPYTSXCLKEGU-QFIPXVFZSA-N 2 1 389.503 3.216 20 0 GGADMP Cc1c(C(=O)NC[C@H](C2CC2)[N@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000185332588 1431117293 /nfs/dbraw/zinc/11/72/93/1431117293.db2.gz VELPYTSXCLKEGU-JOCHJYFZSA-N 2 1 389.503 3.216 20 0 GGADMP Cc1c(C(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000185332588 1431117298 /nfs/dbraw/zinc/11/72/98/1431117298.db2.gz VELPYTSXCLKEGU-JOCHJYFZSA-N 2 1 389.503 3.216 20 0 GGADMP CC[C@H]1CN(C(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000185472792 1431152998 /nfs/dbraw/zinc/15/29/98/1431152998.db2.gz NZZWJGVENZSEAJ-QFIPXVFZSA-N 2 1 384.568 3.167 20 0 GGADMP CCOC(=O)c1ccc(NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185669629 1431200976 /nfs/dbraw/zinc/20/09/76/1431200976.db2.gz UFJRBYGGHAXBJE-AEFFLSMTSA-N 2 1 387.524 3.044 20 0 GGADMP CCOC(=O)c1ccc(NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185669629 1431200983 /nfs/dbraw/zinc/20/09/83/1431200983.db2.gz UFJRBYGGHAXBJE-AEFFLSMTSA-N 2 1 387.524 3.044 20 0 GGADMP Cc1cccc(C)c1OCCNC(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185668878 1431201317 /nfs/dbraw/zinc/20/13/17/1431201317.db2.gz NGAZKXHUNKFLPW-PMACEKPBSA-N 2 1 387.568 3.041 20 0 GGADMP Cc1cccc(C)c1OCCNC(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185668878 1431201319 /nfs/dbraw/zinc/20/13/19/1431201319.db2.gz NGAZKXHUNKFLPW-PMACEKPBSA-N 2 1 387.568 3.041 20 0 GGADMP COc1ccc(Cl)cc1CNC(=O)C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185683567 1431205040 /nfs/dbraw/zinc/20/50/40/1431205040.db2.gz OVVBUGQOOWJRDI-CVEARBPZSA-N 2 1 393.959 3.207 20 0 GGADMP COc1ccc(Cl)cc1CNC(=O)C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185683567 1431205044 /nfs/dbraw/zinc/20/50/44/1431205044.db2.gz OVVBUGQOOWJRDI-CVEARBPZSA-N 2 1 393.959 3.207 20 0 GGADMP C[C@H]([NH2+]CCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185691004 1431207156 /nfs/dbraw/zinc/20/71/56/1431207156.db2.gz SLXIXBUFNKTDGH-ROUUACIJSA-N 2 1 383.536 3.305 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCc1ccc(OC(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185708049 1431211328 /nfs/dbraw/zinc/21/13/28/1431211328.db2.gz JYMAOUBJDQBADV-RDJZCZTQSA-N 2 1 395.494 3.147 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCc1ccc(OC(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185708049 1431211343 /nfs/dbraw/zinc/21/13/43/1431211343.db2.gz JYMAOUBJDQBADV-RDJZCZTQSA-N 2 1 395.494 3.147 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(OC)c1 ZINC000185706789 1431211754 /nfs/dbraw/zinc/21/17/54/1431211754.db2.gz CKGVPOGCQACFQM-IKGGRYGDSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(OC)c1 ZINC000185706789 1431211758 /nfs/dbraw/zinc/21/17/58/1431211758.db2.gz CKGVPOGCQACFQM-IKGGRYGDSA-N 2 1 389.540 3.273 20 0 GGADMP CCOCc1ccccc1CNC(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185711923 1431212721 /nfs/dbraw/zinc/21/27/21/1431212721.db2.gz LWTDUIQSCSIJGM-UYAOXDASSA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccccc1CNC(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185711923 1431212724 /nfs/dbraw/zinc/21/27/24/1431212724.db2.gz LWTDUIQSCSIJGM-UYAOXDASSA-N 2 1 387.568 3.082 20 0 GGADMP CCCOc1ccc(CNC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185712028 1431212770 /nfs/dbraw/zinc/21/27/70/1431212770.db2.gz CDDGVDPAYANFPC-ICSRJNTNSA-N 2 1 387.568 3.334 20 0 GGADMP CCCOc1ccc(CNC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185712028 1431212775 /nfs/dbraw/zinc/21/27/75/1431212775.db2.gz CDDGVDPAYANFPC-ICSRJNTNSA-N 2 1 387.568 3.334 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NCCc1ccc(F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185720222 1431214888 /nfs/dbraw/zinc/21/48/88/1431214888.db2.gz BSPMAYAFMBHEDY-ZIFCJYIRSA-N 2 1 375.532 3.116 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NCCc1ccc(F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185720222 1431214893 /nfs/dbraw/zinc/21/48/93/1431214893.db2.gz BSPMAYAFMBHEDY-ZIFCJYIRSA-N 2 1 375.532 3.116 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NCCc1ccc(F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185720265 1431215535 /nfs/dbraw/zinc/21/55/35/1431215535.db2.gz BSPMAYAFMBHEDY-AOIWGVFYSA-N 2 1 375.532 3.116 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NCCc1ccc(F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185720265 1431215540 /nfs/dbraw/zinc/21/55/40/1431215540.db2.gz BSPMAYAFMBHEDY-AOIWGVFYSA-N 2 1 375.532 3.116 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N1CCc2sccc2C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185723744 1431215839 /nfs/dbraw/zinc/21/58/39/1431215839.db2.gz WYRMHYTZINPXLZ-IXDOHACOSA-N 2 1 375.582 3.264 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N1CCc2sccc2C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185723744 1431215841 /nfs/dbraw/zinc/21/58/41/1431215841.db2.gz WYRMHYTZINPXLZ-IXDOHACOSA-N 2 1 375.582 3.264 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C(=O)N1CCc2sccc2C1 ZINC000185723728 1431216117 /nfs/dbraw/zinc/21/61/17/1431216117.db2.gz WYRMHYTZINPXLZ-YESZJQIVSA-N 2 1 375.582 3.264 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C(=O)N1CCc2sccc2C1 ZINC000185723728 1431216120 /nfs/dbraw/zinc/21/61/20/1431216120.db2.gz WYRMHYTZINPXLZ-YESZJQIVSA-N 2 1 375.582 3.264 20 0 GGADMP CCOCc1ccc(CNC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185726748 1431216801 /nfs/dbraw/zinc/21/68/01/1431216801.db2.gz UFYIONRVORKWJU-NQIIRXRSSA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccc(CNC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185726748 1431216804 /nfs/dbraw/zinc/21/68/04/1431216804.db2.gz UFYIONRVORKWJU-NQIIRXRSSA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccc(CNC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185726717 1431217051 /nfs/dbraw/zinc/21/70/51/1431217051.db2.gz UFYIONRVORKWJU-WIYYLYMNSA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccc(CNC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185726717 1431217060 /nfs/dbraw/zinc/21/70/60/1431217060.db2.gz UFYIONRVORKWJU-WIYYLYMNSA-N 2 1 387.568 3.082 20 0 GGADMP COc1ccc(CN(C(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)C2CC2)cc1 ZINC000185745557 1431222352 /nfs/dbraw/zinc/22/23/52/1431222352.db2.gz ALLDBANTJVAVIS-AZUAARDMSA-N 2 1 399.579 3.429 20 0 GGADMP COc1ccc(CN(C(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C2CC2)cc1 ZINC000185745557 1431222359 /nfs/dbraw/zinc/22/23/59/1431222359.db2.gz ALLDBANTJVAVIS-AZUAARDMSA-N 2 1 399.579 3.429 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185748197 1431222973 /nfs/dbraw/zinc/22/29/73/1431222973.db2.gz SQLBZNULBPBDNJ-HSALFYBXSA-N 2 1 387.568 3.121 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185748197 1431222976 /nfs/dbraw/zinc/22/29/76/1431222976.db2.gz SQLBZNULBPBDNJ-HSALFYBXSA-N 2 1 387.568 3.121 20 0 GGADMP Cc1cccc(OCCCNC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185750498 1431223687 /nfs/dbraw/zinc/22/36/87/1431223687.db2.gz RHUWLWCFOPFLQY-PMACEKPBSA-N 2 1 387.568 3.123 20 0 GGADMP Cc1cccc(OCCCNC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185750498 1431223689 /nfs/dbraw/zinc/22/36/89/1431223689.db2.gz RHUWLWCFOPFLQY-PMACEKPBSA-N 2 1 387.568 3.123 20 0 GGADMP C[C@@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1=O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185751274 1431224755 /nfs/dbraw/zinc/22/47/55/1431224755.db2.gz AKTBESUJJIIVGS-ZRGWGRIASA-N 2 1 377.479 3.313 20 0 GGADMP C[C@@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1=O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185751274 1431224757 /nfs/dbraw/zinc/22/47/57/1431224757.db2.gz AKTBESUJJIIVGS-ZRGWGRIASA-N 2 1 377.479 3.313 20 0 GGADMP Cc1cc2ncn(C[C@@H](O)C[NH2+][C@@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)c2cc1C ZINC000185761162 1431227193 /nfs/dbraw/zinc/22/71/93/1431227193.db2.gz FYDFOTOHFTWOOG-ZVDOUQERSA-N 2 1 384.568 3.257 20 0 GGADMP Cc1cc(NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)n(C(C)(C)C)n1 ZINC000185762737 1431227872 /nfs/dbraw/zinc/22/78/72/1431227872.db2.gz PLPCZMZZRSAMQS-IRXDYDNUSA-N 2 1 375.561 3.128 20 0 GGADMP Cc1cc(NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)n(C(C)(C)C)n1 ZINC000185762737 1431227874 /nfs/dbraw/zinc/22/78/74/1431227874.db2.gz PLPCZMZZRSAMQS-IRXDYDNUSA-N 2 1 375.561 3.128 20 0 GGADMP Cc1cc(NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)n(C(C)(C)C)n1 ZINC000185762758 1431228013 /nfs/dbraw/zinc/22/80/13/1431228013.db2.gz PLPCZMZZRSAMQS-SJORKVTESA-N 2 1 375.561 3.128 20 0 GGADMP Cc1cc(NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)n(C(C)(C)C)n1 ZINC000185762758 1431228017 /nfs/dbraw/zinc/22/80/17/1431228017.db2.gz PLPCZMZZRSAMQS-SJORKVTESA-N 2 1 375.561 3.128 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(N2CCCCC2)nc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185766701 1431229211 /nfs/dbraw/zinc/22/92/11/1431229211.db2.gz IZSVWLZKLBJOGY-OALUTQOASA-N 2 1 399.583 3.253 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(N2CCCCC2)nc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766701 1431229219 /nfs/dbraw/zinc/22/92/19/1431229219.db2.gz IZSVWLZKLBJOGY-OALUTQOASA-N 2 1 399.583 3.253 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+][C@H](C)CCN3CC[NH+](C)CC3)cs2)cc1 ZINC000185865862 1431256037 /nfs/dbraw/zinc/25/60/37/1431256037.db2.gz CMASOLBGPZYFKG-GOSISDBHSA-N 2 1 388.581 3.146 20 0 GGADMP C[C@@H](C[NH+]1CCCCCC1)NC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186108547 1431331827 /nfs/dbraw/zinc/33/18/27/1431331827.db2.gz JPNAFTKIUYNLGJ-RBBKRZOGSA-N 2 1 386.584 3.414 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)CC1 ZINC000186273772 1431368497 /nfs/dbraw/zinc/36/84/97/1431368497.db2.gz CZTFYGXGHOSMJR-JOCHJYFZSA-N 2 1 386.584 3.270 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000186274022 1431368913 /nfs/dbraw/zinc/36/89/13/1431368913.db2.gz CRWDQLBCIJYXDW-QGZVFWFLSA-N 2 1 390.553 3.205 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000186274022 1431368915 /nfs/dbraw/zinc/36/89/15/1431368915.db2.gz CRWDQLBCIJYXDW-QGZVFWFLSA-N 2 1 390.553 3.205 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21)C1CC1 ZINC000186275588 1431369002 /nfs/dbraw/zinc/36/90/02/1431369002.db2.gz DLNKWTBPDROILM-VSKRKVRLSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21)C1CC1 ZINC000186275588 1431369007 /nfs/dbraw/zinc/36/90/07/1431369007.db2.gz DLNKWTBPDROILM-VSKRKVRLSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)C1CC1 ZINC000186275588 1431369013 /nfs/dbraw/zinc/36/90/13/1431369013.db2.gz DLNKWTBPDROILM-VSKRKVRLSA-N 2 1 384.568 3.023 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)C1CC1 ZINC000186281960 1431370954 /nfs/dbraw/zinc/37/09/54/1431370954.db2.gz GJRKXJMSRXGCRU-IFMALSPDSA-N 2 1 384.568 3.024 20 0 GGADMP CS(=O)(=O)CCCCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000186852698 1431540569 /nfs/dbraw/zinc/54/05/69/1431540569.db2.gz WHDGZAYVKWPSPA-PCCBWWKXSA-N 2 1 378.582 3.092 20 0 GGADMP CS(=O)(=O)CCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000186852729 1431540703 /nfs/dbraw/zinc/54/07/03/1431540703.db2.gz WHDGZAYVKWPSPA-QHAWAJNXSA-N 2 1 378.582 3.092 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)C1CCS(=O)(=O)CC1 ZINC000187005648 1431587655 /nfs/dbraw/zinc/58/76/55/1431587655.db2.gz NQJMXZRYXZIVTN-MSOLQXFVSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)C1CCS(=O)(=O)CC1 ZINC000187010107 1431588614 /nfs/dbraw/zinc/58/86/14/1431588614.db2.gz ADVAKCONGOINCR-MSOLQXFVSA-N 2 1 378.582 3.364 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2ccc(OCC)cc2)[C@H](C)C1 ZINC000187018057 1431591482 /nfs/dbraw/zinc/59/14/82/1431591482.db2.gz SPBYHIHVPAELGG-LVCYWYKZSA-N 2 1 391.556 3.139 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2ccc(OCC)cc2)[C@H](C)C1 ZINC000187018057 1431591487 /nfs/dbraw/zinc/59/14/87/1431591487.db2.gz SPBYHIHVPAELGG-LVCYWYKZSA-N 2 1 391.556 3.139 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)ccc2C)[C@H](C)C1 ZINC000187024589 1431593463 /nfs/dbraw/zinc/59/34/63/1431593463.db2.gz WIULXYNPLCKKQI-AABGKKOBSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)ccc2C)[C@H](C)C1 ZINC000187024589 1431593467 /nfs/dbraw/zinc/59/34/67/1431593467.db2.gz WIULXYNPLCKKQI-AABGKKOBSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(=O)N[C@@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000187023885 1431593478 /nfs/dbraw/zinc/59/34/78/1431593478.db2.gz YITDHCUYZJMTBH-FUHIMQAGSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CC(=O)N[C@@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000187023885 1431593481 /nfs/dbraw/zinc/59/34/81/1431593481.db2.gz YITDHCUYZJMTBH-FUHIMQAGSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)c(F)c2)[C@H](C)C1 ZINC000187027067 1431594240 /nfs/dbraw/zinc/59/42/40/1431594240.db2.gz QEEFNRNNUIUDEC-UWVAXJGDSA-N 2 1 379.520 3.188 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)c(F)c2)[C@H](C)C1 ZINC000187027067 1431594244 /nfs/dbraw/zinc/59/42/44/1431594244.db2.gz QEEFNRNNUIUDEC-UWVAXJGDSA-N 2 1 379.520 3.188 20 0 GGADMP CN1c2ccc(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)cc2CCC1=O ZINC000187120586 1431621529 /nfs/dbraw/zinc/62/15/29/1431621529.db2.gz SPRDVTNWPQKISW-UHFFFAOYSA-N 2 1 377.532 3.392 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000187134438 1431627189 /nfs/dbraw/zinc/62/71/89/1431627189.db2.gz JVJCNJWVLYDXCI-RDTXWAMCSA-N 2 1 398.473 3.092 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc4c(c3)CCC(=O)N4C)c2)CCO1 ZINC000187162062 1431635183 /nfs/dbraw/zinc/63/51/83/1431635183.db2.gz PGZGFWLOUAADSP-GOSISDBHSA-N 2 1 393.531 3.106 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc4c(c3)CCC(=O)N4C)c2)CCO1 ZINC000187162062 1431635189 /nfs/dbraw/zinc/63/51/89/1431635189.db2.gz PGZGFWLOUAADSP-GOSISDBHSA-N 2 1 393.531 3.106 20 0 GGADMP COc1ccc(-c2ccncc2)cc1C[NH2+]CC1CCN(CC[NH+](C)C)CC1 ZINC000187207236 1431648473 /nfs/dbraw/zinc/64/84/73/1431648473.db2.gz QNIWQLMSVKDDPJ-UHFFFAOYSA-N 2 1 382.552 3.120 20 0 GGADMP COc1ccc(-c2ccncc2)cc1C[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000187250828 1431665984 /nfs/dbraw/zinc/66/59/84/1431665984.db2.gz JPDQSGYCKWSHQX-SFHVURJKSA-N 2 1 381.520 3.348 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)[NH+](C)C)[N@@H+](C)C1CC1 ZINC000187256748 1431668409 /nfs/dbraw/zinc/66/84/09/1431668409.db2.gz BQOIXQRHNUAZFS-SUMWQHHRSA-N 2 1 386.462 3.090 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)[NH+](C)C)[N@@H+](C)C1CC1 ZINC000187256711 1431668654 /nfs/dbraw/zinc/66/86/54/1431668654.db2.gz BQOIXQRHNUAZFS-GUYCJALGSA-N 2 1 386.462 3.090 20 0 GGADMP C[C@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)C1CCS(=O)(=O)CC1 ZINC000187521410 1431755400 /nfs/dbraw/zinc/75/54/00/1431755400.db2.gz UUNXZWMRHWABCX-KRWDZBQOSA-N 2 1 393.597 3.090 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](Cc3ccn(-c4ccccc4F)n3)CC2)C[C@@H](C)O1 ZINC000188932392 1432011198 /nfs/dbraw/zinc/01/11/98/1432011198.db2.gz BESUCCCEKAEXOD-QZTJIDSGSA-N 2 1 386.515 3.333 20 0 GGADMP CC(C)[C@H](C[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1)[NH+]1CCCC1 ZINC000189030804 1432030384 /nfs/dbraw/zinc/03/03/84/1432030384.db2.gz ZTYJNVWZQBRNSI-NGICGMGXSA-N 2 1 383.536 3.304 20 0 GGADMP C[N@@H+](CCC(=O)N1CCc2ccccc2C1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000189057124 1432036241 /nfs/dbraw/zinc/03/62/41/1432036241.db2.gz URWZEAAZBNRKQT-QFIPXVFZSA-N 2 1 391.559 3.415 20 0 GGADMP C[NH+](CCC(=O)N1CCc2ccccc2C1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000189057124 1432036248 /nfs/dbraw/zinc/03/62/48/1432036248.db2.gz URWZEAAZBNRKQT-QFIPXVFZSA-N 2 1 391.559 3.415 20 0 GGADMP C[NH+](CCC(=O)N1CCc2ccccc2C1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000189057124 1432036253 /nfs/dbraw/zinc/03/62/53/1432036253.db2.gz URWZEAAZBNRKQT-QFIPXVFZSA-N 2 1 391.559 3.415 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)[C@H](C)C1 ZINC000189209063 1432063675 /nfs/dbraw/zinc/06/36/75/1432063675.db2.gz RHYIRWGVSJGZGW-GCJKJVERSA-N 2 1 388.531 3.297 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)[C@H](C)C1 ZINC000189209063 1432063682 /nfs/dbraw/zinc/06/36/82/1432063682.db2.gz RHYIRWGVSJGZGW-GCJKJVERSA-N 2 1 388.531 3.297 20 0 GGADMP Cc1cc(C[NH2+]Cc2cnc(N3CC[NH+](C)CC3)nc2)ccc1-c1ccccc1 ZINC000189506765 1432140226 /nfs/dbraw/zinc/14/02/26/1432140226.db2.gz SYAPHLKGRPCBDR-UHFFFAOYSA-N 2 1 387.531 3.494 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(=O)oc3cc(OC)ccc23)[C@H](C)C1 ZINC000190006900 1432303202 /nfs/dbraw/zinc/30/32/02/1432303202.db2.gz HBSWMUQLZFFHQC-OXQOHEQNSA-N 2 1 388.508 3.028 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(=O)oc3cc(OC)ccc23)[C@H](C)C1 ZINC000190006900 1432303205 /nfs/dbraw/zinc/30/32/05/1432303205.db2.gz HBSWMUQLZFFHQC-OXQOHEQNSA-N 2 1 388.508 3.028 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccccc2CC)[C@@H](C)C1 ZINC000190007909 1432303674 /nfs/dbraw/zinc/30/36/74/1432303674.db2.gz FYCZMQRYCFHFGU-BJLQDIEVSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccccc2CC)[C@@H](C)C1 ZINC000190007909 1432303678 /nfs/dbraw/zinc/30/36/78/1432303678.db2.gz FYCZMQRYCFHFGU-BJLQDIEVSA-N 2 1 375.557 3.303 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000190141404 1432326978 /nfs/dbraw/zinc/32/69/78/1432326978.db2.gz JEUNOPOHHZAVPD-UHFFFAOYSA-N 2 1 387.503 3.337 20 0 GGADMP C[NH+](C)Cc1cccc(NC(=O)NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1 ZINC000190420101 1432378165 /nfs/dbraw/zinc/37/81/65/1432378165.db2.gz LKVCRBJDRXSLEF-QFIPXVFZSA-N 2 1 396.535 3.161 20 0 GGADMP Cc1cc(C)c(N2CC[C@H]([NH+]3CCC(OCC[NH+]4CCCC4)CC3)C2=O)c(C)c1 ZINC000190619385 1432422710 /nfs/dbraw/zinc/42/27/10/1432422710.db2.gz APNYAXUXSFSACN-QFIPXVFZSA-N 2 1 399.579 3.294 20 0 GGADMP CCN(C)c1ccc(C[NH2+]CCCN2CC[N@@H+](C)C[C@@H]2c2ccccc2)cn1 ZINC000190752361 1432467356 /nfs/dbraw/zinc/46/73/56/1432467356.db2.gz LNGLKYPBRDHTOE-JOCHJYFZSA-N 2 1 381.568 3.006 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(N(C)C(C)C)nc2)CC1 ZINC000190778390 1432476049 /nfs/dbraw/zinc/47/60/49/1432476049.db2.gz FVSCWWARIBQSQL-UHFFFAOYSA-N 2 1 395.595 3.354 20 0 GGADMP COCCN(C)c1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)cn1 ZINC000190784406 1432478065 /nfs/dbraw/zinc/47/80/65/1432478065.db2.gz RDAAKCVOARGQFF-UHFFFAOYSA-N 2 1 382.552 3.227 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(-n2cccn2)cc1C ZINC000190834500 1432500284 /nfs/dbraw/zinc/50/02/84/1432500284.db2.gz NXMLLQSRFPVIBV-HXUWFJFHSA-N 2 1 398.555 3.061 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NC[C@@H]1C[NH+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000190981131 1432542840 /nfs/dbraw/zinc/54/28/40/1432542840.db2.gz LMMXCNJJAMRMSU-DHIUTWEWSA-N 2 1 395.547 3.087 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000190981131 1432542843 /nfs/dbraw/zinc/54/28/43/1432542843.db2.gz LMMXCNJJAMRMSU-DHIUTWEWSA-N 2 1 395.547 3.087 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000190981131 1432542846 /nfs/dbraw/zinc/54/28/46/1432542846.db2.gz LMMXCNJJAMRMSU-DHIUTWEWSA-N 2 1 395.547 3.087 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3cn(C(C)(C)C)nn3)CC2)cs1 ZINC000190999055 1432546451 /nfs/dbraw/zinc/54/64/51/1432546451.db2.gz GMLYSNHWDFSVKQ-UHFFFAOYSA-N 2 1 376.574 3.054 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(OCC4CC4)cc3)CC2)CC1 ZINC000191332392 1432635103 /nfs/dbraw/zinc/63/51/03/1432635103.db2.gz VKGXXDCCPHLBOE-UHFFFAOYSA-N 2 1 399.579 3.242 20 0 GGADMP CCCN(CCC[NH+](C)C)C(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000191412658 1432656504 /nfs/dbraw/zinc/65/65/04/1432656504.db2.gz KDRZWSLXSVVKHT-SFHVURJKSA-N 2 1 376.545 3.275 20 0 GGADMP COc1ccc(C[N@@H+](C)CCCN2CC[NH+](C(C)C)CC2)cc1OC(F)F ZINC000191432638 1432660674 /nfs/dbraw/zinc/66/06/74/1432660674.db2.gz UYAWBAFWBPDMJD-UHFFFAOYSA-N 2 1 385.499 3.145 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)Nc1ccc(N2CCCC2)cc1 ZINC000191472974 1432668228 /nfs/dbraw/zinc/66/82/28/1432668228.db2.gz WIYIKBHTUMABTA-UHFFFAOYSA-N 2 1 383.540 3.396 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)Nc1ccc(N2CCCC2)cc1 ZINC000191472974 1432668232 /nfs/dbraw/zinc/66/82/32/1432668232.db2.gz WIYIKBHTUMABTA-UHFFFAOYSA-N 2 1 383.540 3.396 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)Nc1ccc(OC)c(Cl)c1 ZINC000191482393 1432669613 /nfs/dbraw/zinc/66/96/13/1432669613.db2.gz APNLZDBGABGTML-UHFFFAOYSA-N 2 1 378.904 3.458 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)Nc1ccc(OC)c(Cl)c1 ZINC000191482393 1432669614 /nfs/dbraw/zinc/66/96/14/1432669614.db2.gz APNLZDBGABGTML-UHFFFAOYSA-N 2 1 378.904 3.458 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H](O)Cn1cnc2cc(C)c(C)cc21 ZINC000191501431 1432673605 /nfs/dbraw/zinc/67/36/05/1432673605.db2.gz FLNWYWDABZOIBH-IBGZPJMESA-N 2 1 383.540 3.185 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H](O)Cn1cnc2cc(C)c(C)cc21 ZINC000191501431 1432673613 /nfs/dbraw/zinc/67/36/13/1432673613.db2.gz FLNWYWDABZOIBH-IBGZPJMESA-N 2 1 383.540 3.185 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)N1CCCc2cc(OC)ccc21 ZINC000191508800 1432675250 /nfs/dbraw/zinc/67/52/50/1432675250.db2.gz QNWANWYNAJQIKK-UHFFFAOYSA-N 2 1 384.524 3.146 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)N1CCCc2cc(OC)ccc21 ZINC000191508800 1432675253 /nfs/dbraw/zinc/67/52/53/1432675253.db2.gz QNWANWYNAJQIKK-UHFFFAOYSA-N 2 1 384.524 3.146 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](Cc2ccccc2)C[C@@H](O)c2ccco2)CC1 ZINC000191543219 1432680883 /nfs/dbraw/zinc/68/08/83/1432680883.db2.gz OAFNBUMXOAWVGE-JOCHJYFZSA-N 2 1 385.552 3.231 20 0 GGADMP CCOC(=O)c1csc(CC[NH2+][C@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000191561853 1432683430 /nfs/dbraw/zinc/68/34/30/1432683430.db2.gz FBYGYJXUZMREGB-QYZOEREBSA-N 2 1 399.560 3.363 20 0 GGADMP CC(C)N(C)c1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)cn1 ZINC000191580840 1432686791 /nfs/dbraw/zinc/68/67/91/1432686791.db2.gz ZDRGDGZXWWYZKO-JOCHJYFZSA-N 2 1 382.552 3.173 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191601805 1432690359 /nfs/dbraw/zinc/69/03/59/1432690359.db2.gz KSYSQQXYCDYYPK-AUSIDOKSSA-N 2 1 392.547 3.040 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191601805 1432690364 /nfs/dbraw/zinc/69/03/64/1432690364.db2.gz KSYSQQXYCDYYPK-AUSIDOKSSA-N 2 1 392.547 3.040 20 0 GGADMP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC1 ZINC000191646082 1432699609 /nfs/dbraw/zinc/69/96/09/1432699609.db2.gz JPUHLRSKNMVKDF-IBGZPJMESA-N 2 1 379.495 3.308 20 0 GGADMP COc1cccc2c1CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)C2 ZINC000192447616 1432845717 /nfs/dbraw/zinc/84/57/17/1432845717.db2.gz MHBHGYQTWPYNLM-FCHUYYIVSA-N 2 1 380.532 3.299 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCCCC[C@@H]2C[C@H](O)c2ccco2)CC1 ZINC000192758140 1432885548 /nfs/dbraw/zinc/88/55/48/1432885548.db2.gz OQJHEZMUAMZWSG-RTWAWAEBSA-N 2 1 377.573 3.364 20 0 GGADMP C[C@H]1COCC[N@@H+]1CCN1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000192767760 1432887752 /nfs/dbraw/zinc/88/77/52/1432887752.db2.gz NRYMQNOGQCVCOJ-KRWDZBQOSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@H]1COCC[N@H+]1CCN1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000192767760 1432887753 /nfs/dbraw/zinc/88/77/53/1432887753.db2.gz NRYMQNOGQCVCOJ-KRWDZBQOSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@H]1COCC[NH+]1CCN1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000192767760 1432887754 /nfs/dbraw/zinc/88/77/54/1432887754.db2.gz NRYMQNOGQCVCOJ-KRWDZBQOSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@H]1COCC[NH+]1CCN1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000192767760 1432887755 /nfs/dbraw/zinc/88/77/55/1432887755.db2.gz NRYMQNOGQCVCOJ-KRWDZBQOSA-N 2 1 399.501 3.322 20 0 GGADMP Cc1nn(CC(=O)OC(C)C)c(C)c1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192934723 1432909885 /nfs/dbraw/zinc/90/98/85/1432909885.db2.gz NEQQRHFMLYCYLM-OAQYLSRUSA-N 2 1 398.551 3.063 20 0 GGADMP Cc1nn(CC(=O)OC(C)C)c(C)c1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192934710 1432910005 /nfs/dbraw/zinc/91/00/05/1432910005.db2.gz NEQQRHFMLYCYLM-NRFANRHFSA-N 2 1 398.551 3.063 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H](c1ccccc1)[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000192959289 1432913380 /nfs/dbraw/zinc/91/33/80/1432913380.db2.gz QVZACBIFDAEVLT-QFBILLFUSA-N 2 1 386.565 3.097 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NC3CC[NH+](C(C)(C)C)CC3)cc2)C[C@@H](C)O1 ZINC000193448654 1433000867 /nfs/dbraw/zinc/00/08/67/1433000867.db2.gz PRQPFPULRUBZAI-QZTJIDSGSA-N 2 1 387.568 3.289 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NC3CC[NH+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000193448640 1433000886 /nfs/dbraw/zinc/00/08/86/1433000886.db2.gz PRQPFPULRUBZAI-ROUUACIJSA-N 2 1 387.568 3.289 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NC3CC[NH+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000193448625 1433000969 /nfs/dbraw/zinc/00/09/69/1433000969.db2.gz PRQPFPULRUBZAI-HDICACEKSA-N 2 1 387.568 3.289 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NC3CC[NH+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000193448625 1433000972 /nfs/dbraw/zinc/00/09/72/1433000972.db2.gz PRQPFPULRUBZAI-HDICACEKSA-N 2 1 387.568 3.289 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000193461294 1433003259 /nfs/dbraw/zinc/00/32/59/1433003259.db2.gz UMEFYRQJWKDXLU-UHFFFAOYSA-N 2 1 394.510 3.104 20 0 GGADMP Cc1ccc(CNC(=O)C2CC[NH+](CCC[NH+]3CCCCC3)CC2)cc1F ZINC000193471882 1433004900 /nfs/dbraw/zinc/00/49/00/1433004900.db2.gz VZNMCPYVADTPAA-UHFFFAOYSA-N 2 1 375.532 3.338 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC1CC[NH+](CC2CC2)CC1)c1ccccc1Cl ZINC000193621570 1433030093 /nfs/dbraw/zinc/03/00/93/1433030093.db2.gz XHDRNIYJIATIRJ-LJQANCHMSA-N 2 1 378.948 3.116 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)CC1 ZINC000193621388 1433030124 /nfs/dbraw/zinc/03/01/24/1433030124.db2.gz QFMPCNPEAZUVQJ-IBGZPJMESA-N 2 1 380.964 3.316 20 0 GGADMP COC[C@H]([NH2+]CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1ccc(Cl)cc1 ZINC000193684108 1433040118 /nfs/dbraw/zinc/04/01/18/1433040118.db2.gz BLCDASLPSLVXOA-VQTJNVASSA-N 2 1 389.927 3.036 20 0 GGADMP COC[C@@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)c1ccc(Cl)cc1 ZINC000193684125 1433040213 /nfs/dbraw/zinc/04/02/13/1433040213.db2.gz BLCDASLPSLVXOA-UXHICEINSA-N 2 1 389.927 3.036 20 0 GGADMP C[C@H](CNC(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1)[NH+]1CCc2sccc2C1 ZINC000193761639 1433054454 /nfs/dbraw/zinc/05/44/54/1433054454.db2.gz UHVKFZAQSUVLSG-QZTJIDSGSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@H](CNC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[NH+]1CCc2sccc2C1 ZINC000193761639 1433054455 /nfs/dbraw/zinc/05/44/55/1433054455.db2.gz UHVKFZAQSUVLSG-QZTJIDSGSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[N@@H+]1CCc2sccc2C1 ZINC000193761639 1433054456 /nfs/dbraw/zinc/05/44/56/1433054456.db2.gz UHVKFZAQSUVLSG-QZTJIDSGSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[N@H+]1CCc2sccc2C1 ZINC000193761639 1433054457 /nfs/dbraw/zinc/05/44/57/1433054457.db2.gz UHVKFZAQSUVLSG-QZTJIDSGSA-N 2 1 392.613 3.306 20 0 GGADMP Cc1ccc(C[NH+]2CCCN(C(=O)C[N@H+]3CCC[C@@H]3c3cccn3C)CC2)cc1 ZINC000193796008 1433061459 /nfs/dbraw/zinc/06/14/59/1433061459.db2.gz MHYSIIKWGODDFZ-HSZRJFAPSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccc(C[NH+]2CCCN(C(=O)C[N@@H+]3CCC[C@@H]3c3cccn3C)CC2)cc1 ZINC000193796008 1433061461 /nfs/dbraw/zinc/06/14/61/1433061461.db2.gz MHYSIIKWGODDFZ-HSZRJFAPSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccc(C[N@H+]2CCCN(C(=O)C[NH+]3CCC[C@@H]3c3cccn3C)CC2)cc1 ZINC000193796008 1433061463 /nfs/dbraw/zinc/06/14/63/1433061463.db2.gz MHYSIIKWGODDFZ-HSZRJFAPSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)C[NH+]3CCC[C@@H]3c3cccn3C)CC2)cc1 ZINC000193796008 1433061465 /nfs/dbraw/zinc/06/14/65/1433061465.db2.gz MHYSIIKWGODDFZ-HSZRJFAPSA-N 2 1 394.563 3.205 20 0 GGADMP CC(C)(C)[NH+]1CCC(NC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)CC1 ZINC000193846476 1433072279 /nfs/dbraw/zinc/07/22/79/1433072279.db2.gz XEXUYUMLMVVKGG-UHFFFAOYSA-N 2 1 390.547 3.306 20 0 GGADMP CC(C)(C)[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)CC1 ZINC000193846476 1433072281 /nfs/dbraw/zinc/07/22/81/1433072281.db2.gz XEXUYUMLMVVKGG-UHFFFAOYSA-N 2 1 390.547 3.306 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000193927797 1433086478 /nfs/dbraw/zinc/08/64/78/1433086478.db2.gz RHMOGFHCWDSOBB-RBUKOAKNSA-N 2 1 386.565 3.172 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000193933102 1433087860 /nfs/dbraw/zinc/08/78/60/1433087860.db2.gz ZOXKOTTYIUSUNS-QFIPXVFZSA-N 2 1 380.536 3.070 20 0 GGADMP Cc1ccc(C)c(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)c1 ZINC000194065993 1433110862 /nfs/dbraw/zinc/11/08/62/1433110862.db2.gz FYFQCRMYQHHWFA-UHFFFAOYSA-N 2 1 381.520 3.254 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000194069701 1433111500 /nfs/dbraw/zinc/11/15/00/1433111500.db2.gz YFPLXTASMAJJRD-SIKLNZKXSA-N 2 1 398.526 3.250 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000194106575 1433118717 /nfs/dbraw/zinc/11/87/17/1433118717.db2.gz FHOQJCHTURJERF-RTWAWAEBSA-N 2 1 398.551 3.484 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000194111438 1433119632 /nfs/dbraw/zinc/11/96/32/1433119632.db2.gz YVCYBIPNSHOACY-QFIPXVFZSA-N 2 1 398.595 3.462 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N[C@@H]1CC[NH+](CC2CCCC2)C1 ZINC000194210959 1433139865 /nfs/dbraw/zinc/13/98/65/1433139865.db2.gz UVCZJTQSQQIERR-FGZHOGPDSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC000194210959 1433139870 /nfs/dbraw/zinc/13/98/70/1433139870.db2.gz UVCZJTQSQQIERR-FGZHOGPDSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000194210959 1433139873 /nfs/dbraw/zinc/13/98/73/1433139873.db2.gz UVCZJTQSQQIERR-FGZHOGPDSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CC[NH+](C2CCCC2)CC1 ZINC000194226083 1433143311 /nfs/dbraw/zinc/14/33/11/1433143311.db2.gz ZCWUGRUXZGXUPL-FQEVSTJZSA-N 2 1 384.568 3.215 20 0 GGADMP Cc1ccc(N2CCC(C(=O)Nc3ccc(OCC[NH+](C)C)cc3)CC2)[nH+]c1 ZINC000194346374 1433164767 /nfs/dbraw/zinc/16/47/67/1433164767.db2.gz KSFRTFKILREFMY-UHFFFAOYSA-N 2 1 382.508 3.186 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](C2CCCCC2)CC1 ZINC000194420595 1433175175 /nfs/dbraw/zinc/17/51/75/1433175175.db2.gz KWAVBVKLFWNHGL-NRFANRHFSA-N 2 1 384.568 3.168 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000194437680 1433178071 /nfs/dbraw/zinc/17/80/71/1433178071.db2.gz HURPXMDZWHGOPC-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000194726657 1433220573 /nfs/dbraw/zinc/22/05/73/1433220573.db2.gz CEDBXOBYNJGQTA-FQEVSTJZSA-N 2 1 397.485 3.430 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)NC1CC[NH+](CC2CC2)CC1 ZINC000194981698 1433276118 /nfs/dbraw/zinc/27/61/18/1433276118.db2.gz KQIGWRGIQZHTPS-SFHVURJKSA-N 2 1 390.597 3.134 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)NC1CC[NH+](CC2CC2)CC1 ZINC000194981685 1433276133 /nfs/dbraw/zinc/27/61/33/1433276133.db2.gz KQIGWRGIQZHTPS-GOSISDBHSA-N 2 1 390.597 3.134 20 0 GGADMP c1c[nH]c([C@@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c2cccnc2)n1 ZINC000195002625 1433279505 /nfs/dbraw/zinc/27/95/05/1433279505.db2.gz ZMSCTLHTLWKEOE-QFIPXVFZSA-N 2 1 390.535 3.086 20 0 GGADMP c1c[nH]c([C@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)c2cccnc2)n1 ZINC000195087865 1433290873 /nfs/dbraw/zinc/29/08/73/1433290873.db2.gz HHIUJJLGMZVZRH-JOCHJYFZSA-N 2 1 391.519 3.201 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000195132803 1433296904 /nfs/dbraw/zinc/29/69/04/1433296904.db2.gz CFLJKGBLKKLFFZ-AEFFLSMTSA-N 2 1 390.524 3.402 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000195132803 1433296906 /nfs/dbraw/zinc/29/69/06/1433296906.db2.gz CFLJKGBLKKLFFZ-AEFFLSMTSA-N 2 1 390.524 3.402 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000195132793 1433297097 /nfs/dbraw/zinc/29/70/97/1433297097.db2.gz CFLJKGBLKKLFFZ-WMZOPIPTSA-N 2 1 390.524 3.402 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000195132793 1433297101 /nfs/dbraw/zinc/29/71/01/1433297101.db2.gz CFLJKGBLKKLFFZ-WMZOPIPTSA-N 2 1 390.524 3.402 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C1(c2ccccc2)CC[NH2+]CC1)c1ccccc1Cl ZINC000195133902 1433297271 /nfs/dbraw/zinc/29/72/71/1433297271.db2.gz XRGGVBNXRPGJMB-HXUWFJFHSA-N 2 1 385.939 3.380 20 0 GGADMP c1nn(-c2cc[nH+]cc2)c2ncnc(NC[C@H]3CC[N@H+](Cc4ccccc4)C3)c12 ZINC000195164232 1433301443 /nfs/dbraw/zinc/30/14/43/1433301443.db2.gz KRWDNWHOQHJELT-GOSISDBHSA-N 2 1 385.475 3.145 20 0 GGADMP c1nn(-c2cc[nH+]cc2)c2ncnc(NC[C@H]3CC[N@@H+](Cc4ccccc4)C3)c12 ZINC000195164232 1433301445 /nfs/dbraw/zinc/30/14/45/1433301445.db2.gz KRWDNWHOQHJELT-GOSISDBHSA-N 2 1 385.475 3.145 20 0 GGADMP c1nn(-c2cc[nH+]cc2)c2ncnc(NC[C@@H]3CC[N@H+](Cc4ccccc4)C3)c12 ZINC000195164243 1433301568 /nfs/dbraw/zinc/30/15/68/1433301568.db2.gz KRWDNWHOQHJELT-SFHVURJKSA-N 2 1 385.475 3.145 20 0 GGADMP c1nn(-c2cc[nH+]cc2)c2ncnc(NC[C@@H]3CC[N@@H+](Cc4ccccc4)C3)c12 ZINC000195164243 1433301572 /nfs/dbraw/zinc/30/15/72/1433301572.db2.gz KRWDNWHOQHJELT-SFHVURJKSA-N 2 1 385.475 3.145 20 0 GGADMP C[NH+](C)[C@H](C(=O)N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1ccccc1 ZINC000195315231 1433318392 /nfs/dbraw/zinc/31/83/92/1433318392.db2.gz UIYWTBRUXOZVEL-UNMCSNQZSA-N 2 1 393.531 3.394 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)C[NH+]1CCCC1 ZINC000195562937 1433339329 /nfs/dbraw/zinc/33/93/29/1433339329.db2.gz JNGDKRKDVGDZLM-UXHICEINSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)N[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000195606504 1433341324 /nfs/dbraw/zinc/34/13/24/1433341324.db2.gz XTPDQFGAZYSQLL-QHCPKHFHSA-N 2 1 392.547 3.009 20 0 GGADMP O=C(NCC[NH+]1CCc2ccccc2C1)N[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000195606504 1433341328 /nfs/dbraw/zinc/34/13/28/1433341328.db2.gz XTPDQFGAZYSQLL-QHCPKHFHSA-N 2 1 392.547 3.009 20 0 GGADMP O=C(NCC[NH+]1CCc2ccccc2C1)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000195606504 1433341331 /nfs/dbraw/zinc/34/13/31/1433341331.db2.gz XTPDQFGAZYSQLL-QHCPKHFHSA-N 2 1 392.547 3.009 20 0 GGADMP O[C@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)COc1cccc2[nH]ccc21 ZINC000212073726 1433358063 /nfs/dbraw/zinc/35/80/63/1433358063.db2.gz GSOWTAGGUZOCLU-HXUWFJFHSA-N 2 1 379.504 3.162 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)C1(c2ccccc2)CC[NH2+]CC1 ZINC000236654337 1433375245 /nfs/dbraw/zinc/37/52/45/1433375245.db2.gz NYBAYTNLMNTZNW-UHFFFAOYSA-N 2 1 379.548 3.464 20 0 GGADMP CC(C)c1ccc([C@H]([NH3+])CNC(=O)C[C@@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC000236821705 1433380002 /nfs/dbraw/zinc/38/00/02/1433380002.db2.gz ICFPXWBRHRXDAM-DHIUTWEWSA-N 2 1 395.547 3.217 20 0 GGADMP CC(C)c1ccc([C@H]([NH3+])CNC(=O)C[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC000236821705 1433380004 /nfs/dbraw/zinc/38/00/04/1433380004.db2.gz ICFPXWBRHRXDAM-DHIUTWEWSA-N 2 1 395.547 3.217 20 0 GGADMP CC(C)Oc1cccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000236830593 1433380516 /nfs/dbraw/zinc/38/05/16/1433380516.db2.gz KSSCJCFBKQNOFA-QFIPXVFZSA-N 2 1 395.547 3.461 20 0 GGADMP CC[N@H+](C)[C@@H](C(=O)Nc1cccc(C(=O)OC2CC[NH2+]CC2)c1)c1ccccc1 ZINC000236886879 1433382131 /nfs/dbraw/zinc/38/21/31/1433382131.db2.gz ORGMKUZUHZCZAX-OAQYLSRUSA-N 2 1 395.503 3.227 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)Nc1cccc(C(=O)OC2CC[NH2+]CC2)c1)c1ccccc1 ZINC000236886879 1433382134 /nfs/dbraw/zinc/38/21/34/1433382134.db2.gz ORGMKUZUHZCZAX-OAQYLSRUSA-N 2 1 395.503 3.227 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1Cc2ccccc2C[NH2+]1 ZINC000236896061 1433382407 /nfs/dbraw/zinc/38/24/07/1433382407.db2.gz QCKJJGXXOZILHS-OFNKIYASSA-N 2 1 377.532 3.072 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1Cc2ccccc2C[NH2+]1 ZINC000236904210 1433382702 /nfs/dbraw/zinc/38/27/02/1433382702.db2.gz QCKJJGXXOZILHS-REWPJTCUSA-N 2 1 377.532 3.072 20 0 GGADMP CCC[C@H]([NH3+])C(=O)Nc1ccccc1C[N@@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000236940976 1433383869 /nfs/dbraw/zinc/38/38/69/1433383869.db2.gz OVOJSGLKJYVKTD-IBGZPJMESA-N 2 1 397.519 3.328 20 0 GGADMP CCC[C@H]([NH3+])C(=O)Nc1ccccc1C[N@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000236940976 1433383872 /nfs/dbraw/zinc/38/38/72/1433383872.db2.gz OVOJSGLKJYVKTD-IBGZPJMESA-N 2 1 397.519 3.328 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000237007799 1433385790 /nfs/dbraw/zinc/38/57/90/1433385790.db2.gz KCUNSCGGTCLWKX-QGZVFWFLSA-N 2 1 381.586 3.241 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc4c(c3)CC(C)(C)O4)cc2)CC1 ZINC000237091405 1433388670 /nfs/dbraw/zinc/38/86/70/1433388670.db2.gz DYZSBTCEKKVHIW-UHFFFAOYSA-N 2 1 379.548 3.437 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CC[C@@H]([NH3+])C2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000237124399 1433390002 /nfs/dbraw/zinc/39/00/02/1433390002.db2.gz SPJIUYZTSVXUQT-AHCXZYCDSA-N 2 1 383.458 3.332 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2cc(C)c(OCc3ccccn3)c(C)c2)CC1 ZINC000237123922 1433390021 /nfs/dbraw/zinc/39/00/21/1433390021.db2.gz UABUMGVXEKDMCO-UHFFFAOYSA-N 2 1 383.536 3.478 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCCC[NH2+]2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000237124130 1433390129 /nfs/dbraw/zinc/39/01/29/1433390129.db2.gz KTIVVKVJDUFFCX-NJAFHUGGSA-N 2 1 383.458 3.347 20 0 GGADMP Cc1ncc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)s1 ZINC000237203917 1433392507 /nfs/dbraw/zinc/39/25/07/1433392507.db2.gz VHJHTHVNFIBXRZ-UHFFFAOYSA-N 2 1 375.538 3.231 20 0 GGADMP COc1cccc([C@@H](C)[NH+]2CCN(C(=O)CC[C@H]([NH3+])c3ccccc3)CC2)c1 ZINC000237280242 1433395814 /nfs/dbraw/zinc/39/58/14/1433395814.db2.gz RISITLALVAAVSR-GCJKJVERSA-N 2 1 381.520 3.381 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c(OC)c1 ZINC000237294218 1433396009 /nfs/dbraw/zinc/39/60/09/1433396009.db2.gz ZINFFJCJXCLEMC-SJORKVTESA-N 2 1 377.529 3.275 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(N2CC[NH+](C)CC2)c(Cl)c1)[C@H]1CCC[NH2+]C1 ZINC000237367770 1433399299 /nfs/dbraw/zinc/39/92/99/1433399299.db2.gz SMBDCZCJZCKVGQ-HOTGVXAUSA-N 2 1 378.948 3.056 20 0 GGADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)o1 ZINC000237372580 1433399571 /nfs/dbraw/zinc/39/95/71/1433399571.db2.gz PLKFTQKYSKPCIQ-BSIFCXSSSA-N 2 1 381.520 3.390 20 0 GGADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)o1 ZINC000237372580 1433399573 /nfs/dbraw/zinc/39/95/73/1433399573.db2.gz PLKFTQKYSKPCIQ-BSIFCXSSSA-N 2 1 381.520 3.390 20 0 GGADMP C[C@@H](C[NH2+]Cc1cc(Br)c2c(c1)OCCCO2)C[NH+]1CCCC1 ZINC000237400983 1433400700 /nfs/dbraw/zinc/40/07/00/1433400700.db2.gz UEBLVAZNDJAZMO-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP COc1cc2c(cc1OC)C[N@H+](Cc1ccccc1NC(=O)CC(C)(C)[NH3+])CC2 ZINC000237414240 1433402150 /nfs/dbraw/zinc/40/21/50/1433402150.db2.gz CDHOYUAIHULUHL-UHFFFAOYSA-N 2 1 397.519 3.328 20 0 GGADMP COc1cc2c(cc1OC)C[N@@H+](Cc1ccccc1NC(=O)CC(C)(C)[NH3+])CC2 ZINC000237414240 1433402156 /nfs/dbraw/zinc/40/21/56/1433402156.db2.gz CDHOYUAIHULUHL-UHFFFAOYSA-N 2 1 397.519 3.328 20 0 GGADMP C[C@H](CCNC(=O)C1(c2ccccc2)CC[NH2+]CC1)[N@@H+](C)Cc1ccccc1 ZINC000237455452 1433404009 /nfs/dbraw/zinc/40/40/09/1433404009.db2.gz HOIJKOGXNUFWPD-HXUWFJFHSA-N 2 1 379.548 3.335 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)N1CC[N@@H+](Cc2ccccc2)C2(CCCCC2)C1 ZINC000237516046 1433407281 /nfs/dbraw/zinc/40/72/81/1433407281.db2.gz NWYDKKKKSOTOGQ-LJQANCHMSA-N 2 1 375.582 3.114 20 0 GGADMP C[C@@H]1CCN(C(=O)C2(c3ccccc3)CC[NH2+]CC2)CC[N@H+]1Cc1ccccc1 ZINC000237528461 1433408156 /nfs/dbraw/zinc/40/81/56/1433408156.db2.gz AEYGAZGLRMFVCO-OAQYLSRUSA-N 2 1 391.559 3.431 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[C@@H]([NH3+])c1ccccc1 ZINC000237601417 1433412239 /nfs/dbraw/zinc/41/22/39/1433412239.db2.gz FZQPVWHNSZEZHZ-QVKFZJNVSA-N 2 1 387.474 3.382 20 0 GGADMP C[C@@H](C(=O)N1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)[C@@H]([NH3+])c1ccccc1 ZINC000237606643 1433412298 /nfs/dbraw/zinc/41/22/98/1433412298.db2.gz PBDFNEIJWOYDPS-VQQMMKBISA-N 2 1 387.568 3.060 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCC[NH2+]C3CCCCCC3)CC2)cs1 ZINC000237718869 1433418974 /nfs/dbraw/zinc/41/89/74/1433418974.db2.gz WZWSCJHYUXQDTG-UHFFFAOYSA-N 2 1 378.586 3.092 20 0 GGADMP [NH3+]CC1(C(=O)NC[C@@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CCCC1 ZINC000237826851 1433426422 /nfs/dbraw/zinc/42/64/22/1433426422.db2.gz KMUDHHACIMVPHU-IBGZPJMESA-N 2 1 383.561 3.483 20 0 GGADMP [NH3+]CC1(C(=O)NC[C@@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CCCC1 ZINC000237826851 1433426427 /nfs/dbraw/zinc/42/64/27/1433426427.db2.gz KMUDHHACIMVPHU-IBGZPJMESA-N 2 1 383.561 3.483 20 0 GGADMP O=C(N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000237840860 1433428417 /nfs/dbraw/zinc/42/84/17/1433428417.db2.gz NMHGCJZYWWLRSO-UHFFFAOYSA-N 2 1 395.522 3.181 20 0 GGADMP O=C(N1CCC[N@H+](Cc2ccc(F)cc2)CC1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000237840860 1433428420 /nfs/dbraw/zinc/42/84/20/1433428420.db2.gz NMHGCJZYWWLRSO-UHFFFAOYSA-N 2 1 395.522 3.181 20 0 GGADMP [NH3+][C@H](CC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000237869694 1433430411 /nfs/dbraw/zinc/43/04/11/1433430411.db2.gz DCSJESLGTHGDPA-RTBURBONSA-N 2 1 391.437 3.486 20 0 GGADMP [NH3+][C@@H](CC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000237898145 1433432786 /nfs/dbraw/zinc/43/27/86/1433432786.db2.gz DCSJESLGTHGDPA-MOPGFXCFSA-N 2 1 391.437 3.486 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000238022028 1433439690 /nfs/dbraw/zinc/43/96/90/1433439690.db2.gz JGSAGHQBPUSSQF-UHFFFAOYSA-N 2 1 392.503 3.119 20 0 GGADMP [NH3+]CC1(C(=O)NC2CC[NH+](Cc3cccc(C(F)(F)F)c3)CC2)CCCC1 ZINC000238048482 1433441162 /nfs/dbraw/zinc/44/11/62/1433441162.db2.gz OMIRRNKZRYJMAE-UHFFFAOYSA-N 2 1 383.458 3.305 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000245202268 1433455158 /nfs/dbraw/zinc/45/51/58/1433455158.db2.gz QEZUNJGSRWHRHZ-OWCLPIDISA-N 2 1 379.495 3.307 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000245202268 1433455161 /nfs/dbraw/zinc/45/51/61/1433455161.db2.gz QEZUNJGSRWHRHZ-OWCLPIDISA-N 2 1 379.495 3.307 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000245392607 1433458799 /nfs/dbraw/zinc/45/87/99/1433458799.db2.gz ULYCVFDFVRIYBO-QYZOEREBSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000245392607 1433458802 /nfs/dbraw/zinc/45/88/02/1433458802.db2.gz ULYCVFDFVRIYBO-QYZOEREBSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000245392607 1433458806 /nfs/dbraw/zinc/45/88/06/1433458806.db2.gz ULYCVFDFVRIYBO-QYZOEREBSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000245454970 1433470851 /nfs/dbraw/zinc/47/08/51/1433470851.db2.gz HTKIWSCKUMGWLX-QZTJIDSGSA-N 2 1 381.586 3.242 20 0 GGADMP COc1cccc([C@H]2[C@@H](NC(=O)CN(C)Cc3ccccc3)CC[N@H+]2C2CC2)c1 ZINC000245535118 1433481952 /nfs/dbraw/zinc/48/19/52/1433481952.db2.gz FHBFBMBWQLSMOU-UPVQGACJSA-N 2 1 393.531 3.221 20 0 GGADMP COc1cccc([C@H]2[C@@H](NC(=O)CN(C)Cc3ccccc3)CCN2C2CC2)c1 ZINC000245535118 1433481955 /nfs/dbraw/zinc/48/19/55/1433481955.db2.gz FHBFBMBWQLSMOU-UPVQGACJSA-N 2 1 393.531 3.221 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H](O)CN2Cc2ccccc2)cc1 ZINC000245588795 1433488358 /nfs/dbraw/zinc/48/83/58/1433488358.db2.gz KMNJXZCSPPVDQP-NTUVXCKYSA-N 2 1 390.531 3.467 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000245587292 1433488400 /nfs/dbraw/zinc/48/84/00/1433488400.db2.gz AONJKVFGYXACIR-RTBURBONSA-N 2 1 392.613 3.333 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000245587292 1433488401 /nfs/dbraw/zinc/48/84/01/1433488401.db2.gz AONJKVFGYXACIR-RTBURBONSA-N 2 1 392.613 3.333 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000245587292 1433488403 /nfs/dbraw/zinc/48/84/03/1433488403.db2.gz AONJKVFGYXACIR-RTBURBONSA-N 2 1 392.613 3.333 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000245587918 1433488438 /nfs/dbraw/zinc/48/84/38/1433488438.db2.gz APEALCAWCLEXEH-ZWKOTPCHSA-N 2 1 378.586 3.258 20 0 GGADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000245589850 1433488571 /nfs/dbraw/zinc/48/85/71/1433488571.db2.gz KLMBXHUBIFCSSX-GDBMZVCRSA-N 2 1 381.446 3.412 20 0 GGADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000245589850 1433488577 /nfs/dbraw/zinc/48/85/77/1433488577.db2.gz KLMBXHUBIFCSSX-GDBMZVCRSA-N 2 1 381.446 3.412 20 0 GGADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000245589850 1433488580 /nfs/dbraw/zinc/48/85/80/1433488580.db2.gz KLMBXHUBIFCSSX-GDBMZVCRSA-N 2 1 381.446 3.412 20 0 GGADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000245589851 1433488682 /nfs/dbraw/zinc/48/86/82/1433488682.db2.gz KLMBXHUBIFCSSX-ZBFHGGJFSA-N 2 1 381.446 3.412 20 0 GGADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000245589851 1433488684 /nfs/dbraw/zinc/48/86/84/1433488684.db2.gz KLMBXHUBIFCSSX-ZBFHGGJFSA-N 2 1 381.446 3.412 20 0 GGADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000245589851 1433488685 /nfs/dbraw/zinc/48/86/85/1433488685.db2.gz KLMBXHUBIFCSSX-ZBFHGGJFSA-N 2 1 381.446 3.412 20 0 GGADMP CC(C)c1ccc(OCCNC(=O)C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000245602541 1433489711 /nfs/dbraw/zinc/48/97/11/1433489711.db2.gz MSJJPWQQCWZOBD-GHTZIAJQSA-N 2 1 384.524 3.085 20 0 GGADMP CC(C)c1ccc(OCCNC(=O)CN2CC[C@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000245602541 1433489713 /nfs/dbraw/zinc/48/97/13/1433489713.db2.gz MSJJPWQQCWZOBD-GHTZIAJQSA-N 2 1 384.524 3.085 20 0 GGADMP CC(C)c1ccc(OCCNC(=O)C[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000245602547 1433489782 /nfs/dbraw/zinc/48/97/82/1433489782.db2.gz MSJJPWQQCWZOBD-WIYYLYMNSA-N 2 1 384.524 3.085 20 0 GGADMP CC(C)c1ccc(OCCNC(=O)CN2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000245602547 1433489785 /nfs/dbraw/zinc/48/97/85/1433489785.db2.gz MSJJPWQQCWZOBD-WIYYLYMNSA-N 2 1 384.524 3.085 20 0 GGADMP CC(C)CCO[C@H](C)C(=O)N(C)[C@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000245622255 1433491992 /nfs/dbraw/zinc/49/19/92/1433491992.db2.gz BFQXYPCZADHTOT-NRSPTQNISA-N 2 1 381.605 3.233 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000245639959 1433494157 /nfs/dbraw/zinc/49/41/57/1433494157.db2.gz DCHVEVSJNTUGGX-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000245639959 1433494160 /nfs/dbraw/zinc/49/41/60/1433494160.db2.gz DCHVEVSJNTUGGX-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000245639959 1433494163 /nfs/dbraw/zinc/49/41/63/1433494163.db2.gz DCHVEVSJNTUGGX-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1)[NH+](C)C1CC1 ZINC000245644801 1433494702 /nfs/dbraw/zinc/49/47/02/1433494702.db2.gz AWYPVXYCHJLCEE-WTANOLMUSA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1)[N@H+](C)C1CC1 ZINC000245644801 1433494705 /nfs/dbraw/zinc/49/47/05/1433494705.db2.gz AWYPVXYCHJLCEE-WTANOLMUSA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1)[N@@H+](C)C1CC1 ZINC000245644801 1433494708 /nfs/dbraw/zinc/49/47/08/1433494708.db2.gz AWYPVXYCHJLCEE-WTANOLMUSA-N 2 1 396.938 3.254 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)NC[C@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245644871 1433495111 /nfs/dbraw/zinc/49/51/11/1433495111.db2.gz AZKLBUCFSAIZEZ-LZQZEXGQSA-N 2 1 381.923 3.463 20 0 GGADMP CC[NH+]1CCCC[C@@H]1C(=O)NC[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245644871 1433495113 /nfs/dbraw/zinc/49/51/13/1433495113.db2.gz AZKLBUCFSAIZEZ-LZQZEXGQSA-N 2 1 381.923 3.463 20 0 GGADMP CC[NH+]1CCCC[C@@H]1C(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245644871 1433495115 /nfs/dbraw/zinc/49/51/15/1433495115.db2.gz AZKLBUCFSAIZEZ-LZQZEXGQSA-N 2 1 381.923 3.463 20 0 GGADMP C[NH+]1CC[C@@H](CNC(=O)NC[C@H]2CCC[N@@H+](C)C2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245653858 1433495831 /nfs/dbraw/zinc/49/58/31/1433495831.db2.gz CZIOBGYVZOSRPR-ALKREAHSSA-N 2 1 396.938 3.113 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH+]2CCC[C@H]2c2ccncc2)CC1 ZINC000245686820 1433499699 /nfs/dbraw/zinc/49/96/99/1433499699.db2.gz PRXCLGALMLHKJS-QHCPKHFHSA-N 2 1 392.547 3.261 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)C[NH+]2CCC[C@H]2c2ccncc2)CC1 ZINC000245686820 1433499700 /nfs/dbraw/zinc/49/97/00/1433499700.db2.gz PRXCLGALMLHKJS-QHCPKHFHSA-N 2 1 392.547 3.261 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@@H+]2CCC[C@H]2c2ccncc2)CC1 ZINC000245686820 1433499701 /nfs/dbraw/zinc/49/97/01/1433499701.db2.gz PRXCLGALMLHKJS-QHCPKHFHSA-N 2 1 392.547 3.261 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@H+]2CCC[C@H]2c2ccncc2)CC1 ZINC000245686820 1433499702 /nfs/dbraw/zinc/49/97/02/1433499702.db2.gz PRXCLGALMLHKJS-QHCPKHFHSA-N 2 1 392.547 3.261 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c(C)c1 ZINC000245837127 1433524344 /nfs/dbraw/zinc/52/43/44/1433524344.db2.gz HHWYICDKZXLJHV-ROUUACIJSA-N 2 1 397.523 3.028 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)[C@H](C)[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c(C)c1 ZINC000245837127 1433524347 /nfs/dbraw/zinc/52/43/47/1433524347.db2.gz HHWYICDKZXLJHV-ROUUACIJSA-N 2 1 397.523 3.028 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1 ZINC000245852578 1433526854 /nfs/dbraw/zinc/52/68/54/1433526854.db2.gz MPKMAWNDAGSNQP-RBBKRZOGSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCNC(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000245852578 1433526859 /nfs/dbraw/zinc/52/68/59/1433526859.db2.gz MPKMAWNDAGSNQP-RBBKRZOGSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCNC(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000245852578 1433526865 /nfs/dbraw/zinc/52/68/65/1433526865.db2.gz MPKMAWNDAGSNQP-RBBKRZOGSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)C[C@H](C)O1 ZINC000245892687 1433535597 /nfs/dbraw/zinc/53/55/97/1433535597.db2.gz MKRXHCAQYZZFBS-OPVJXMOQSA-N 2 1 376.541 3.222 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21)c1ccccc1Cl ZINC000245993581 1433554656 /nfs/dbraw/zinc/55/46/56/1433554656.db2.gz RAEZAJZBXSPNAY-KFKAGJAMSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21)c1ccccc1Cl ZINC000245993581 1433554661 /nfs/dbraw/zinc/55/46/61/1433554661.db2.gz RAEZAJZBXSPNAY-KFKAGJAMSA-N 2 1 378.948 3.068 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@H]2C[NH+](C)CC[C@H]21 ZINC000246018194 1433558167 /nfs/dbraw/zinc/55/81/67/1433558167.db2.gz URMMKMJIYJNVGC-RNJSZURPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21 ZINC000246018194 1433558172 /nfs/dbraw/zinc/55/81/72/1433558172.db2.gz URMMKMJIYJNVGC-RNJSZURPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21 ZINC000246018194 1433558177 /nfs/dbraw/zinc/55/81/77/1433558177.db2.gz URMMKMJIYJNVGC-RNJSZURPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@@H](C)N2CCOCC2)cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000246053646 1433562254 /nfs/dbraw/zinc/56/22/54/1433562254.db2.gz DYDJPPNXKZMVMM-GUDVDZBRSA-N 2 1 388.556 3.322 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000246053646 1433562260 /nfs/dbraw/zinc/56/22/60/1433562260.db2.gz DYDJPPNXKZMVMM-GUDVDZBRSA-N 2 1 388.556 3.322 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000246053646 1433562265 /nfs/dbraw/zinc/56/22/65/1433562265.db2.gz DYDJPPNXKZMVMM-GUDVDZBRSA-N 2 1 388.556 3.322 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@H](C)c1cccc(F)c1F ZINC000246056044 1433562609 /nfs/dbraw/zinc/56/26/09/1433562609.db2.gz XXEKAJWRRZKGKP-HZPDHXFCSA-N 2 1 382.499 3.083 20 0 GGADMP C[C@@H]1CCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000246111472 1433570437 /nfs/dbraw/zinc/57/04/37/1433570437.db2.gz HUQKEHJTLFBIST-UYAOXDASSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@@H]1CCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)CC[N@H+]1Cc1ccccc1 ZINC000246111472 1433570438 /nfs/dbraw/zinc/57/04/38/1433570438.db2.gz HUQKEHJTLFBIST-UYAOXDASSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[NH+]1C1CC1 ZINC000246135213 1433573030 /nfs/dbraw/zinc/57/30/30/1433573030.db2.gz BHRYCJULUIGJSK-RMEPHLEKSA-N 2 1 384.568 3.306 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[NH+]1C1CC1 ZINC000246135213 1433573033 /nfs/dbraw/zinc/57/30/33/1433573033.db2.gz BHRYCJULUIGJSK-RMEPHLEKSA-N 2 1 384.568 3.306 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)N[C@H](C)C(C)(C)C[NH+](C)C ZINC000246149019 1433574933 /nfs/dbraw/zinc/57/49/33/1433574933.db2.gz CPIMOPPGYCCBMB-QUCCMNQESA-N 2 1 389.588 3.054 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)c2ccccc2)CC1 ZINC000246174953 1433578114 /nfs/dbraw/zinc/57/81/14/1433578114.db2.gz GKHAPDNBVSOANC-BAGYTPMASA-N 2 1 386.584 3.441 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1CN(C)Cc1ccco1 ZINC000246192291 1433580018 /nfs/dbraw/zinc/58/00/18/1433580018.db2.gz IKSZTBPBSZICJI-PGRDOPGGSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000246192291 1433580022 /nfs/dbraw/zinc/58/00/22/1433580022.db2.gz IKSZTBPBSZICJI-PGRDOPGGSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000246192291 1433580024 /nfs/dbraw/zinc/58/00/24/1433580024.db2.gz IKSZTBPBSZICJI-PGRDOPGGSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@H]1C[NH+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000246192291 1433580028 /nfs/dbraw/zinc/58/00/28/1433580028.db2.gz IKSZTBPBSZICJI-PGRDOPGGSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@H]1C[NH+](C)CC[C@H]1N(C)C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000246192291 1433580031 /nfs/dbraw/zinc/58/00/31/1433580031.db2.gz IKSZTBPBSZICJI-PGRDOPGGSA-N 2 1 398.551 3.393 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)[NH+](C)C)cc1 ZINC000246209450 1433582094 /nfs/dbraw/zinc/58/20/94/1433582094.db2.gz AJXCNMXSCCYZKZ-BVSLBCMMSA-N 2 1 384.568 3.256 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)[NH+](C)C)cc1 ZINC000246209458 1433582155 /nfs/dbraw/zinc/58/21/55/1433582155.db2.gz AJXCNMXSCCYZKZ-NNWRFLSQSA-N 2 1 384.568 3.256 20 0 GGADMP O=C(C[N@H+]1CCS[C@@H]2CCCC[C@H]21)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000246219072 1433583101 /nfs/dbraw/zinc/58/31/01/1433583101.db2.gz ZIOKKECBHSEBPG-NHCUHLMSSA-N 2 1 387.593 3.259 20 0 GGADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246219985 1433583414 /nfs/dbraw/zinc/58/34/14/1433583414.db2.gz BGCCFBFQQHCBSA-RVDAZCDBSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[NH+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246219985 1433583416 /nfs/dbraw/zinc/58/34/16/1433583416.db2.gz BGCCFBFQQHCBSA-RVDAZCDBSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[NH+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246219985 1433583418 /nfs/dbraw/zinc/58/34/18/1433583418.db2.gz BGCCFBFQQHCBSA-RVDAZCDBSA-N 2 1 376.589 3.011 20 0 GGADMP Clc1cccc(N2CCN(CCC[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CC2)c1 ZINC000246229755 1433584718 /nfs/dbraw/zinc/58/47/18/1433584718.db2.gz FUHUPEWWFPNSMZ-FPOVZHCZSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCN[C@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)c1 ZINC000246229755 1433584719 /nfs/dbraw/zinc/58/47/19/1433584719.db2.gz FUHUPEWWFPNSMZ-FPOVZHCZSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCN[C@H]3CC[N@H+]4CCC[C@H]4C3)CC2)c1 ZINC000246229755 1433584721 /nfs/dbraw/zinc/58/47/21/1433584721.db2.gz FUHUPEWWFPNSMZ-FPOVZHCZSA-N 2 1 376.976 3.069 20 0 GGADMP C[C@H](CC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)[C@H]1CCC[NH2+]C1 ZINC000246234602 1433584862 /nfs/dbraw/zinc/58/48/62/1433584862.db2.gz ICRQSLNIWHNTGA-HHXXYDBFSA-N 2 1 397.485 3.422 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246287801 1433590003 /nfs/dbraw/zinc/59/00/03/1433590003.db2.gz IGKFRACJKLMUDI-GGPKGHCWSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246287801 1433590006 /nfs/dbraw/zinc/59/00/06/1433590006.db2.gz IGKFRACJKLMUDI-GGPKGHCWSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246287801 1433590009 /nfs/dbraw/zinc/59/00/09/1433590009.db2.gz IGKFRACJKLMUDI-GGPKGHCWSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)C1 ZINC000246290990 1433590666 /nfs/dbraw/zinc/59/06/66/1433590666.db2.gz DFLVCIRKEKWUEB-QRVBRYPASA-N 2 1 376.545 3.178 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)C1 ZINC000246290990 1433590669 /nfs/dbraw/zinc/59/06/69/1433590669.db2.gz DFLVCIRKEKWUEB-QRVBRYPASA-N 2 1 376.545 3.178 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246321666 1433594526 /nfs/dbraw/zinc/59/45/26/1433594526.db2.gz KOQJREKFBVJLTJ-DYQZNNLLSA-N 2 1 390.616 3.403 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246321666 1433594529 /nfs/dbraw/zinc/59/45/29/1433594529.db2.gz KOQJREKFBVJLTJ-DYQZNNLLSA-N 2 1 390.616 3.403 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246321666 1433594532 /nfs/dbraw/zinc/59/45/32/1433594532.db2.gz KOQJREKFBVJLTJ-DYQZNNLLSA-N 2 1 390.616 3.403 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)CC1 ZINC000246320495 1433594538 /nfs/dbraw/zinc/59/45/38/1433594538.db2.gz GVJSKQOQIYWALT-WOJBJXKFSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000246323783 1433595046 /nfs/dbraw/zinc/59/50/46/1433595046.db2.gz HFCYWTSWALHWAU-NJDAHSKKSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)C1 ZINC000246323783 1433595050 /nfs/dbraw/zinc/59/50/50/1433595050.db2.gz HFCYWTSWALHWAU-NJDAHSKKSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)C1 ZINC000246323783 1433595052 /nfs/dbraw/zinc/59/50/52/1433595052.db2.gz HFCYWTSWALHWAU-NJDAHSKKSA-N 2 1 378.605 3.403 20 0 GGADMP O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246324975 1433595272 /nfs/dbraw/zinc/59/52/72/1433595272.db2.gz CMBGZQKEVWIWOM-ACIOBRDBSA-N 2 1 396.579 3.482 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000246327238 1433595640 /nfs/dbraw/zinc/59/56/40/1433595640.db2.gz HPQYKVVMDPSWCF-OALUTQOASA-N 2 1 386.540 3.311 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000246327238 1433595642 /nfs/dbraw/zinc/59/56/42/1433595642.db2.gz HPQYKVVMDPSWCF-OALUTQOASA-N 2 1 386.540 3.311 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000246327238 1433595645 /nfs/dbraw/zinc/59/56/45/1433595645.db2.gz HPQYKVVMDPSWCF-OALUTQOASA-N 2 1 386.540 3.311 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000246334428 1433596349 /nfs/dbraw/zinc/59/63/49/1433596349.db2.gz BVKDLZYQGIUFLO-CEXWTWQISA-N 2 1 395.613 3.346 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000246334130 1433596443 /nfs/dbraw/zinc/59/64/43/1433596443.db2.gz HHRGRYUZTGWMQJ-UXJHKWJQSA-N 2 1 386.584 3.315 20 0 GGADMP OC[C@@H]1c2ccccc2CC[NH+]1CCCCC[N@H+]1CCc2ccccc2[C@H]1CO ZINC000246356110 1433599931 /nfs/dbraw/zinc/59/99/31/1433599931.db2.gz JRWCHDQKZBQBPI-JWQCQUIFSA-N 2 1 394.559 3.340 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(C)[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000246359677 1433600170 /nfs/dbraw/zinc/60/01/70/1433600170.db2.gz IIUZWNFMGCPSFZ-VXKWHMMOSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(C)[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000246359686 1433600299 /nfs/dbraw/zinc/60/02/99/1433600299.db2.gz IIUZWNFMGCPSFZ-YADHBBJMSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCCN2Cc2ccc(F)cc2)C1 ZINC000246361906 1433600472 /nfs/dbraw/zinc/60/04/72/1433600472.db2.gz GPVHNDOTBKGLPF-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@H](CNC(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000246361906 1433600475 /nfs/dbraw/zinc/60/04/75/1433600475.db2.gz GPVHNDOTBKGLPF-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000246361906 1433600477 /nfs/dbraw/zinc/60/04/77/1433600477.db2.gz GPVHNDOTBKGLPF-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000246361906 1433600480 /nfs/dbraw/zinc/60/04/80/1433600480.db2.gz GPVHNDOTBKGLPF-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000246361906 1433600483 /nfs/dbraw/zinc/60/04/83/1433600483.db2.gz GPVHNDOTBKGLPF-TZIWHRDSSA-N 2 1 375.532 3.274 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]([NH+]2CCCC2)C1 ZINC000246364795 1433600904 /nfs/dbraw/zinc/60/09/04/1433600904.db2.gz KRFLQFYEUQIGMW-YUVXSKOASA-N 2 1 384.568 3.023 20 0 GGADMP CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000246362985 1433601138 /nfs/dbraw/zinc/60/11/38/1433601138.db2.gz PWJICHCDRKNZFZ-ROUUACIJSA-N 2 1 385.487 3.088 20 0 GGADMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000246362985 1433601139 /nfs/dbraw/zinc/60/11/39/1433601139.db2.gz PWJICHCDRKNZFZ-ROUUACIJSA-N 2 1 385.487 3.088 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NC2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000246364029 1433601176 /nfs/dbraw/zinc/60/11/76/1433601176.db2.gz KNEUPJHIHQLRQB-SBHAEUEKSA-N 2 1 386.584 3.126 20 0 GGADMP O=C([C@@H]1CCC[N@H+]1Cc1ccc(F)cc1)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246368789 1433601940 /nfs/dbraw/zinc/60/19/40/1433601940.db2.gz HDTMSIQQUGJIIS-BWAGFHJFSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246368789 1433601944 /nfs/dbraw/zinc/60/19/44/1433601944.db2.gz HDTMSIQQUGJIIS-BWAGFHJFSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccc(F)cc1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246368789 1433601946 /nfs/dbraw/zinc/60/19/46/1433601946.db2.gz HDTMSIQQUGJIIS-BWAGFHJFSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccc(F)cc1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246368789 1433601950 /nfs/dbraw/zinc/60/19/50/1433601950.db2.gz HDTMSIQQUGJIIS-BWAGFHJFSA-N 2 1 385.527 3.265 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000246389436 1433605429 /nfs/dbraw/zinc/60/54/29/1433605429.db2.gz OFTKXUMMCGMRBK-JIWOIOHBSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@@H]1CC[NH+](C)C[C@@H]1C ZINC000246389436 1433605432 /nfs/dbraw/zinc/60/54/32/1433605432.db2.gz OFTKXUMMCGMRBK-JIWOIOHBSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@@H]1CC[NH+](C)C[C@@H]1C ZINC000246389436 1433605434 /nfs/dbraw/zinc/60/54/34/1433605434.db2.gz OFTKXUMMCGMRBK-JIWOIOHBSA-N 2 1 386.584 3.125 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)C1 ZINC000246403836 1433607976 /nfs/dbraw/zinc/60/79/76/1433607976.db2.gz LMZNQBXFSGYLTO-PWRODBHTSA-N 2 1 378.605 3.260 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)C1 ZINC000246403836 1433607981 /nfs/dbraw/zinc/60/79/81/1433607981.db2.gz LMZNQBXFSGYLTO-PWRODBHTSA-N 2 1 378.605 3.260 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)C1 ZINC000246403836 1433607987 /nfs/dbraw/zinc/60/79/87/1433607987.db2.gz LMZNQBXFSGYLTO-PWRODBHTSA-N 2 1 378.605 3.260 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1)c1cccc(OC)c1 ZINC000246409418 1433608645 /nfs/dbraw/zinc/60/86/45/1433608645.db2.gz LQPLMDLISNSCBR-PLMTUMEDSA-N 2 1 388.556 3.003 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000246420887 1433610133 /nfs/dbraw/zinc/61/01/33/1433610133.db2.gz SDLBTVBRLIURFW-HSALFYBXSA-N 2 1 387.568 3.075 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N(C)[C@H]3CC[N@@H+](C)C[C@H]3C)cc2)CC1 ZINC000246428149 1433611283 /nfs/dbraw/zinc/61/12/83/1433611283.db2.gz WGMAYKYXMSYYRR-KNQAVFIVSA-N 2 1 386.584 3.400 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N(C)[C@@H]3CC[N@@H+](C)C[C@H]3C)cc2)CC1 ZINC000246428133 1433611397 /nfs/dbraw/zinc/61/13/97/1433611397.db2.gz WGMAYKYXMSYYRR-DENIHFKCSA-N 2 1 386.584 3.400 20 0 GGADMP Cc1ccc(CN(C(=O)CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C2CC2)cc1 ZINC000246433053 1433612359 /nfs/dbraw/zinc/61/23/59/1433612359.db2.gz CSEVMELWRZTZSF-REWPJTCUSA-N 2 1 381.564 3.435 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[N@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc12 ZINC000246444788 1433614000 /nfs/dbraw/zinc/61/40/00/1433614000.db2.gz DNBJFBSHIYPIHG-UWJYYQICSA-N 2 1 382.504 3.429 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[NH+]3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)ccc12 ZINC000246444788 1433614003 /nfs/dbraw/zinc/61/40/03/1433614003.db2.gz DNBJFBSHIYPIHG-UWJYYQICSA-N 2 1 382.504 3.429 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000246463572 1433616103 /nfs/dbraw/zinc/61/61/03/1433616103.db2.gz QBPCILDHEGQLQQ-MSOLQXFVSA-N 2 1 391.556 3.379 20 0 GGADMP CN(C1CC[NH+](C)CC1)[C@@H]1CCCC[C@@H]1N(C)S(=O)(=O)CCC(C)(C)C ZINC000246467697 1433617080 /nfs/dbraw/zinc/61/70/80/1433617080.db2.gz JJKHAWPVZRRSNM-MOPGFXCFSA-N 2 1 387.634 3.021 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1 ZINC000246477148 1433618671 /nfs/dbraw/zinc/61/86/71/1433618671.db2.gz VPFOMMNBJJHABK-FGZHOGPDSA-N 2 1 386.584 3.067 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000246477148 1433618674 /nfs/dbraw/zinc/61/86/74/1433618674.db2.gz VPFOMMNBJJHABK-FGZHOGPDSA-N 2 1 386.584 3.067 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000246477148 1433618677 /nfs/dbraw/zinc/61/86/77/1433618677.db2.gz VPFOMMNBJJHABK-FGZHOGPDSA-N 2 1 386.584 3.067 20 0 GGADMP CC(C)[N@@H+]1CCC[C@H](CNC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000246483738 1433619478 /nfs/dbraw/zinc/61/94/78/1433619478.db2.gz RSPNMEVMCNBXIL-VQIMIIECSA-N 2 1 380.964 3.362 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000246483738 1433619480 /nfs/dbraw/zinc/61/94/80/1433619480.db2.gz RSPNMEVMCNBXIL-VQIMIIECSA-N 2 1 380.964 3.362 20 0 GGADMP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000246483715 1433619537 /nfs/dbraw/zinc/61/95/37/1433619537.db2.gz RSPNMEVMCNBXIL-QFBILLFUSA-N 2 1 380.964 3.362 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000246483715 1433619538 /nfs/dbraw/zinc/61/95/38/1433619538.db2.gz RSPNMEVMCNBXIL-QFBILLFUSA-N 2 1 380.964 3.362 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N2CC[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC000246486217 1433619751 /nfs/dbraw/zinc/61/97/51/1433619751.db2.gz VZTNWTUVLOXWIU-BWAGFHJFSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@H]1CCC[NH+](Cc2ccccc2CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)C1 ZINC000246486217 1433619752 /nfs/dbraw/zinc/61/97/52/1433619752.db2.gz VZTNWTUVLOXWIU-BWAGFHJFSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@H]1CCC[NH+](Cc2ccccc2CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000246486217 1433619753 /nfs/dbraw/zinc/61/97/53/1433619753.db2.gz VZTNWTUVLOXWIU-BWAGFHJFSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)[C@@H]2CCCCCC[C@H]2[NH3+])C[C@@H](C)O1 ZINC000246504774 1433622589 /nfs/dbraw/zinc/62/25/89/1433622589.db2.gz QCISIILWRCMJMY-MCEIDBOGSA-N 2 1 387.568 3.210 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@H](c1ncccc1C)C(C)C ZINC000246514361 1433623825 /nfs/dbraw/zinc/62/38/25/1433623825.db2.gz XDMCQTQCQHUHLP-UXHICEINSA-N 2 1 389.588 3.145 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246513365 1433623841 /nfs/dbraw/zinc/62/38/41/1433623841.db2.gz UFJIKSGWEUCPGP-DYXWJJEUSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246513365 1433623842 /nfs/dbraw/zinc/62/38/42/1433623842.db2.gz UFJIKSGWEUCPGP-DYXWJJEUSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246513365 1433623843 /nfs/dbraw/zinc/62/38/43/1433623843.db2.gz UFJIKSGWEUCPGP-DYXWJJEUSA-N 2 1 376.589 3.013 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246542591 1433628704 /nfs/dbraw/zinc/62/87/04/1433628704.db2.gz JYCPHTHWAFMFGY-RXOYHEDQSA-N 2 1 384.564 3.390 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246542591 1433628709 /nfs/dbraw/zinc/62/87/09/1433628709.db2.gz JYCPHTHWAFMFGY-RXOYHEDQSA-N 2 1 384.564 3.390 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246542591 1433628713 /nfs/dbraw/zinc/62/87/13/1433628713.db2.gz JYCPHTHWAFMFGY-RXOYHEDQSA-N 2 1 384.564 3.390 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)N[C@H]2c3ccccc3CC[C@H]2n2ccnc2)C1 ZINC000246547652 1433629504 /nfs/dbraw/zinc/62/95/04/1433629504.db2.gz DEOSVDMEDKWEHB-UIFIKXQLSA-N 2 1 381.524 3.143 20 0 GGADMP CNc1cc(N2CCC[C@@H]2CNC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)ncn1 ZINC000246553537 1433630379 /nfs/dbraw/zinc/63/03/79/1433630379.db2.gz WRQKAZWPFNHKON-YZGWKJHDSA-N 3 1 386.588 3.120 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246553332 1433630475 /nfs/dbraw/zinc/63/04/75/1433630475.db2.gz WEGSIBXAGAFVFP-SVFBPWRDSA-N 2 1 387.568 3.004 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246553332 1433630479 /nfs/dbraw/zinc/63/04/79/1433630479.db2.gz WEGSIBXAGAFVFP-SVFBPWRDSA-N 2 1 387.568 3.004 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246553332 1433630483 /nfs/dbraw/zinc/63/04/83/1433630483.db2.gz WEGSIBXAGAFVFP-SVFBPWRDSA-N 2 1 387.568 3.004 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246553332 1433630486 /nfs/dbraw/zinc/63/04/86/1433630486.db2.gz WEGSIBXAGAFVFP-SVFBPWRDSA-N 2 1 387.568 3.004 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(C(=O)NCC3CC[NH+](Cc4cccs4)CC3)CC[C@H]21 ZINC000246573143 1433633125 /nfs/dbraw/zinc/63/31/25/1433633125.db2.gz BYNWJMAGDQCLIR-AZUAARDMSA-N 2 1 390.597 3.086 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@@H]1C[C@@H](C)[N@@H+](C2CC2)C1 ZINC000246578432 1433634001 /nfs/dbraw/zinc/63/40/01/1433634001.db2.gz WPKOZZNRQADKBL-HMXCVIKNSA-N 2 1 384.568 3.165 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000246578432 1433634002 /nfs/dbraw/zinc/63/40/02/1433634002.db2.gz WPKOZZNRQADKBL-HMXCVIKNSA-N 2 1 384.568 3.165 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CC[C@@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000246579675 1433634348 /nfs/dbraw/zinc/63/43/48/1433634348.db2.gz ZSEVEIKWXIPEFS-IFMALSPDSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000246579675 1433634350 /nfs/dbraw/zinc/63/43/50/1433634350.db2.gz ZSEVEIKWXIPEFS-IFMALSPDSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)C1 ZINC000246579675 1433634355 /nfs/dbraw/zinc/63/43/55/1433634355.db2.gz ZSEVEIKWXIPEFS-IFMALSPDSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000246590302 1433635434 /nfs/dbraw/zinc/63/54/34/1433635434.db2.gz PNZCVJSWESVMFR-CEMLEFRQSA-N 2 1 384.568 3.309 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589440 1433635473 /nfs/dbraw/zinc/63/54/73/1433635473.db2.gz AZXMUHMGMBBZDO-HSALFYBXSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589440 1433635474 /nfs/dbraw/zinc/63/54/74/1433635474.db2.gz AZXMUHMGMBBZDO-HSALFYBXSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589440 1433635475 /nfs/dbraw/zinc/63/54/75/1433635475.db2.gz AZXMUHMGMBBZDO-HSALFYBXSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589440 1433635476 /nfs/dbraw/zinc/63/54/76/1433635476.db2.gz AZXMUHMGMBBZDO-HSALFYBXSA-N 2 1 385.552 3.494 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NCC(C)(C)[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000246676176 1433648389 /nfs/dbraw/zinc/64/83/89/1433648389.db2.gz CPSGPRWWDOHIQM-QZTJIDSGSA-N 2 1 375.561 3.303 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)C1 ZINC000246676176 1433648393 /nfs/dbraw/zinc/64/83/93/1433648393.db2.gz CPSGPRWWDOHIQM-QZTJIDSGSA-N 2 1 375.561 3.303 20 0 GGADMP CC[C@H](NC(=O)[C@H](C)[C@H]([NH3+])c1ccccc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246714066 1433653933 /nfs/dbraw/zinc/65/39/33/1433653933.db2.gz XCUDSJFZCZNITH-PVSGBFIBSA-N 2 1 395.547 3.118 20 0 GGADMP CC[C@H](NC(=O)[C@H](C)[C@H]([NH3+])c1ccccc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246714066 1433653936 /nfs/dbraw/zinc/65/39/36/1433653936.db2.gz XCUDSJFZCZNITH-PVSGBFIBSA-N 2 1 395.547 3.118 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246719517 1433654995 /nfs/dbraw/zinc/65/49/95/1433654995.db2.gz UZEYEZJZCSSYAY-JTJHWIPRSA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246719517 1433654996 /nfs/dbraw/zinc/65/49/96/1433654996.db2.gz UZEYEZJZCSSYAY-JTJHWIPRSA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246719517 1433654997 /nfs/dbraw/zinc/65/49/97/1433654997.db2.gz UZEYEZJZCSSYAY-JTJHWIPRSA-N 2 1 376.589 3.013 20 0 GGADMP O[C@H](CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccccc1Br ZINC000246749171 1433659403 /nfs/dbraw/zinc/65/94/03/1433659403.db2.gz QAOKWHOUSGLKAE-GDIGMMSISA-N 2 1 379.342 3.431 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)C1 ZINC000246778886 1433664934 /nfs/dbraw/zinc/66/49/34/1433664934.db2.gz ZFWBRQYGWPIVMV-RBUKOAKNSA-N 2 1 388.556 3.275 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000246778886 1433664941 /nfs/dbraw/zinc/66/49/41/1433664941.db2.gz ZFWBRQYGWPIVMV-RBUKOAKNSA-N 2 1 388.556 3.275 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000246778886 1433664946 /nfs/dbraw/zinc/66/49/46/1433664946.db2.gz ZFWBRQYGWPIVMV-RBUKOAKNSA-N 2 1 388.556 3.275 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCN(CC(F)(F)F)C1=O ZINC000246782330 1433665199 /nfs/dbraw/zinc/66/51/99/1433665199.db2.gz QKEZPMPJQIIJOT-QAPCUYQASA-N 2 1 383.458 3.314 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(C(=O)NCC3CC[NH+](Cc4ccccc4)CC3)CC[C@H]21 ZINC000246812297 1433672098 /nfs/dbraw/zinc/67/20/98/1433672098.db2.gz JLWVEVOSNADQIM-FCHUYYIVSA-N 2 1 384.568 3.024 20 0 GGADMP CN(C)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1)c1ccccc1Cl ZINC000246844513 1433677118 /nfs/dbraw/zinc/67/71/18/1433677118.db2.gz KONDJOZCRMBFRG-AYOQOUSVSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1)c1ccccc1Cl ZINC000246844513 1433677119 /nfs/dbraw/zinc/67/71/19/1433677119.db2.gz KONDJOZCRMBFRG-AYOQOUSVSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1)c1ccccc1Cl ZINC000246844513 1433677120 /nfs/dbraw/zinc/67/71/20/1433677120.db2.gz KONDJOZCRMBFRG-AYOQOUSVSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1)c1ccccc1Cl ZINC000246844563 1433677632 /nfs/dbraw/zinc/67/76/32/1433677632.db2.gz KONDJOZCRMBFRG-ZYSHUDEJSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1)c1ccccc1Cl ZINC000246844563 1433677636 /nfs/dbraw/zinc/67/76/36/1433677636.db2.gz KONDJOZCRMBFRG-ZYSHUDEJSA-N 2 1 378.948 3.068 20 0 GGADMP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000246873775 1433680967 /nfs/dbraw/zinc/68/09/67/1433680967.db2.gz DOSXJKIPSMNZDW-GBXCKJPGSA-N 2 1 378.564 3.330 20 0 GGADMP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000246873775 1433680968 /nfs/dbraw/zinc/68/09/68/1433680968.db2.gz DOSXJKIPSMNZDW-GBXCKJPGSA-N 2 1 378.564 3.330 20 0 GGADMP C[C@H](C(=O)Nc1cccc2ncccc21)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000246901741 1433684968 /nfs/dbraw/zinc/68/49/68/1433684968.db2.gz JTFHTRRXKUOELO-SJORKVTESA-N 2 1 377.492 3.250 20 0 GGADMP C[C@H](C(=O)Nc1cccc2ncccc21)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000246901741 1433684969 /nfs/dbraw/zinc/68/49/69/1433684969.db2.gz JTFHTRRXKUOELO-SJORKVTESA-N 2 1 377.492 3.250 20 0 GGADMP CC[NH+](CC)CCOc1ccc(CN[C@@H]2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1OC ZINC000246920534 1433687504 /nfs/dbraw/zinc/68/75/04/1433687504.db2.gz GSHAJDQTUHCZGL-QWFCFKBJSA-N 2 1 377.573 3.234 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@H]2C)cc1OC ZINC000246920534 1433687508 /nfs/dbraw/zinc/68/75/08/1433687508.db2.gz GSHAJDQTUHCZGL-QWFCFKBJSA-N 3 1 377.573 3.234 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1OC ZINC000246920534 1433687516 /nfs/dbraw/zinc/68/75/16/1433687516.db2.gz GSHAJDQTUHCZGL-QWFCFKBJSA-N 3 1 377.573 3.234 20 0 GGADMP Cc1nccn1C[C@@H](C)CNC(=O)N1CCC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000247265943 1433698019 /nfs/dbraw/zinc/69/80/19/1433698019.db2.gz RJVWKOJGPVAXST-RBUKOAKNSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000247265943 1433698027 /nfs/dbraw/zinc/69/80/27/1433698027.db2.gz RJVWKOJGPVAXST-RBUKOAKNSA-N 2 1 383.540 3.134 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC(=O)Nc2cccc(C[NH+](C)C)c2)[C@@H](C)C1 ZINC000247271986 1433698621 /nfs/dbraw/zinc/69/86/21/1433698621.db2.gz RGZAAEOFNNGMJX-PXNSSMCTSA-N 2 1 376.545 3.007 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000247280583 1433700181 /nfs/dbraw/zinc/70/01/81/1433700181.db2.gz KHQKDOJTWLBODI-RBBKRZOGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000247280583 1433700182 /nfs/dbraw/zinc/70/01/82/1433700182.db2.gz KHQKDOJTWLBODI-RBBKRZOGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000247280583 1433700183 /nfs/dbraw/zinc/70/01/83/1433700183.db2.gz KHQKDOJTWLBODI-RBBKRZOGSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N(C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247308522 1433703611 /nfs/dbraw/zinc/70/36/11/1433703611.db2.gz GYKNJMHFKFGSTL-NNWRFLSQSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247308522 1433703616 /nfs/dbraw/zinc/70/36/16/1433703616.db2.gz GYKNJMHFKFGSTL-NNWRFLSQSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247308522 1433703622 /nfs/dbraw/zinc/70/36/22/1433703622.db2.gz GYKNJMHFKFGSTL-NNWRFLSQSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H](NC(=O)C[N@H+]1CCC[C@@H](Cc2nccn2C)C1)c1ccc2c(c1)CCCC2 ZINC000247329451 1433707580 /nfs/dbraw/zinc/70/75/80/1433707580.db2.gz URGTVMBFYKKORW-MOPGFXCFSA-N 2 1 394.563 3.431 20 0 GGADMP C[C@@H](NC(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)c1ccc2c(c1)CCCC2 ZINC000247329451 1433707584 /nfs/dbraw/zinc/70/75/84/1433707584.db2.gz URGTVMBFYKKORW-MOPGFXCFSA-N 2 1 394.563 3.431 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H](C)C1 ZINC000247342050 1433710423 /nfs/dbraw/zinc/71/04/23/1433710423.db2.gz NWMSURNWAOBDQT-PKOBYXMFSA-N 2 1 383.577 3.113 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+]1CCC[C@@H](C)C1 ZINC000247362036 1433713447 /nfs/dbraw/zinc/71/34/47/1433713447.db2.gz CIFQIRLWZFFQGV-IFMALSPDSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@@H+]1CCC[C@@H](C)C1 ZINC000247362036 1433713451 /nfs/dbraw/zinc/71/34/51/1433713451.db2.gz CIFQIRLWZFFQGV-IFMALSPDSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@H+]1CCC[C@@H](C)C1 ZINC000247362036 1433713456 /nfs/dbraw/zinc/71/34/56/1433713456.db2.gz CIFQIRLWZFFQGV-IFMALSPDSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+]1CCC[C@@H](C)C1 ZINC000247362042 1433713527 /nfs/dbraw/zinc/71/35/27/1433713527.db2.gz CIFQIRLWZFFQGV-IRLDBZIGSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@@H+]1CCC[C@@H](C)C1 ZINC000247362042 1433713533 /nfs/dbraw/zinc/71/35/33/1433713533.db2.gz CIFQIRLWZFFQGV-IRLDBZIGSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@H+]1CCC[C@@H](C)C1 ZINC000247362042 1433713538 /nfs/dbraw/zinc/71/35/38/1433713538.db2.gz CIFQIRLWZFFQGV-IRLDBZIGSA-N 2 1 386.584 3.272 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1CNC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000247369461 1433714204 /nfs/dbraw/zinc/71/42/04/1433714204.db2.gz DWOVWULKAOEVFL-QZTJIDSGSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCCC[C@@H]1CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000247369461 1433714210 /nfs/dbraw/zinc/71/42/10/1433714210.db2.gz DWOVWULKAOEVFL-QZTJIDSGSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCCC[C@@H]1CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000247369461 1433714214 /nfs/dbraw/zinc/71/42/14/1433714214.db2.gz DWOVWULKAOEVFL-QZTJIDSGSA-N 2 1 378.586 3.134 20 0 GGADMP C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000247445685 1433723355 /nfs/dbraw/zinc/72/33/55/1433723355.db2.gz YCVLCTJVDZRKEO-TWARZNRNSA-N 2 1 384.568 3.148 20 0 GGADMP C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247445685 1433723356 /nfs/dbraw/zinc/72/33/56/1433723356.db2.gz YCVLCTJVDZRKEO-TWARZNRNSA-N 2 1 384.568 3.148 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247460228 1433725032 /nfs/dbraw/zinc/72/50/32/1433725032.db2.gz UIKHWUZJHWTASA-NNWRFLSQSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247460228 1433725036 /nfs/dbraw/zinc/72/50/36/1433725036.db2.gz UIKHWUZJHWTASA-NNWRFLSQSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247460228 1433725039 /nfs/dbraw/zinc/72/50/39/1433725039.db2.gz UIKHWUZJHWTASA-NNWRFLSQSA-N 2 1 386.584 3.317 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000247471093 1433726715 /nfs/dbraw/zinc/72/67/15/1433726715.db2.gz RRJAXXSVUIZNAD-UXHICEINSA-N 2 1 386.584 3.413 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1CNC(=O)N[C@H]1c2ccccc2CC[C@H]1n1ccnc1 ZINC000247529237 1433733598 /nfs/dbraw/zinc/73/35/98/1433733598.db2.gz OUJFPJOFRIKCIB-NRSPTQNISA-N 2 1 381.524 3.285 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@@H]2c3ccccc3CC[C@H]2n2ccnc2)C[N@H+]1C1CC1 ZINC000247535311 1433734282 /nfs/dbraw/zinc/73/42/82/1433734282.db2.gz POWDEXLQQLLEJA-ZHFAOOELSA-N 2 1 379.508 3.036 20 0 GGADMP C[N@@H+](C[C@@H](O)COc1cccc2[nH]ccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000247645312 1433742847 /nfs/dbraw/zinc/74/28/47/1433742847.db2.gz WAPPYKSCFQVZSH-LEWJYISDSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C[C@@H](O)COc1cccc2[nH]ccc21)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000247645312 1433742851 /nfs/dbraw/zinc/74/28/51/1433742851.db2.gz WAPPYKSCFQVZSH-LEWJYISDSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C[C@@H](O)COc1cccc2[nH]ccc21)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000247645312 1433742855 /nfs/dbraw/zinc/74/28/55/1433742855.db2.gz WAPPYKSCFQVZSH-LEWJYISDSA-N 2 1 393.531 3.362 20 0 GGADMP C[N@@H+](CC1CC[NH+](C[C@H](O)c2ccccc2)CC1)[C@H]1Cc2ccccc2[C@H]1O ZINC000247710095 1433747438 /nfs/dbraw/zinc/74/74/38/1433747438.db2.gz RSJIYFMBSJJNSJ-KMDXXIMOSA-N 2 1 380.532 3.022 20 0 GGADMP C[C@@H](CNC(=O)N1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1)C[NH+]1CCCC1 ZINC000247883442 1433755234 /nfs/dbraw/zinc/75/52/34/1433755234.db2.gz CGVKUTLCZZJFJX-PMACEKPBSA-N 2 1 378.605 3.404 20 0 GGADMP Cc1cc(NC(=O)CC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)no1 ZINC000247929094 1433757208 /nfs/dbraw/zinc/75/72/08/1433757208.db2.gz BWEQTFVYZLEEPJ-VQTJNVASSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)no1 ZINC000247929094 1433757212 /nfs/dbraw/zinc/75/72/12/1433757212.db2.gz BWEQTFVYZLEEPJ-VQTJNVASSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)no1 ZINC000247929094 1433757215 /nfs/dbraw/zinc/75/72/15/1433757215.db2.gz BWEQTFVYZLEEPJ-VQTJNVASSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)no1 ZINC000247929094 1433757217 /nfs/dbraw/zinc/75/72/17/1433757217.db2.gz BWEQTFVYZLEEPJ-VQTJNVASSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1nc2c(s1)[C@@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c1)CCC2 ZINC000247947631 1433758372 /nfs/dbraw/zinc/75/83/72/1433758372.db2.gz DRMXFKNOFUGEIA-MOPGFXCFSA-N 2 1 398.576 3.316 20 0 GGADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000247958294 1433759243 /nfs/dbraw/zinc/75/92/43/1433759243.db2.gz FWVLCBNMXSOIPA-ODOSVJCGSA-N 2 1 377.532 3.407 20 0 GGADMP C[C@H](Cc1ccc(F)cc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248012233 1433763282 /nfs/dbraw/zinc/76/32/82/1433763282.db2.gz LJCTWZRFVRGIRX-DYESRHJHSA-N 2 1 383.511 3.244 20 0 GGADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248012235 1433763471 /nfs/dbraw/zinc/76/34/71/1433763471.db2.gz LJCTWZRFVRGIRX-LAUBAEHRSA-N 2 1 383.511 3.244 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)CC[C@H]21 ZINC000248123543 1433771347 /nfs/dbraw/zinc/77/13/47/1433771347.db2.gz NRKOLQNYQBQTSG-ATZDWAIDSA-N 2 1 393.478 3.200 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@H]21 ZINC000248386689 1433792416 /nfs/dbraw/zinc/79/24/16/1433792416.db2.gz NMIIGCHMYOJYOV-GHTZIAJQSA-N 2 1 383.536 3.259 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@H]21 ZINC000248386689 1433792421 /nfs/dbraw/zinc/79/24/21/1433792421.db2.gz NMIIGCHMYOJYOV-GHTZIAJQSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1cccc(F)c1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248390696 1433793709 /nfs/dbraw/zinc/79/37/09/1433793709.db2.gz BRESNHLXKXOMQT-YRISNDGFSA-N 2 1 390.547 3.381 20 0 GGADMP COC(=O)c1cccc(NC(=O)C[C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000248392130 1433794013 /nfs/dbraw/zinc/79/40/13/1433794013.db2.gz VQOWABWEHKAOTM-QZTJIDSGSA-N 2 1 389.540 3.148 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@H](O)COCc1cccs1 ZINC000248391611 1433794186 /nfs/dbraw/zinc/79/41/86/1433794186.db2.gz DJAMZFOXQKOLKY-GXKRZCMTSA-N 2 1 388.577 3.372 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@H]1C[NH+]1CCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248396083 1433795498 /nfs/dbraw/zinc/79/54/98/1433795498.db2.gz GVTVUHWCONFDNA-ZVDOUQERSA-N 2 1 376.589 3.299 20 0 GGADMP COCCC[NH+]1CCC(N[C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395173 1433795552 /nfs/dbraw/zinc/79/55/52/1433795552.db2.gz FZZGPPMUTWQUDF-GMKZXUHWSA-N 2 1 385.596 3.378 20 0 GGADMP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395173 1433795559 /nfs/dbraw/zinc/79/55/59/1433795559.db2.gz FZZGPPMUTWQUDF-GMKZXUHWSA-N 3 1 385.596 3.378 20 0 GGADMP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395173 1433795567 /nfs/dbraw/zinc/79/55/67/1433795567.db2.gz FZZGPPMUTWQUDF-GMKZXUHWSA-N 3 1 385.596 3.378 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248399413 1433796902 /nfs/dbraw/zinc/79/69/02/1433796902.db2.gz JUXWGAOLWHMVRL-IHPCNDPISA-N 2 1 376.589 3.203 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[NH+](CC2CCCC2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248399413 1433796903 /nfs/dbraw/zinc/79/69/03/1433796903.db2.gz JUXWGAOLWHMVRL-IHPCNDPISA-N 2 1 376.589 3.203 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[NH+](CC2CCCC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248399413 1433796904 /nfs/dbraw/zinc/79/69/04/1433796904.db2.gz JUXWGAOLWHMVRL-IHPCNDPISA-N 2 1 376.589 3.203 20 0 GGADMP CN(C(=O)NC1Cc2ccccc2C1)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000248400626 1433796906 /nfs/dbraw/zinc/79/69/06/1433796906.db2.gz QNILRIVDDHHPMI-DHIUTWEWSA-N 2 1 398.595 3.132 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248401639 1433797528 /nfs/dbraw/zinc/79/75/28/1433797528.db2.gz MCSNBCXAGIQPQP-DYXWJJEUSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248401639 1433797535 /nfs/dbraw/zinc/79/75/35/1433797535.db2.gz MCSNBCXAGIQPQP-DYXWJJEUSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248401639 1433797539 /nfs/dbraw/zinc/79/75/39/1433797539.db2.gz MCSNBCXAGIQPQP-DYXWJJEUSA-N 2 1 386.584 3.459 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N[C@H](C)[C@H]2CCC[NH+](C3CCC3)C2)C1 ZINC000248401335 1433797731 /nfs/dbraw/zinc/79/77/31/1433797731.db2.gz LVEAYGOMJKFIDV-AQNXPRMDSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)C1 ZINC000248401335 1433797737 /nfs/dbraw/zinc/79/77/37/1433797737.db2.gz LVEAYGOMJKFIDV-AQNXPRMDSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000248401335 1433797743 /nfs/dbraw/zinc/79/77/43/1433797743.db2.gz LVEAYGOMJKFIDV-AQNXPRMDSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)N1CC[NH+](C)CC1 ZINC000248402338 1433797848 /nfs/dbraw/zinc/79/78/48/1433797848.db2.gz NEWKLNRIMJIGQE-VPBXCIAMSA-N 3 1 398.639 3.149 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)N1CCN(C)CC1 ZINC000248402338 1433797853 /nfs/dbraw/zinc/79/78/53/1433797853.db2.gz NEWKLNRIMJIGQE-VPBXCIAMSA-N 2 1 398.639 3.149 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)N1CCN(C)CC1 ZINC000248402338 1433797860 /nfs/dbraw/zinc/79/78/60/1433797860.db2.gz NEWKLNRIMJIGQE-VPBXCIAMSA-N 2 1 398.639 3.149 20 0 GGADMP C[C@@H](NC(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248401538 1433798191 /nfs/dbraw/zinc/79/81/91/1433798191.db2.gz LVFZBIBWIFVWFQ-IYWMVGAKSA-N 2 1 378.605 3.307 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248401538 1433798197 /nfs/dbraw/zinc/79/81/97/1433798197.db2.gz LVFZBIBWIFVWFQ-IYWMVGAKSA-N 2 1 378.605 3.307 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248401538 1433798204 /nfs/dbraw/zinc/79/82/04/1433798204.db2.gz LVFZBIBWIFVWFQ-IYWMVGAKSA-N 2 1 378.605 3.307 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)NCc1ccccc1F ZINC000248403184 1433798388 /nfs/dbraw/zinc/79/83/88/1433798388.db2.gz XJDKBVIHFOZHGG-CYGODWOOSA-N 2 1 383.511 3.188 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)NCc1ccccc1F ZINC000248403184 1433798397 /nfs/dbraw/zinc/79/83/97/1433798397.db2.gz XJDKBVIHFOZHGG-CYGODWOOSA-N 2 1 383.511 3.188 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H](Cc2nccn2C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248405320 1433799099 /nfs/dbraw/zinc/79/90/99/1433799099.db2.gz REIHWWJLOSJMLJ-GBESFXJTSA-N 2 1 387.572 3.037 20 0 GGADMP C[C@H](NC(=O)C[C@H]1CN(Cc2ccccc2)CCO1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248405416 1433799440 /nfs/dbraw/zinc/79/94/40/1433799440.db2.gz RIWIABCTJKDPQM-WPYKKVEZSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248405416 1433799446 /nfs/dbraw/zinc/79/94/46/1433799446.db2.gz RIWIABCTJKDPQM-WPYKKVEZSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248405416 1433799449 /nfs/dbraw/zinc/79/94/49/1433799449.db2.gz RIWIABCTJKDPQM-WPYKKVEZSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248405416 1433799454 /nfs/dbraw/zinc/79/94/54/1433799454.db2.gz RIWIABCTJKDPQM-WPYKKVEZSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248405416 1433799461 /nfs/dbraw/zinc/79/94/61/1433799461.db2.gz RIWIABCTJKDPQM-WPYKKVEZSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@@H](NC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248408214 1433800171 /nfs/dbraw/zinc/80/01/71/1433800171.db2.gz VFWBKDQIBHXUGR-QRVBRYPASA-N 2 1 378.605 3.449 20 0 GGADMP C[C@@H](NC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248408214 1433800172 /nfs/dbraw/zinc/80/01/72/1433800172.db2.gz VFWBKDQIBHXUGR-QRVBRYPASA-N 2 1 378.605 3.449 20 0 GGADMP C[C@@H](NC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248408214 1433800173 /nfs/dbraw/zinc/80/01/73/1433800173.db2.gz VFWBKDQIBHXUGR-QRVBRYPASA-N 2 1 378.605 3.449 20 0 GGADMP C[C@H](NC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248408217 1433800235 /nfs/dbraw/zinc/80/02/35/1433800235.db2.gz VFWBKDQIBHXUGR-QYZOEREBSA-N 2 1 378.605 3.449 20 0 GGADMP C[C@H](NC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248408217 1433800236 /nfs/dbraw/zinc/80/02/36/1433800236.db2.gz VFWBKDQIBHXUGR-QYZOEREBSA-N 2 1 378.605 3.449 20 0 GGADMP C[C@H](NC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248408217 1433800237 /nfs/dbraw/zinc/80/02/37/1433800237.db2.gz VFWBKDQIBHXUGR-QYZOEREBSA-N 2 1 378.605 3.449 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCC[C@@H]2C[NH+](Cc3ccccc3)C[C@H]21 ZINC000248411753 1433800658 /nfs/dbraw/zinc/80/06/58/1433800658.db2.gz ZPKLPHMAQHWWQW-UEQSERJNSA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[NH+]1CCCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248411753 1433800660 /nfs/dbraw/zinc/80/06/60/1433800660.db2.gz ZPKLPHMAQHWWQW-UEQSERJNSA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[NH+]1CCCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248411753 1433800661 /nfs/dbraw/zinc/80/06/61/1433800661.db2.gz ZPKLPHMAQHWWQW-UEQSERJNSA-N 3 1 385.596 3.114 20 0 GGADMP O=C1[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)CCCN1CC(F)(F)F ZINC000248418843 1433801221 /nfs/dbraw/zinc/80/12/21/1433801221.db2.gz UDNCHHBTVGUCIL-NCXUSEDFSA-N 2 1 395.469 3.040 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000248428335 1433801775 /nfs/dbraw/zinc/80/17/75/1433801775.db2.gz ASBNTNXPIKKESZ-WMZHIEFXSA-N 3 1 397.563 3.044 20 0 GGADMP CCO[C@@H]1C[C@H]([N@@H+](C)CC2(C[NH+](C)[C@H]3C[C@H](OCC)C3(C)C)COC2)C1(C)C ZINC000248450577 1433803702 /nfs/dbraw/zinc/80/37/02/1433803702.db2.gz YCWJVJTZZDJGQY-LWYYNNOASA-N 2 1 396.616 3.274 20 0 GGADMP CCO[C@@H]1C[C@H]([NH+](C)CC2(C[N@H+](C)[C@H]3C[C@H](OCC)C3(C)C)COC2)C1(C)C ZINC000248450577 1433803703 /nfs/dbraw/zinc/80/37/03/1433803703.db2.gz YCWJVJTZZDJGQY-LWYYNNOASA-N 2 1 396.616 3.274 20 0 GGADMP CCO[C@@H]1C[C@H]([NH+](C)CC2(C[N@@H+](C)[C@H]3C[C@H](OCC)C3(C)C)COC2)C1(C)C ZINC000248450577 1433803705 /nfs/dbraw/zinc/80/37/05/1433803705.db2.gz YCWJVJTZZDJGQY-LWYYNNOASA-N 2 1 396.616 3.274 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)c(F)c1 ZINC000248454556 1433804011 /nfs/dbraw/zinc/80/40/11/1433804011.db2.gz RAAVDASMDYQWIW-NQIIRXRSSA-N 2 1 376.447 3.009 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(F)c(F)c1 ZINC000248454556 1433804012 /nfs/dbraw/zinc/80/40/12/1433804012.db2.gz RAAVDASMDYQWIW-NQIIRXRSSA-N 2 1 376.447 3.009 20 0 GGADMP COc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1OC ZINC000248457329 1433804342 /nfs/dbraw/zinc/80/43/42/1433804342.db2.gz SXIPFLQPDNZNDH-YLJYHZDGSA-N 2 1 384.520 3.430 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000248471009 1433805380 /nfs/dbraw/zinc/80/53/80/1433805380.db2.gz VMQMKTVBIYIECV-AYBZRNKSSA-N 2 1 398.469 3.394 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000248471009 1433805381 /nfs/dbraw/zinc/80/53/81/1433805381.db2.gz VMQMKTVBIYIECV-AYBZRNKSSA-N 2 1 398.469 3.394 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000248471009 1433805383 /nfs/dbraw/zinc/80/53/83/1433805383.db2.gz VMQMKTVBIYIECV-AYBZRNKSSA-N 2 1 398.469 3.394 20 0 GGADMP CCC[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cccnc1 ZINC000248498625 1433806025 /nfs/dbraw/zinc/80/60/25/1433806025.db2.gz MJHYGCQAOLHKMB-YADHBBJMSA-N 2 1 380.536 3.410 20 0 GGADMP C[C@@H](CCNC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)[NH+]1CCCCC1 ZINC000248509664 1433806314 /nfs/dbraw/zinc/80/63/14/1433806314.db2.gz ZCHOCRMCZGJAJS-XUVXKRRUSA-N 2 1 387.568 3.290 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000248585917 1433809868 /nfs/dbraw/zinc/80/98/68/1433809868.db2.gz PYYVIVZDRYPLKI-POAQFYNOSA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000248585917 1433809869 /nfs/dbraw/zinc/80/98/69/1433809869.db2.gz PYYVIVZDRYPLKI-POAQFYNOSA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000248585917 1433809871 /nfs/dbraw/zinc/80/98/71/1433809871.db2.gz PYYVIVZDRYPLKI-POAQFYNOSA-N 2 1 378.944 3.337 20 0 GGADMP Cc1c([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cnn1C(C)C ZINC000248688149 1433815289 /nfs/dbraw/zinc/81/52/89/1433815289.db2.gz IBDZSJAGAVMXPS-LAUBAEHRSA-N 2 1 397.567 3.321 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)C[C@H]2COCCN2C(=O)OC(C)(C)C)C1 ZINC000248690641 1433815496 /nfs/dbraw/zinc/81/54/96/1433815496.db2.gz AULGVFAICONKBE-ZCNNSNEGSA-N 2 1 397.604 3.359 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000248722592 1433817673 /nfs/dbraw/zinc/81/76/73/1433817673.db2.gz CMDCDSRXKPBIQC-CEMLEFRQSA-N 2 1 384.568 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000248724536 1433817943 /nfs/dbraw/zinc/81/79/43/1433817943.db2.gz HQCKYHKWGKADQV-XJUOHMSHSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000248724536 1433817944 /nfs/dbraw/zinc/81/79/44/1433817944.db2.gz HQCKYHKWGKADQV-XJUOHMSHSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000248724536 1433817946 /nfs/dbraw/zinc/81/79/46/1433817946.db2.gz HQCKYHKWGKADQV-XJUOHMSHSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000248726774 1433817949 /nfs/dbraw/zinc/81/79/49/1433817949.db2.gz IINXCDVZRAPBAX-VXKWHMMOSA-N 2 1 384.568 3.168 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC[C@H]21 ZINC000248735182 1433818655 /nfs/dbraw/zinc/81/86/55/1433818655.db2.gz QPYVFGDBPOMXSA-QGPMSJSTSA-N 2 1 381.442 3.227 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248773460 1433821711 /nfs/dbraw/zinc/82/17/11/1433821711.db2.gz TYUSMPZDYXCXCP-LEWJYISDSA-N 2 1 396.535 3.238 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N[C@H]1CC[NH+](CC2CCCC2)C1 ZINC000248779072 1433822018 /nfs/dbraw/zinc/82/20/18/1433822018.db2.gz UVCZJTQSQQIERR-YADHBBJMSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC000248779072 1433822019 /nfs/dbraw/zinc/82/20/19/1433822019.db2.gz UVCZJTQSQQIERR-YADHBBJMSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000248779072 1433822021 /nfs/dbraw/zinc/82/20/21/1433822021.db2.gz UVCZJTQSQQIERR-YADHBBJMSA-N 2 1 384.568 3.072 20 0 GGADMP C[C@H](NC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248791600 1433822815 /nfs/dbraw/zinc/82/28/15/1433822815.db2.gz XTZYYOYXBKROAK-KSEOMHKRSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248791600 1433822817 /nfs/dbraw/zinc/82/28/17/1433822817.db2.gz XTZYYOYXBKROAK-KSEOMHKRSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248791600 1433822819 /nfs/dbraw/zinc/82/28/19/1433822819.db2.gz XTZYYOYXBKROAK-KSEOMHKRSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1ccc(C[NH+](C)C)cc1 ZINC000248806583 1433823480 /nfs/dbraw/zinc/82/34/80/1433823480.db2.gz KDZMWTWSEMNGMQ-XMSQKQJNSA-N 2 1 380.536 3.068 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248829342 1433824542 /nfs/dbraw/zinc/82/45/42/1433824542.db2.gz DTQOMZKAPRVFAQ-BKULYWANSA-N 2 1 378.564 3.404 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000248852087 1433825748 /nfs/dbraw/zinc/82/57/48/1433825748.db2.gz OWKCSKXGFSJOMI-VGSGFSFPSA-N 2 1 396.579 3.165 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)N[C@H]1CCOc2ccccc21 ZINC000248861976 1433826380 /nfs/dbraw/zinc/82/63/80/1433826380.db2.gz XNJANLIABBWWDS-MJGOQNOKSA-N 2 1 384.524 3.186 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)N[C@H]1CCOc2ccccc21 ZINC000248861976 1433826381 /nfs/dbraw/zinc/82/63/81/1433826381.db2.gz XNJANLIABBWWDS-MJGOQNOKSA-N 2 1 384.524 3.186 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000248894762 1433828339 /nfs/dbraw/zinc/82/83/39/1433828339.db2.gz YLAWYWUEQGKEPK-VQTJNVASSA-N 2 1 386.584 3.113 20 0 GGADMP COc1ccc(C[C@H](C)C[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1F ZINC000248896604 1433828401 /nfs/dbraw/zinc/82/84/01/1433828401.db2.gz VKMHNCGGWSUGEH-LAUBAEHRSA-N 2 1 386.511 3.369 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC[C@H](c2cccc(C(F)(F)F)c2)[NH+](C)C)C[N@H+]1C1CC1 ZINC000248917272 1433829441 /nfs/dbraw/zinc/82/94/41/1433829441.db2.gz DLJUUKRZLHKFIN-MZMPZRCHSA-N 2 1 398.473 3.233 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000248932731 1433829703 /nfs/dbraw/zinc/82/97/03/1433829703.db2.gz XZXMNKVCDZTIAM-PGRDOPGGSA-N 2 1 380.536 3.068 20 0 GGADMP C[C@H]1CN([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2c(F)cccc2Cl)CCO1 ZINC000248996349 1433831823 /nfs/dbraw/zinc/83/18/23/1433831823.db2.gz PAVRGLBAFBVEED-HAGWPMTMSA-N 2 1 395.950 3.456 20 0 GGADMP C[C@H]1CN([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2c(F)cccc2Cl)CCO1 ZINC000248996349 1433831825 /nfs/dbraw/zinc/83/18/25/1433831825.db2.gz PAVRGLBAFBVEED-HAGWPMTMSA-N 2 1 395.950 3.456 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C(F)(F)F)c1 ZINC000249001134 1433831978 /nfs/dbraw/zinc/83/19/78/1433831978.db2.gz NAGNQFLFKKSRBH-FGTMMUONSA-N 2 1 398.473 3.186 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000249013742 1433832299 /nfs/dbraw/zinc/83/22/99/1433832299.db2.gz PCLYHVPACWTUNX-FKBYEOEOSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000249013742 1433832300 /nfs/dbraw/zinc/83/23/00/1433832300.db2.gz PCLYHVPACWTUNX-FKBYEOEOSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000249013742 1433832301 /nfs/dbraw/zinc/83/23/01/1433832301.db2.gz PCLYHVPACWTUNX-FKBYEOEOSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21 ZINC000249061799 1433833526 /nfs/dbraw/zinc/83/35/26/1433833526.db2.gz YQYZZBNBCSXWNB-BHIFYINESA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000249061799 1433833527 /nfs/dbraw/zinc/83/35/27/1433833527.db2.gz YQYZZBNBCSXWNB-BHIFYINESA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21 ZINC000249061799 1433833528 /nfs/dbraw/zinc/83/35/28/1433833528.db2.gz YQYZZBNBCSXWNB-BHIFYINESA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@@H]21 ZINC000249061814 1433833608 /nfs/dbraw/zinc/83/36/08/1433833608.db2.gz YQYZZBNBCSXWNB-FSSWDIPSSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21 ZINC000249061814 1433833609 /nfs/dbraw/zinc/83/36/09/1433833609.db2.gz YQYZZBNBCSXWNB-FSSWDIPSSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21 ZINC000249061814 1433833611 /nfs/dbraw/zinc/83/36/11/1433833611.db2.gz YQYZZBNBCSXWNB-FSSWDIPSSA-N 2 1 386.584 3.269 20 0 GGADMP CN1CCN(C(=O)NC[C@H](c2ccco2)N2CCCC2)[C@H](c2ccccc2)C1 ZINC000249337849 1433841342 /nfs/dbraw/zinc/84/13/42/1433841342.db2.gz ZRMXYEOFHPTZDP-UXHICEINSA-N 2 1 382.508 3.115 20 0 GGADMP CN1CCN(C(=O)NC[C@H](c2ccco2)N2CCCC2)[C@@H](c2ccccc2)C1 ZINC000249337852 1433841408 /nfs/dbraw/zinc/84/14/08/1433841408.db2.gz ZRMXYEOFHPTZDP-WOJBJXKFSA-N 2 1 382.508 3.115 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)c(F)c2)[C@@H](C)C1 ZINC000249458242 1433844285 /nfs/dbraw/zinc/84/42/85/1433844285.db2.gz QEEFNRNNUIUDEC-QKLQHJQFSA-N 2 1 379.520 3.188 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)c(F)c2)[C@@H](C)C1 ZINC000249458242 1433844286 /nfs/dbraw/zinc/84/42/86/1433844286.db2.gz QEEFNRNNUIUDEC-QKLQHJQFSA-N 2 1 379.520 3.188 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(CC)cc2)[C@H](C)C1 ZINC000249466529 1433844373 /nfs/dbraw/zinc/84/43/73/1433844373.db2.gz SLGAKIXQQJVSGF-LQWHRVPQSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(CC)cc2)[C@H](C)C1 ZINC000249466529 1433844374 /nfs/dbraw/zinc/84/43/74/1433844374.db2.gz SLGAKIXQQJVSGF-LQWHRVPQSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@@H](C)C1 ZINC000249479599 1433844648 /nfs/dbraw/zinc/84/46/48/1433844648.db2.gz WNXYUOILIWNNPG-ZJOUEHCJSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@@H](C)C1 ZINC000249479599 1433844650 /nfs/dbraw/zinc/84/46/50/1433844650.db2.gz WNXYUOILIWNNPG-ZJOUEHCJSA-N 2 1 375.557 3.357 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)NC[C@H]1CC[NH+](C2CC2)C1 ZINC000249512801 1433845699 /nfs/dbraw/zinc/84/56/99/1433845699.db2.gz VQCGEVWDGYDSED-RBUKOAKNSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000249512801 1433845700 /nfs/dbraw/zinc/84/57/00/1433845700.db2.gz VQCGEVWDGYDSED-RBUKOAKNSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000249512801 1433845701 /nfs/dbraw/zinc/84/57/01/1433845701.db2.gz VQCGEVWDGYDSED-RBUKOAKNSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)N1CCc2sccc2C1 ZINC000249526554 1433846199 /nfs/dbraw/zinc/84/61/99/1433846199.db2.gz UHVKFZAQSUVLSG-MSOLQXFVSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1)[NH+]1CCc2sccc2C1 ZINC000249526554 1433846202 /nfs/dbraw/zinc/84/62/02/1433846202.db2.gz UHVKFZAQSUVLSG-MSOLQXFVSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[NH+]1CCc2sccc2C1 ZINC000249526554 1433846203 /nfs/dbraw/zinc/84/62/03/1433846203.db2.gz UHVKFZAQSUVLSG-MSOLQXFVSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[N@@H+]1CCc2sccc2C1 ZINC000249526554 1433846204 /nfs/dbraw/zinc/84/62/04/1433846204.db2.gz UHVKFZAQSUVLSG-MSOLQXFVSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[N@H+]1CCc2sccc2C1 ZINC000249526554 1433846205 /nfs/dbraw/zinc/84/62/05/1433846205.db2.gz UHVKFZAQSUVLSG-MSOLQXFVSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)C1 ZINC000249528024 1433846459 /nfs/dbraw/zinc/84/64/59/1433846459.db2.gz VTWOGZJGXKVXGQ-VAMGGRTRSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)C(=O)NC(=O)NC(C)(C)C ZINC000249766175 1433851550 /nfs/dbraw/zinc/85/15/50/1433851550.db2.gz POZDMRIDZPBEAF-DLBZAZTESA-N 2 1 388.556 3.163 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)C(=O)NC(=O)NC(C)(C)C ZINC000249766178 1433851566 /nfs/dbraw/zinc/85/15/66/1433851566.db2.gz POZDMRIDZPBEAF-IAGOWNOFSA-N 2 1 388.556 3.163 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000249772841 1433851740 /nfs/dbraw/zinc/85/17/40/1433851740.db2.gz LREGFCSPOAFMCE-NHCUHLMSSA-N 2 1 381.520 3.445 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)C1CCS(=O)(=O)CC1 ZINC000250135464 1433854786 /nfs/dbraw/zinc/85/47/86/1433854786.db2.gz XZACIBBJGLGZFD-CEXWTWQISA-N 2 1 392.609 3.467 20 0 GGADMP COc1ccc(COC[C@H](O)C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000250291413 1433855751 /nfs/dbraw/zinc/85/57/51/1433855751.db2.gz SWFRHLMXGGLLJG-FGZHOGPDSA-N 2 1 390.568 3.017 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21)C1CC1 ZINC000251496122 1433858355 /nfs/dbraw/zinc/85/83/55/1433858355.db2.gz DLNKWTBPDROILM-YPAWHYETSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21)C1CC1 ZINC000251496122 1433858357 /nfs/dbraw/zinc/85/83/57/1433858357.db2.gz DLNKWTBPDROILM-YPAWHYETSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)C1CC1 ZINC000251496122 1433858358 /nfs/dbraw/zinc/85/83/58/1433858358.db2.gz DLNKWTBPDROILM-YPAWHYETSA-N 2 1 384.568 3.023 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)N1CCC[C@H]2C[NH+](C)CC[C@H]21)C1CC1 ZINC000251496114 1433858404 /nfs/dbraw/zinc/85/84/04/1433858404.db2.gz DLNKWTBPDROILM-BHDDXSALSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21)C1CC1 ZINC000251496114 1433858406 /nfs/dbraw/zinc/85/84/06/1433858406.db2.gz DLNKWTBPDROILM-BHDDXSALSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21)C1CC1 ZINC000251496114 1433858407 /nfs/dbraw/zinc/85/84/07/1433858407.db2.gz DLNKWTBPDROILM-BHDDXSALSA-N 2 1 384.568 3.023 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)C1CC1 ZINC000251542202 1433858767 /nfs/dbraw/zinc/85/87/67/1433858767.db2.gz GJRKXJMSRXGCRU-UNMCSNQZSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000251675623 1433859716 /nfs/dbraw/zinc/85/97/16/1433859716.db2.gz LXWNZJDXXUFUIT-BRWVUGGUSA-N 2 1 393.959 3.488 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000252094693 1433862617 /nfs/dbraw/zinc/86/26/17/1433862617.db2.gz FGQIGYXLQXHLCC-KZNAEPCWSA-N 2 1 378.586 3.305 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000252179698 1433862828 /nfs/dbraw/zinc/86/28/28/1433862828.db2.gz SSCDYROUZAQROP-HSALFYBXSA-N 2 1 390.572 3.474 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)[NH+]1CCc2ccccc2C1 ZINC000252692251 1433864254 /nfs/dbraw/zinc/86/42/54/1433864254.db2.gz UDGSMZSBTXMWDN-JZWVFAODSA-N 2 1 396.579 3.092 20 0 GGADMP CN(C(=O)Cc1noc2ccccc21)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000252726714 1433864401 /nfs/dbraw/zinc/86/44/01/1433864401.db2.gz DWKWODWJKREEJD-NHCUHLMSSA-N 2 1 398.551 3.166 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cccc(C)c2C)[C@@H](C)C1 ZINC000253296060 1433865518 /nfs/dbraw/zinc/86/55/18/1433865518.db2.gz NXLTYZDSJUQFTR-SXLOBPIMSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cccc(C)c2C)[C@@H](C)C1 ZINC000253296060 1433865520 /nfs/dbraw/zinc/86/55/20/1433865520.db2.gz NXLTYZDSJUQFTR-SXLOBPIMSA-N 2 1 375.557 3.357 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(OC)c1 ZINC000255123199 1433876958 /nfs/dbraw/zinc/87/69/58/1433876958.db2.gz GBAPHEUPCMUMAK-WIJUVXSSSA-N 2 1 388.552 3.418 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(OC)c1 ZINC000255123199 1433876959 /nfs/dbraw/zinc/87/69/59/1433876959.db2.gz GBAPHEUPCMUMAK-WIJUVXSSSA-N 2 1 388.552 3.418 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]C/C=C\c3ccc(F)cc3)c2)C1 ZINC000255571059 1433885511 /nfs/dbraw/zinc/88/55/11/1433885511.db2.gz NZDXSAIOMSXZMQ-JZPIVDQYSA-N 2 1 381.495 3.326 20 0 GGADMP C(=C\CN1CCC[N@H+](C2CCCC2)CC1)\CN1CCC[NH+](C2CCCC2)CC1 ZINC000255885385 1433890802 /nfs/dbraw/zinc/89/08/02/1433890802.db2.gz NEXJPFVDVHEKQU-WAYWQWQTSA-N 2 1 388.644 3.443 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)C[NH+]1CCCC1 ZINC000255957894 1433892893 /nfs/dbraw/zinc/89/28/93/1433892893.db2.gz JNGDKRKDVGDZLM-PMACEKPBSA-N 2 1 386.584 3.450 20 0 GGADMP C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(N3CC[NH+](Cc4ccccc4)CC3)cc2)C1 ZINC000261386569 1433895418 /nfs/dbraw/zinc/89/54/18/1433895418.db2.gz MMGYFIPKMVZIMJ-HXUWFJFHSA-N 2 1 392.547 3.289 20 0 GGADMP Cc1nc(COc2ccc(C[N@H+]3C[C@@H](C[NH3+])[C@H](c4ccccc4)C3)cc2)no1 ZINC000261628708 1433897847 /nfs/dbraw/zinc/89/78/47/1433897847.db2.gz FBUKBKCHBVVHGR-CTNGQTDRSA-N 2 1 378.476 3.131 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](Cc2cccc(C(=O)N3CCCCC3)c2)C[C@H]1c1ccccc1 ZINC000261691706 1433899255 /nfs/dbraw/zinc/89/92/55/1433899255.db2.gz JBFSULDQLZGBLH-PKTZIBPZSA-N 2 1 377.532 3.487 20 0 GGADMP O=C(CC[C@H]1CC[NH2+]C1)NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000261778988 1433903274 /nfs/dbraw/zinc/90/32/74/1433903274.db2.gz AUYOGRGMPQZZDP-FXAWDEMLSA-N 2 1 383.561 3.353 20 0 GGADMP O=C(CC[C@H]1CC[NH2+]C1)NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000261778988 1433903277 /nfs/dbraw/zinc/90/32/77/1433903277.db2.gz AUYOGRGMPQZZDP-FXAWDEMLSA-N 2 1 383.561 3.353 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]1CC(=O)NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000261781452 1433903627 /nfs/dbraw/zinc/90/36/27/1433903627.db2.gz PHPXSRUXBJNUEP-SXLOBPIMSA-N 2 1 383.561 3.481 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]1CC(=O)NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000261781452 1433903630 /nfs/dbraw/zinc/90/36/30/1433903630.db2.gz PHPXSRUXBJNUEP-SXLOBPIMSA-N 2 1 383.561 3.481 20 0 GGADMP Cc1cc(OCC[N@H+]2CCC[C@@H](CNC(=O)[C@@H]3CCC[NH2+]3)C2)ccc1C(C)C ZINC000261794643 1433904486 /nfs/dbraw/zinc/90/44/86/1433904486.db2.gz ILWVOICRHXMTCN-UGKGYDQZSA-N 2 1 387.568 3.077 20 0 GGADMP Cc1cc(OCC[N@H+]2CCC[C@@H](CNC(=O)[C@H]3CCC[NH2+]3)C2)ccc1C(C)C ZINC000261794642 1433904627 /nfs/dbraw/zinc/90/46/27/1433904627.db2.gz ILWVOICRHXMTCN-SIKLNZKXSA-N 2 1 387.568 3.077 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+]([C@H](C(=O)N2CCCCC2)c2ccccc2)C[C@H]1c1ccccc1 ZINC000261850967 1433907424 /nfs/dbraw/zinc/90/74/24/1433907424.db2.gz VJRCCOIQOOUKDY-VJBWXMMDSA-N 2 1 377.532 3.415 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+](Cc2ccc(SC(F)F)cc2)C1)[C@H]1CCC[NH2+]1 ZINC000261921098 1433913025 /nfs/dbraw/zinc/91/30/25/1433913025.db2.gz UYOKGPSLVMEQAR-DOTOQJQBSA-N 2 1 383.508 3.082 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+](Cc2ccc(SC(F)F)cc2)C1)[C@@H]1CCC[NH2+]1 ZINC000261921105 1433913207 /nfs/dbraw/zinc/91/32/07/1433913207.db2.gz UYOKGPSLVMEQAR-RDJZCZTQSA-N 2 1 383.508 3.082 20 0 GGADMP [NH3+]CCC(=O)NC[C@H]1CCCC[N@H+]1Cc1cccc(OCc2ccccc2)c1 ZINC000261927941 1433913649 /nfs/dbraw/zinc/91/36/49/1433913649.db2.gz CKPGITLJZCBSAZ-OAQYLSRUSA-N 2 1 381.520 3.085 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@H]1CC12CC[NH2+]CC2 ZINC000261965170 1433917101 /nfs/dbraw/zinc/91/71/01/1433917101.db2.gz SOVHNAZZUFBGIJ-MRXNPFEDSA-N 2 1 396.362 3.464 20 0 GGADMP O=C(c1ccc(C[NH+]2CCSCC2)cc1)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000261990487 1433919491 /nfs/dbraw/zinc/91/94/91/1433919491.db2.gz OXTKFLVCLPLOEQ-NRFANRHFSA-N 2 1 399.535 3.161 20 0 GGADMP Brc1ccc(-c2c[nH]c(C[N@H+]3CCC4(C3)CC[NH2+]CC4)n2)cc1 ZINC000262093986 1433926693 /nfs/dbraw/zinc/92/66/93/1433926693.db2.gz VAZHQYWLTIRQTO-UHFFFAOYSA-N 2 1 375.314 3.415 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000262095376 1433927066 /nfs/dbraw/zinc/92/70/66/1433927066.db2.gz VBGIEELMHJRNQY-UHFFFAOYSA-N 2 1 397.357 3.440 20 0 GGADMP c1c(C[N@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000262168412 1433929401 /nfs/dbraw/zinc/92/94/01/1433929401.db2.gz UQEPBMISTQJNBH-HSZRJFAPSA-N 2 1 387.531 3.019 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)c(OC)c1 ZINC000262196382 1433930396 /nfs/dbraw/zinc/93/03/96/1433930396.db2.gz ZINFFJCJXCLEMC-IAGOWNOFSA-N 2 1 377.529 3.275 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)C2C[C@H]3CCC[C@@H](C2)C3[NH3+])[C@H]1c1cccs1 ZINC000262278897 1433933503 /nfs/dbraw/zinc/93/35/03/1433933503.db2.gz LKVKYBCCTMAVKH-QSEPHNOHSA-N 2 1 375.582 3.401 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N(CCC[NH3+])Cc3ccccc3)CC2)cs1 ZINC000262469267 1433940378 /nfs/dbraw/zinc/94/03/78/1433940378.db2.gz OKVFVEHBTQNUBU-UHFFFAOYSA-N 2 1 386.565 3.041 20 0 GGADMP C[C@H]1C[C@@H](C(=O)N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)CC[NH2+]1 ZINC000262479328 1433940733 /nfs/dbraw/zinc/94/07/33/1433940733.db2.gz XSZRZOWZJYITCJ-UGKGYDQZSA-N 2 1 377.532 3.308 20 0 GGADMP C[C@@H](C(=O)N1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)[C@H]([NH3+])c1ccccc1 ZINC000262647335 1433947708 /nfs/dbraw/zinc/94/77/08/1433947708.db2.gz PBDFNEIJWOYDPS-MOXWOTFGSA-N 2 1 387.568 3.060 20 0 GGADMP COc1ccc([C@H](CNC(=O)[C@H]([NH3+])c2ccc(C)cc2)[NH+]2CCCCC2)cc1 ZINC000262672195 1433949300 /nfs/dbraw/zinc/94/93/00/1433949300.db2.gz SBUVOZMUQZOXQB-FCHUYYIVSA-N 2 1 381.520 3.347 20 0 GGADMP COc1ccc([C@@H](CNC(=O)[C@H]([NH3+])c2ccc(C)cc2)[NH+]2CCCCC2)cc1 ZINC000262672196 1433949439 /nfs/dbraw/zinc/94/94/39/1433949439.db2.gz SBUVOZMUQZOXQB-FGZHOGPDSA-N 2 1 381.520 3.347 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1(C)C ZINC000262752393 1433953923 /nfs/dbraw/zinc/95/39/23/1433953923.db2.gz ACTVHYKREJXHJN-WGGBDISSSA-N 2 1 387.568 3.067 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1(C)C ZINC000262761802 1433954401 /nfs/dbraw/zinc/95/44/01/1433954401.db2.gz DNEIPCUEABEYTG-JWRIFHQMSA-N 2 1 387.568 3.030 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)NCc2ccccc2C[N@H+]2CCCC[C@H]2C)C1(C)C ZINC000262818693 1433958435 /nfs/dbraw/zinc/95/84/35/1433958435.db2.gz XNWDYUHYYWOLLE-LLBVYWAGSA-N 2 1 387.568 3.210 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1ccn([C@H]2CCC[NH2+]C2)n1 ZINC000262832919 1433960213 /nfs/dbraw/zinc/96/02/13/1433960213.db2.gz SEYVPSXPDVGUTA-NQIIRXRSSA-N 2 1 395.551 3.112 20 0 GGADMP C[C@]1([NH3+])CCCC[C@H]1C(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000263197040 1433993947 /nfs/dbraw/zinc/99/39/47/1433993947.db2.gz INMAVMJMUQZGFQ-AOIWGVFYSA-N 2 1 383.458 3.304 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000263271544 1434000015 /nfs/dbraw/zinc/00/00/15/1434000015.db2.gz XAOJRNHQNXUBIO-CABCVRRESA-N 2 1 382.346 3.488 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cc(F)cc4c3OCOC4)CC2)C[C@@H](C)O1 ZINC000263770852 1434031594 /nfs/dbraw/zinc/03/15/94/1434031594.db2.gz STWXGWXJNJFXCP-HZPDHXFCSA-N 2 1 378.488 3.013 20 0 GGADMP Cc1[nH+]ccn1CCCSc1nnc(SCCCn2cc[nH+]c2C)n1C ZINC000264118169 1434073113 /nfs/dbraw/zinc/07/31/13/1434073113.db2.gz GAPIZIIPTADLSC-UHFFFAOYSA-N 2 1 391.570 3.190 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)NCC2([NH+]3CCCC3)CCOCC2)cc1 ZINC000264333300 1434098449 /nfs/dbraw/zinc/09/84/49/1434098449.db2.gz XJUVPKMXIYCTJF-UHFFFAOYSA-N 2 1 387.568 3.293 20 0 GGADMP C[N@@H+](CCCCCn1cccn1)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000264359329 1434101650 /nfs/dbraw/zinc/10/16/50/1434101650.db2.gz JGEKYPGTCNCEDU-HSZRJFAPSA-N 2 1 384.568 3.431 20 0 GGADMP C[N@@H+](CCCOCC(F)(F)F)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000264402933 1434108204 /nfs/dbraw/zinc/10/82/04/1434108204.db2.gz UHKLZFCRSBZDLP-IBGZPJMESA-N 2 1 388.474 3.333 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)CC1 ZINC000264597899 1434132655 /nfs/dbraw/zinc/13/26/55/1434132655.db2.gz ASGOHGQNGGRVLI-GOSISDBHSA-N 2 1 388.556 3.322 20 0 GGADMP Cc1cnn(CCCCC[NH+]2CCN(CC[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000264760719 1434152594 /nfs/dbraw/zinc/15/25/94/1434152594.db2.gz YQVLCIZXKJKBHH-UHFFFAOYSA-N 2 1 383.584 3.111 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N(C)CC[NH+](C)C2CCN(C)CC2)cc1)C(C)C ZINC000264849783 1434159443 /nfs/dbraw/zinc/15/94/43/1434159443.db2.gz BSPUQMINFWAYCB-UHFFFAOYSA-N 2 1 388.600 3.015 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N(C)CC[N@H+](C)C2CCN(C)CC2)cc1)C(C)C ZINC000264849783 1434159444 /nfs/dbraw/zinc/15/94/44/1434159444.db2.gz BSPUQMINFWAYCB-UHFFFAOYSA-N 2 1 388.600 3.015 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N(C)CC[N@@H+](C)C2CCN(C)CC2)cc1)C(C)C ZINC000264849783 1434159446 /nfs/dbraw/zinc/15/94/46/1434159446.db2.gz BSPUQMINFWAYCB-UHFFFAOYSA-N 2 1 388.600 3.015 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)N(C)CCN(C)C2CC[NH+](C)CC2)cc1)C(C)C ZINC000264849783 1434159448 /nfs/dbraw/zinc/15/94/48/1434159448.db2.gz BSPUQMINFWAYCB-UHFFFAOYSA-N 2 1 388.600 3.015 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N(C)CCN(C)C2CC[NH+](C)CC2)cc1)C(C)C ZINC000264849783 1434159450 /nfs/dbraw/zinc/15/94/50/1434159450.db2.gz BSPUQMINFWAYCB-UHFFFAOYSA-N 2 1 388.600 3.015 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]CCCC[N@H+]3CCC[C@@H]3CO)cs2)cc1 ZINC000264944891 1434166513 /nfs/dbraw/zinc/16/65/13/1434166513.db2.gz ICYSGFMSWUCFAA-LJQANCHMSA-N 2 1 389.565 3.357 20 0 GGADMP COCC[N@H+]1CC[C@@H](NC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)C1 ZINC000265428216 1434233607 /nfs/dbraw/zinc/23/36/07/1434233607.db2.gz UGWCCQLKMVNPRI-LJQANCHMSA-N 2 1 388.556 3.293 20 0 GGADMP COCC[NH+]1CC[C@@H](NC(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)C1 ZINC000265428216 1434233608 /nfs/dbraw/zinc/23/36/08/1434233608.db2.gz UGWCCQLKMVNPRI-LJQANCHMSA-N 2 1 388.556 3.293 20 0 GGADMP COCC[NH+]1CC[C@@H](NC(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)C1 ZINC000265428216 1434233609 /nfs/dbraw/zinc/23/36/09/1434233609.db2.gz UGWCCQLKMVNPRI-LJQANCHMSA-N 2 1 388.556 3.293 20 0 GGADMP C[N@@H+](Cc1ccccc1NC(=O)NCC1(O)CC[NH+](C)CC1)C1CCCCC1 ZINC000265974132 1434290825 /nfs/dbraw/zinc/29/08/25/1434290825.db2.gz XPKKPFABIUJWJS-UHFFFAOYSA-N 2 1 388.556 3.029 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CC[C@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC000266521454 1434346181 /nfs/dbraw/zinc/34/61/81/1434346181.db2.gz NQWQRMWKFCWRAS-IBGZPJMESA-N 2 1 383.540 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000266521454 1434346182 /nfs/dbraw/zinc/34/61/82/1434346182.db2.gz NQWQRMWKFCWRAS-IBGZPJMESA-N 2 1 383.540 3.278 20 0 GGADMP COc1cc(NC(=O)CC[N@@H+](C)C2CC[NH+](C(C)C)CC2)c(OC)cc1Cl ZINC000266757790 1434372007 /nfs/dbraw/zinc/37/20/07/1434372007.db2.gz SKPVAEYBMOGHIZ-UHFFFAOYSA-N 2 1 397.947 3.490 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(CC[NH+](C)C)Cc1ccc(F)c(F)c1 ZINC000266767195 1434373224 /nfs/dbraw/zinc/37/32/24/1434373224.db2.gz IDSAUSAXIJDBDS-UHFFFAOYSA-N 2 1 393.482 3.023 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000266789396 1434375545 /nfs/dbraw/zinc/37/55/45/1434375545.db2.gz SHTAWYDGMRJCOE-GOSISDBHSA-N 2 1 389.569 3.245 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000266789396 1434375547 /nfs/dbraw/zinc/37/55/47/1434375547.db2.gz SHTAWYDGMRJCOE-GOSISDBHSA-N 2 1 389.569 3.245 20 0 GGADMP C[NH+]1CCC(C(=O)N(C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)CC1 ZINC000266940973 1434390708 /nfs/dbraw/zinc/39/07/08/1434390708.db2.gz VLRANBLAFMDAIT-GOSISDBHSA-N 2 1 397.485 3.241 20 0 GGADMP C[NH+]1CCC(C(=O)N(C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)CC1 ZINC000266940976 1434390838 /nfs/dbraw/zinc/39/08/38/1434390838.db2.gz VLRANBLAFMDAIT-SFHVURJKSA-N 2 1 397.485 3.241 20 0 GGADMP C[NH+](C)Cc1ccc(-c2noc([C@H]3C[N@H+](Cc4ccccc4)CCO3)n2)cc1 ZINC000267088675 1434406693 /nfs/dbraw/zinc/40/66/93/1434406693.db2.gz RUANGUYWXNUEMM-HXUWFJFHSA-N 2 1 378.476 3.372 20 0 GGADMP C[NH+](C)Cc1ccc(-c2noc([C@H]3C[N@@H+](Cc4ccccc4)CCO3)n2)cc1 ZINC000267088675 1434406695 /nfs/dbraw/zinc/40/66/95/1434406695.db2.gz RUANGUYWXNUEMM-HXUWFJFHSA-N 2 1 378.476 3.372 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCCCCC[NH+]1CCCC1 ZINC000267246657 1434416747 /nfs/dbraw/zinc/41/67/47/1434416747.db2.gz SYJHIDNPJPKJLB-UHFFFAOYSA-N 2 1 398.555 3.421 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000267298163 1434420518 /nfs/dbraw/zinc/42/05/18/1434420518.db2.gz FANNXQFOAZBICX-GCJKJVERSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000267333833 1434423726 /nfs/dbraw/zinc/42/37/26/1434423726.db2.gz MLQVKQXWRPFNSK-WIYYLYMNSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000267359323 1434425584 /nfs/dbraw/zinc/42/55/84/1434425584.db2.gz IZQNSTCFNCKSEZ-BAGYTPMASA-N 2 1 384.568 3.024 20 0 GGADMP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2csc(COc3ccccc3)n2)CC1 ZINC000268412058 1434520199 /nfs/dbraw/zinc/52/01/99/1434520199.db2.gz IFAVVQGSFGWQMA-UHFFFAOYSA-N 2 1 375.538 3.047 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[N@H+](CC[C@H]3CCCC[NH+]3C)CC2)cc1 ZINC000268511735 1434528842 /nfs/dbraw/zinc/52/88/42/1434528842.db2.gz CMJQSVIDRPNXDI-OAQYLSRUSA-N 2 1 387.568 3.037 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[N@@H+](CC[C@H]3CCCC[NH+]3C)CC2)cc1 ZINC000268511735 1434528843 /nfs/dbraw/zinc/52/88/43/1434528843.db2.gz CMJQSVIDRPNXDI-OAQYLSRUSA-N 2 1 387.568 3.037 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[NH+](CC[C@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000268511735 1434528846 /nfs/dbraw/zinc/52/88/46/1434528846.db2.gz CMJQSVIDRPNXDI-OAQYLSRUSA-N 2 1 387.568 3.037 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[NH+](CC[C@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000268511735 1434528849 /nfs/dbraw/zinc/52/88/49/1434528849.db2.gz CMJQSVIDRPNXDI-OAQYLSRUSA-N 2 1 387.568 3.037 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000268556817 1434533395 /nfs/dbraw/zinc/53/33/95/1434533395.db2.gz JLJURRHVFCDJDE-WGMWDUQUSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000268556817 1434533398 /nfs/dbraw/zinc/53/33/98/1434533398.db2.gz JLJURRHVFCDJDE-WGMWDUQUSA-N 2 1 383.540 3.037 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CC[N@@H+]1Cc1ccccc1 ZINC000268741809 1434552216 /nfs/dbraw/zinc/55/22/16/1434552216.db2.gz GDNKEDOUDWWDJW-UGKGYDQZSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CC[N@H+]1Cc1ccccc1 ZINC000268741809 1434552219 /nfs/dbraw/zinc/55/22/19/1434552219.db2.gz GDNKEDOUDWWDJW-UGKGYDQZSA-N 2 1 380.536 3.061 20 0 GGADMP CC[NH+]1CCC([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC1 ZINC000268757697 1434553612 /nfs/dbraw/zinc/55/36/12/1434553612.db2.gz FVLORYGNCKDYDJ-UHFFFAOYSA-N 2 1 397.542 3.121 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2Cn2cncn2)CC[N@@H+]1Cc1ccccc1 ZINC000268760179 1434553768 /nfs/dbraw/zinc/55/37/68/1434553768.db2.gz LAXSMLHOXQQMMD-AUSIDOKSSA-N 2 1 375.520 3.469 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2Cn2cncn2)CC[N@H+]1Cc1ccccc1 ZINC000268760179 1434553771 /nfs/dbraw/zinc/55/37/71/1434553771.db2.gz LAXSMLHOXQQMMD-AUSIDOKSSA-N 2 1 375.520 3.469 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Cn2cncn2)CC[N@@H+]1Cc1ccccc1 ZINC000268760195 1434553817 /nfs/dbraw/zinc/55/38/17/1434553817.db2.gz LAXSMLHOXQQMMD-XXBNENTESA-N 2 1 375.520 3.469 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Cn2cncn2)CC[N@H+]1Cc1ccccc1 ZINC000268760195 1434553820 /nfs/dbraw/zinc/55/38/20/1434553820.db2.gz LAXSMLHOXQQMMD-XXBNENTESA-N 2 1 375.520 3.469 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cn3cncn3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000268775922 1434556034 /nfs/dbraw/zinc/55/60/34/1434556034.db2.gz VVJFGFBGSGUKAL-XXBNENTESA-N 2 1 375.520 3.469 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cn3cncn3)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268775922 1434556035 /nfs/dbraw/zinc/55/60/35/1434556035.db2.gz VVJFGFBGSGUKAL-XXBNENTESA-N 2 1 375.520 3.469 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]Cc3ccccc3Cn3cncn3)CC2)cc1 ZINC000268790041 1434557715 /nfs/dbraw/zinc/55/77/15/1434557715.db2.gz XPPDGYNVIVYTMD-UHFFFAOYSA-N 2 1 393.510 3.262 20 0 GGADMP COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(C(=O)N2CC[NH+](C)CC2)cc1 ZINC000268800311 1434558671 /nfs/dbraw/zinc/55/86/71/1434558671.db2.gz HJZNZBXBYZIJEI-QHCPKHFHSA-N 2 1 393.531 3.250 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000268808790 1434559634 /nfs/dbraw/zinc/55/96/34/1434559634.db2.gz CMHUCFOZAFLPIK-YADHBBJMSA-N 2 1 395.551 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000268808790 1434559639 /nfs/dbraw/zinc/55/96/39/1434559639.db2.gz CMHUCFOZAFLPIK-YADHBBJMSA-N 2 1 395.551 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000268808788 1434559793 /nfs/dbraw/zinc/55/97/93/1434559793.db2.gz CMHUCFOZAFLPIK-VXKWHMMOSA-N 2 1 395.551 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000268808788 1434559796 /nfs/dbraw/zinc/55/97/96/1434559796.db2.gz CMHUCFOZAFLPIK-VXKWHMMOSA-N 2 1 395.551 3.278 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(CS(C)(=O)=O)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000268808199 1434559880 /nfs/dbraw/zinc/55/98/80/1434559880.db2.gz SOYPJNAJKSEPDP-XMSQKQJNSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(CS(C)(=O)=O)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268808199 1434559883 /nfs/dbraw/zinc/55/98/83/1434559883.db2.gz SOYPJNAJKSEPDP-XMSQKQJNSA-N 2 1 386.561 3.374 20 0 GGADMP COc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ccc1OCCO ZINC000268826159 1434561428 /nfs/dbraw/zinc/56/14/28/1434561428.db2.gz YXUDQDSCMVWWDE-GHTZIAJQSA-N 2 1 384.520 3.209 20 0 GGADMP COc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1OCCO ZINC000268826159 1434561431 /nfs/dbraw/zinc/56/14/31/1434561431.db2.gz YXUDQDSCMVWWDE-GHTZIAJQSA-N 2 1 384.520 3.209 20 0 GGADMP COc1cccc2c1CC[C@H]2[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000268875026 1434567044 /nfs/dbraw/zinc/56/70/44/1434567044.db2.gz GTWFUXVZLQCRDP-SIKLNZKXSA-N 2 1 393.531 3.170 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000268963813 1434576192 /nfs/dbraw/zinc/57/61/92/1434576192.db2.gz BLEYKVJIVIBVJJ-YJMBLLCNSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000268963813 1434576194 /nfs/dbraw/zinc/57/61/94/1434576194.db2.gz BLEYKVJIVIBVJJ-YJMBLLCNSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000268963813 1434576198 /nfs/dbraw/zinc/57/61/98/1434576198.db2.gz BLEYKVJIVIBVJJ-YJMBLLCNSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000268963810 1434576269 /nfs/dbraw/zinc/57/62/69/1434576269.db2.gz BLEYKVJIVIBVJJ-GBAJDQEWSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000268963810 1434576272 /nfs/dbraw/zinc/57/62/72/1434576272.db2.gz BLEYKVJIVIBVJJ-GBAJDQEWSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000268963810 1434576275 /nfs/dbraw/zinc/57/62/75/1434576275.db2.gz BLEYKVJIVIBVJJ-GBAJDQEWSA-N 2 1 384.568 3.023 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000269441450 1434646327 /nfs/dbraw/zinc/64/63/27/1434646327.db2.gz BKVJAMOQVPHIBR-NQIIRXRSSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000269441450 1434646331 /nfs/dbraw/zinc/64/63/31/1434646331.db2.gz BKVJAMOQVPHIBR-NQIIRXRSSA-N 2 1 383.540 3.134 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccsc1 ZINC000269482140 1434652060 /nfs/dbraw/zinc/65/20/60/1434652060.db2.gz GESFITAMOROOIS-AYOQOUSVSA-N 2 1 376.570 3.009 20 0 GGADMP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000269704630 1434670708 /nfs/dbraw/zinc/67/07/08/1434670708.db2.gz QJYSRBCGWRDHGF-FYYLOGMGSA-N 2 1 381.564 3.374 20 0 GGADMP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000269704633 1434670778 /nfs/dbraw/zinc/67/07/78/1434670778.db2.gz QJYSRBCGWRDHGF-GGAORHGYSA-N 2 1 381.564 3.374 20 0 GGADMP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C1 ZINC000269716120 1434671328 /nfs/dbraw/zinc/67/13/28/1434671328.db2.gz SFFBYFCHSRDCIQ-IEBWSBKVSA-N 2 1 381.520 3.200 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H]3CCc4c3c(F)ccc4F)c2)C1 ZINC000269884651 1434684184 /nfs/dbraw/zinc/68/41/84/1434684184.db2.gz ZVTGHAMHOLDKRD-UTKZUKDTSA-N 2 1 399.485 3.439 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCc4c3c(F)ccc4F)c2)C1 ZINC000269884651 1434684186 /nfs/dbraw/zinc/68/41/86/1434684186.db2.gz ZVTGHAMHOLDKRD-UTKZUKDTSA-N 2 1 399.485 3.439 20 0 GGADMP COCC[N@@H+](C)CCCC1CCN(C(=O)c2sccc2C[NH+](C)C)CC1 ZINC000271021199 1434796475 /nfs/dbraw/zinc/79/64/75/1434796475.db2.gz YSTPXSCWHYLPQI-UHFFFAOYSA-N 2 1 381.586 3.020 20 0 GGADMP COCCCNC(=O)C1CC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000271118687 1434803108 /nfs/dbraw/zinc/80/31/08/1434803108.db2.gz FSJSLRDZMCUDIR-UHFFFAOYSA-N 2 1 389.584 3.009 20 0 GGADMP C[C@H](C[NH+]1CC[C@@H](C)[C@H](n2ccnc2)C1)C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271288637 1434813340 /nfs/dbraw/zinc/81/33/40/1434813340.db2.gz MDPNOPJLMFCCMR-QMCAAQAGSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@@H](C[NH+]1CC[C@H](C)[C@H](n2ccnc2)C1)C[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000271288637 1434813343 /nfs/dbraw/zinc/81/33/43/1434813343.db2.gz MDPNOPJLMFCCMR-QMCAAQAGSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@@H](C[NH+]1CC[C@H](C)[C@H](n2ccnc2)C1)C[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000271288637 1434813344 /nfs/dbraw/zinc/81/33/44/1434813344.db2.gz MDPNOPJLMFCCMR-QMCAAQAGSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]CCNC(=O)c2c(F)cccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000271470499 1434827437 /nfs/dbraw/zinc/82/74/37/1434827437.db2.gz LUYKONXWGUVUIK-AEFFLSMTSA-N 2 1 387.474 3.337 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]CCNC(=O)c2c(F)cccc2F)CC[N@H+]1Cc1ccccc1 ZINC000271470499 1434827438 /nfs/dbraw/zinc/82/74/38/1434827438.db2.gz LUYKONXWGUVUIK-AEFFLSMTSA-N 2 1 387.474 3.337 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000271476210 1434828071 /nfs/dbraw/zinc/82/80/71/1434828071.db2.gz MRKGRZAMXLCWPW-YLJYHZDGSA-N 2 1 383.561 3.133 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000271476210 1434828073 /nfs/dbraw/zinc/82/80/73/1434828073.db2.gz MRKGRZAMXLCWPW-YLJYHZDGSA-N 2 1 383.561 3.133 20 0 GGADMP Cc1c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cnn1-c1ccc(F)cc1 ZINC000271503968 1434830091 /nfs/dbraw/zinc/83/00/91/1434830091.db2.gz MKTZCFZZOZPMFY-ITEAAPOESA-N 2 1 386.515 3.348 20 0 GGADMP COc1cc(OC)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1Cl ZINC000271515243 1434831099 /nfs/dbraw/zinc/83/10/99/1434831099.db2.gz OLYQTYLWKFSFPR-MORSLUCNSA-N 2 1 382.932 3.386 20 0 GGADMP Cc1ccoc1C(=O)NCCC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000271515102 1434831106 /nfs/dbraw/zinc/83/11/06/1434831106.db2.gz PLAPCNWLCWJIKT-UHFFFAOYSA-N 2 1 387.499 3.144 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000271859039 1434855440 /nfs/dbraw/zinc/85/54/40/1434855440.db2.gz NPELNZSQWCICCJ-MRXNPFEDSA-N 2 1 375.538 3.025 20 0 GGADMP CC[N@@H+](CCCC1CC[NH+](CCCn2ccnc2)CC1)CCCn1ccnc1 ZINC000272059685 1434869516 /nfs/dbraw/zinc/86/95/16/1434869516.db2.gz RVIYFQAXPIDUEO-UHFFFAOYSA-N 2 1 386.588 3.374 20 0 GGADMP C[C@H](NC(=O)NC1CC[NH+](C(C)(C)C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272212409 1434878331 /nfs/dbraw/zinc/87/83/31/1434878331.db2.gz QJJNJXTXVZUVQT-AZUAARDMSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H](NC(=O)NC1CC[NH+](C(C)(C)C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272212424 1434878387 /nfs/dbraw/zinc/87/83/87/1434878387.db2.gz QJJNJXTXVZUVQT-UYAOXDASSA-N 2 1 386.584 3.459 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272270329 1434882921 /nfs/dbraw/zinc/88/29/21/1434882921.db2.gz CZDGXYOEPOWNKE-NQIIRXRSSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272270329 1434882922 /nfs/dbraw/zinc/88/29/22/1434882922.db2.gz CZDGXYOEPOWNKE-NQIIRXRSSA-N 2 1 383.540 3.134 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cnnn2)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272307452 1434886020 /nfs/dbraw/zinc/88/60/20/1434886020.db2.gz IBIIUPNVMYUCCE-UEXGIBASSA-N 2 1 376.508 3.224 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1ccco1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272343123 1434888748 /nfs/dbraw/zinc/88/87/48/1434888748.db2.gz BWTFKUSJKVNJHX-PZJWPPBQSA-N 2 1 398.551 3.263 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1ccco1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272343124 1434888770 /nfs/dbraw/zinc/88/87/70/1434888770.db2.gz BWTFKUSJKVNJHX-TZIWHRDSSA-N 2 1 398.551 3.263 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272375472 1434891401 /nfs/dbraw/zinc/89/14/01/1434891401.db2.gz HCXTZZJXJXDCRL-WIYYLYMNSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272375472 1434891403 /nfs/dbraw/zinc/89/14/03/1434891403.db2.gz HCXTZZJXJXDCRL-WIYYLYMNSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272394420 1434893369 /nfs/dbraw/zinc/89/33/69/1434893369.db2.gz WMELEKPTZBBDGO-LQWHRVPQSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272394420 1434893370 /nfs/dbraw/zinc/89/33/70/1434893370.db2.gz WMELEKPTZBBDGO-LQWHRVPQSA-N 2 1 383.540 3.037 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272400186 1434893983 /nfs/dbraw/zinc/89/39/83/1434893983.db2.gz YSPHCUZGOQVKFJ-WWPVKYPJSA-N 2 1 398.595 3.270 20 0 GGADMP c1ccc([C@@H](NCCC[NH+]2CCN(c3cc[nH+]cc3)CC2)c2ccccn2)cc1 ZINC000272424075 1434895353 /nfs/dbraw/zinc/89/53/53/1434895353.db2.gz MFMSSXVEFUGJRK-XMMPIXPASA-N 2 1 387.531 3.368 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272447583 1434897016 /nfs/dbraw/zinc/89/70/16/1434897016.db2.gz MDERSAGXOVDMSK-DFQSSKMNSA-N 2 1 384.524 3.092 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272447583 1434897018 /nfs/dbraw/zinc/89/70/18/1434897018.db2.gz MDERSAGXOVDMSK-DFQSSKMNSA-N 2 1 384.524 3.092 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000272468117 1434898366 /nfs/dbraw/zinc/89/83/66/1434898366.db2.gz HYGUMRCJLBXPML-VXSCBNMQSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272468117 1434898368 /nfs/dbraw/zinc/89/83/68/1434898368.db2.gz HYGUMRCJLBXPML-VXSCBNMQSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272468117 1434898370 /nfs/dbraw/zinc/89/83/70/1434898370.db2.gz HYGUMRCJLBXPML-VXSCBNMQSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272470370 1434898552 /nfs/dbraw/zinc/89/85/52/1434898552.db2.gz IFPXLWIKYIOWKK-BVSLBCMMSA-N 2 1 384.568 3.024 20 0 GGADMP C[N@H+]1CC[C@H]2CCN(C(=O)NC3CC[NH+](Cc4ccc(Cl)cc4)CC3)[C@@H]2C1 ZINC000272472525 1434898707 /nfs/dbraw/zinc/89/87/07/1434898707.db2.gz QKWHTNRMAPFDQS-FXAWDEMLSA-N 2 1 390.959 3.040 20 0 GGADMP C[N@H+]1CC[C@@H]2CCN(C(=O)NC3CC[NH+](Cc4ccc(Cl)cc4)CC3)[C@@H]2C1 ZINC000272472538 1434898716 /nfs/dbraw/zinc/89/87/16/1434898716.db2.gz QKWHTNRMAPFDQS-YLJYHZDGSA-N 2 1 390.959 3.040 20 0 GGADMP COCC[C@@H]([NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000272508007 1434901806 /nfs/dbraw/zinc/90/18/06/1434901806.db2.gz VOKJADPDHVNYIL-WIYYLYMNSA-N 2 1 399.535 3.116 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000272534812 1434905069 /nfs/dbraw/zinc/90/50/69/1434905069.db2.gz PDWOYLSULQSAJV-VXSCBNMQSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272534812 1434905073 /nfs/dbraw/zinc/90/50/73/1434905073.db2.gz PDWOYLSULQSAJV-VXSCBNMQSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272534812 1434905076 /nfs/dbraw/zinc/90/50/76/1434905076.db2.gz PDWOYLSULQSAJV-VXSCBNMQSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC(CC[NH+](C)C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272543437 1434906144 /nfs/dbraw/zinc/90/61/44/1434906144.db2.gz QDTYTHULIFLKAY-UGKGYDQZSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](c1ccc(NC(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)cc1)[NH+]1CCOCC1 ZINC000272564740 1434908358 /nfs/dbraw/zinc/90/83/58/1434908358.db2.gz KHBGWIYSMHSEGE-ZWKOTPCHSA-N 2 1 388.556 3.274 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@@H]21 ZINC000272579361 1434910238 /nfs/dbraw/zinc/91/02/38/1434910238.db2.gz MGKNYCNIVWVGLJ-YJMBLLCNSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21 ZINC000272579361 1434910240 /nfs/dbraw/zinc/91/02/40/1434910240.db2.gz MGKNYCNIVWVGLJ-YJMBLLCNSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21 ZINC000272579361 1434910242 /nfs/dbraw/zinc/91/02/42/1434910242.db2.gz MGKNYCNIVWVGLJ-YJMBLLCNSA-N 2 1 384.568 3.023 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[NH+](C)C[C@@H]21 ZINC000272610114 1434914864 /nfs/dbraw/zinc/91/48/64/1434914864.db2.gz RPDDLYXGGRGKBJ-GCJKJVERSA-N 2 1 396.535 3.147 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[NH+](C)C[C@@H]21 ZINC000272610114 1434914865 /nfs/dbraw/zinc/91/48/65/1434914865.db2.gz RPDDLYXGGRGKBJ-GCJKJVERSA-N 2 1 396.535 3.147 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[N@H+](C)C[C@@H]21 ZINC000272610114 1434914867 /nfs/dbraw/zinc/91/48/67/1434914867.db2.gz RPDDLYXGGRGKBJ-GCJKJVERSA-N 2 1 396.535 3.147 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@H]2CC[N@@H+](C)C[C@@H]21 ZINC000272610114 1434914869 /nfs/dbraw/zinc/91/48/69/1434914869.db2.gz RPDDLYXGGRGKBJ-GCJKJVERSA-N 2 1 396.535 3.147 20 0 GGADMP C[C@@H]([NH2+]C1CCN(C(=O)c2ccncc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272659469 1434920553 /nfs/dbraw/zinc/92/05/53/1434920553.db2.gz MPKDFGIKIDMJAL-KNQAVFIVSA-N 2 1 392.547 3.186 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(Cn2cncn2)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272668508 1434921087 /nfs/dbraw/zinc/92/10/87/1434921087.db2.gz OSHQSZFYVHHGTR-CVDCTZTESA-N 2 1 375.520 3.327 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(Cn2cncn2)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272668510 1434921170 /nfs/dbraw/zinc/92/11/70/1434921170.db2.gz OSHQSZFYVHHGTR-XXBNENTESA-N 2 1 375.520 3.327 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)C1=CC[NH+](C)CC1 ZINC000272694797 1434923500 /nfs/dbraw/zinc/92/35/00/1434923500.db2.gz DDBRVKLDSIFPQD-MOXWOTFGSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1[C@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)C1=CC[N@H+](C)CC1 ZINC000272694797 1434923502 /nfs/dbraw/zinc/92/35/02/1434923502.db2.gz DDBRVKLDSIFPQD-MOXWOTFGSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1[C@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)C1=CC[N@@H+](C)CC1 ZINC000272694797 1434923504 /nfs/dbraw/zinc/92/35/04/1434923504.db2.gz DDBRVKLDSIFPQD-MOXWOTFGSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](NC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1=CC[NH+](C)CC1 ZINC000272986303 1434946888 /nfs/dbraw/zinc/94/68/88/1434946888.db2.gz PONFUFSWKIAYQC-CNNODRBYSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1)C1=CC[N@H+](C)CC1 ZINC000272986303 1434946892 /nfs/dbraw/zinc/94/68/92/1434946892.db2.gz PONFUFSWKIAYQC-CNNODRBYSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1)C1=CC[N@@H+](C)CC1 ZINC000272986303 1434946893 /nfs/dbraw/zinc/94/68/93/1434946893.db2.gz PONFUFSWKIAYQC-CNNODRBYSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1=CC[NH+](C)CC1 ZINC000272986313 1434946945 /nfs/dbraw/zinc/94/69/45/1434946945.db2.gz PONFUFSWKIAYQC-XQBPLPMBSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1)C1=CC[N@H+](C)CC1 ZINC000272986313 1434946948 /nfs/dbraw/zinc/94/69/48/1434946948.db2.gz PONFUFSWKIAYQC-XQBPLPMBSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1)C1=CC[N@@H+](C)CC1 ZINC000272986313 1434946950 /nfs/dbraw/zinc/94/69/50/1434946950.db2.gz PONFUFSWKIAYQC-XQBPLPMBSA-N 2 1 384.568 3.331 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)N[C@H](C)C1=CC[NH+](C)CC1 ZINC000272994104 1434947979 /nfs/dbraw/zinc/94/79/79/1434947979.db2.gz QKBKVZATCHXSDA-TZIWHRDSSA-N 2 1 384.568 3.190 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@H](C)C1=CC[N@H+](C)CC1 ZINC000272994104 1434947982 /nfs/dbraw/zinc/94/79/82/1434947982.db2.gz QKBKVZATCHXSDA-TZIWHRDSSA-N 2 1 384.568 3.190 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@H](C)C1=CC[N@@H+](C)CC1 ZINC000272994104 1434947985 /nfs/dbraw/zinc/94/79/85/1434947985.db2.gz QKBKVZATCHXSDA-TZIWHRDSSA-N 2 1 384.568 3.190 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccccc2OCC(=O)OC)[C@@H](C)C1 ZINC000273128609 1434964529 /nfs/dbraw/zinc/96/45/29/1434964529.db2.gz ARYMEJSUXQHBOL-NSHGMRRFSA-N 2 1 392.540 3.026 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccccc2OCC(=O)OC)[C@@H](C)C1 ZINC000273128609 1434964531 /nfs/dbraw/zinc/96/45/31/1434964531.db2.gz ARYMEJSUXQHBOL-NSHGMRRFSA-N 2 1 392.540 3.026 20 0 GGADMP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000273407913 1434986807 /nfs/dbraw/zinc/98/68/07/1434986807.db2.gz IDTKAEWLYQCSPD-NNMXDRDESA-N 2 1 386.584 3.269 20 0 GGADMP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000273410920 1434987083 /nfs/dbraw/zinc/98/70/83/1434987083.db2.gz ISRSMJDSHAIJKZ-WOIUINJBSA-N 2 1 386.584 3.411 20 0 GGADMP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000273423105 1434987969 /nfs/dbraw/zinc/98/79/69/1434987969.db2.gz SNZBZBPABSXKJI-KRWDZBQOSA-N 2 1 390.597 3.429 20 0 GGADMP COC(=O)CCCN1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000274215644 1435051876 /nfs/dbraw/zinc/05/18/76/1435051876.db2.gz OOWGXTIBQVSACN-DENIHFKCSA-N 2 1 387.568 3.047 20 0 GGADMP COC(=O)CCCN1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000274215644 1435051877 /nfs/dbraw/zinc/05/18/77/1435051877.db2.gz OOWGXTIBQVSACN-DENIHFKCSA-N 2 1 387.568 3.047 20 0 GGADMP CCn1nc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c2ccccc21 ZINC000274386438 1435067213 /nfs/dbraw/zinc/06/72/13/1435067213.db2.gz BLMKINBHVROUCP-HXUWFJFHSA-N 2 1 378.520 3.303 20 0 GGADMP CCn1nc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)c2ccccc21 ZINC000274386438 1435067215 /nfs/dbraw/zinc/06/72/15/1435067215.db2.gz BLMKINBHVROUCP-HXUWFJFHSA-N 2 1 378.520 3.303 20 0 GGADMP OCC[C@H]([NH2+]Cc1ccccc1C[NH2+][C@@H](CCO)c1ccco1)c1ccco1 ZINC000274392605 1435067680 /nfs/dbraw/zinc/06/76/80/1435067680.db2.gz HOCVYJJKSYMCKJ-PMACEKPBSA-N 2 1 384.476 3.299 20 0 GGADMP Cc1ccc(NC(=O)c2sccc2C[NH+](C)C)cc1NC(=O)CC[NH+](C)C ZINC000274469307 1435073324 /nfs/dbraw/zinc/07/33/24/1435073324.db2.gz YCNRPOHRXFRNMD-UHFFFAOYSA-N 2 1 388.537 3.261 20 0 GGADMP CN(CC[N@H+](C)C1CC1)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000274491732 1435074516 /nfs/dbraw/zinc/07/45/16/1435074516.db2.gz FOVLTMBPADEJOC-UHFFFAOYSA-N 2 1 384.524 3.147 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000274491732 1435074518 /nfs/dbraw/zinc/07/45/18/1435074518.db2.gz FOVLTMBPADEJOC-UHFFFAOYSA-N 2 1 384.524 3.147 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000274491732 1435074521 /nfs/dbraw/zinc/07/45/21/1435074521.db2.gz FOVLTMBPADEJOC-UHFFFAOYSA-N 2 1 384.524 3.147 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000274491732 1435074525 /nfs/dbraw/zinc/07/45/25/1435074525.db2.gz FOVLTMBPADEJOC-UHFFFAOYSA-N 2 1 384.524 3.147 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000274511126 1435075716 /nfs/dbraw/zinc/07/57/16/1435075716.db2.gz VHYNRHPXSURJAX-QGZVFWFLSA-N 2 1 384.524 3.261 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000274511126 1435075719 /nfs/dbraw/zinc/07/57/19/1435075719.db2.gz VHYNRHPXSURJAX-QGZVFWFLSA-N 2 1 384.524 3.261 20 0 GGADMP COc1ccc(-c2ccncc2)cc1C[NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1 ZINC000274759515 1435090201 /nfs/dbraw/zinc/09/02/01/1435090201.db2.gz GMGLYLUCORXNLA-FGZHOGPDSA-N 2 1 381.520 3.225 20 0 GGADMP COc1ccc(-c2ccncc2)cc1C[NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1 ZINC000274759512 1435090206 /nfs/dbraw/zinc/09/02/06/1435090206.db2.gz GMGLYLUCORXNLA-FCHUYYIVSA-N 2 1 381.520 3.225 20 0 GGADMP CC(=O)c1cccc(OC[C@H](O)C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000274784942 1435092348 /nfs/dbraw/zinc/09/23/48/1435092348.db2.gz AQUHYMPEIDBYHM-IHLLOCCUSA-N 2 1 396.531 3.129 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+]Cc2ccc(-c3ccccc3C(=O)OC)o2)CC1 ZINC000274812380 1435094872 /nfs/dbraw/zinc/09/48/72/1435094872.db2.gz DSSIMRZSRZTNPD-UHFFFAOYSA-N 2 1 399.535 3.241 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCCc2nc(-c3ccccc3)no2)[C@@H](C)C1 ZINC000274830414 1435096343 /nfs/dbraw/zinc/09/63/43/1435096343.db2.gz JKXQRXYUWTUIIH-AZUAARDMSA-N 2 1 386.540 3.396 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000274854448 1435098085 /nfs/dbraw/zinc/09/80/85/1435098085.db2.gz RXDVFZRFYRWGEQ-PMOQBDJRSA-N 2 1 398.547 3.073 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000274854456 1435098116 /nfs/dbraw/zinc/09/81/16/1435098116.db2.gz RXDVFZRFYRWGEQ-WWPVKYPJSA-N 2 1 398.547 3.073 20 0 GGADMP COc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1OCCO ZINC000274872524 1435099936 /nfs/dbraw/zinc/09/99/36/1435099936.db2.gz FXUYMQCAJHIJRE-WIYYLYMNSA-N 2 1 384.520 3.067 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(CS(C)(=O)=O)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274872578 1435099950 /nfs/dbraw/zinc/09/99/50/1435099950.db2.gz GAQFUJFSMGCHGW-PGRDOPGGSA-N 2 1 386.561 3.231 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(Cl)cn1 ZINC000274877171 1435100233 /nfs/dbraw/zinc/10/02/33/1435100233.db2.gz GXTZNSLYAATXHX-CRAIPNDOSA-N 2 1 386.927 3.283 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(Cl)cn1 ZINC000274877171 1435100235 /nfs/dbraw/zinc/10/02/35/1435100235.db2.gz GXTZNSLYAATXHX-CRAIPNDOSA-N 2 1 386.927 3.283 20 0 GGADMP C[C@H]([NH2+]CCCNC(=O)c1cccc(O)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274879281 1435100441 /nfs/dbraw/zinc/10/04/41/1435100441.db2.gz HGNACYXJIQRQMX-RXVVDRJESA-N 2 1 381.520 3.012 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1Cn1cncn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274894723 1435101668 /nfs/dbraw/zinc/10/16/68/1435101668.db2.gz JZQIFEHTJSAMRW-SIKLNZKXSA-N 2 1 375.520 3.327 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(CS(C)(=O)=O)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274903690 1435102475 /nfs/dbraw/zinc/10/24/75/1435102475.db2.gz LSBYODIMVDCEFO-PGRDOPGGSA-N 2 1 386.561 3.231 20 0 GGADMP C[C@@H]([NH2+]CCc1cccc(C(=O)N(C)C)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274955868 1435105780 /nfs/dbraw/zinc/10/57/80/1435105780.db2.gz VXKQDWMWWMVGRQ-XXBNENTESA-N 2 1 379.548 3.431 20 0 GGADMP C[C@H]([NH2+]CCc1cccc(C(=O)N(C)C)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274955862 1435105787 /nfs/dbraw/zinc/10/57/87/1435105787.db2.gz VXKQDWMWWMVGRQ-WMZHIEFXSA-N 2 1 379.548 3.431 20 0 GGADMP Cn1cncc1[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CCO1 ZINC000275399701 1435136738 /nfs/dbraw/zinc/13/67/38/1435136738.db2.gz CJSMYNBCYKSRNQ-IIDPUWFRSA-N 2 1 380.536 3.140 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C[C@@H]1CCc2[nH+]ccn2C1 ZINC000275577303 1435149914 /nfs/dbraw/zinc/14/99/14/1435149914.db2.gz OSZIFJSEAGJHDR-KBPBESRZSA-N 2 1 396.413 3.351 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C[C@@H]1CCc2[nH+]ccn2C1 ZINC000275577307 1435149925 /nfs/dbraw/zinc/14/99/25/1435149925.db2.gz OSZIFJSEAGJHDR-KGLIPLIRSA-N 2 1 396.413 3.351 20 0 GGADMP C[NH+](C)CCc1ccccc1NC(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000275643928 1435155684 /nfs/dbraw/zinc/15/56/84/1435155684.db2.gz MBGXWECYVJUNEN-OAQYLSRUSA-N 2 1 394.563 3.477 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]34)CC2)n[nH]1 ZINC000275928009 1435180243 /nfs/dbraw/zinc/18/02/43/1435180243.db2.gz QZZGRNXGGRNHJN-CEMLEFRQSA-N 2 1 379.552 3.187 20 0 GGADMP Cc1cc(N2CCC([NH2+]C3CC[NH+](CCc4ccc(F)cc4)CC3)CC2)n[nH]1 ZINC000275981232 1435183530 /nfs/dbraw/zinc/18/35/30/1435183530.db2.gz YEPWTOFQBVYWLA-UHFFFAOYSA-N 2 1 385.531 3.123 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N(C)Cc2ccccc2C)[C@@H](C)C1 ZINC000276286938 1435202381 /nfs/dbraw/zinc/20/23/81/1435202381.db2.gz VBPUUWHMQBJGQP-ONTIZHBOSA-N 2 1 389.584 3.069 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N(C)Cc2ccccc2C)[C@@H](C)C1 ZINC000276286938 1435202384 /nfs/dbraw/zinc/20/23/84/1435202384.db2.gz VBPUUWHMQBJGQP-ONTIZHBOSA-N 2 1 389.584 3.069 20 0 GGADMP C[NH+](C)CCCCCCCNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000276504203 1435214985 /nfs/dbraw/zinc/21/49/85/1435214985.db2.gz PQMCJWJGPSUVPW-OAQYLSRUSA-N 2 1 389.588 3.057 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc2c(c1)CC[NH2+]CC2 ZINC000276530849 1435215874 /nfs/dbraw/zinc/21/58/74/1435215874.db2.gz CRZCIAANPJZTRJ-NRFANRHFSA-N 2 1 391.559 3.359 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[N@@H+]2CCC[C@H]2C(N)=O)no1)[NH+]1CCCCCC1 ZINC000276917682 1435242805 /nfs/dbraw/zinc/24/28/05/1435242805.db2.gz LWABTHBLUYUGQB-APWZRJJASA-N 2 1 397.523 3.123 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[N@H+]2CCC[C@H]2C(N)=O)no1)[NH+]1CCCCCC1 ZINC000276917682 1435242807 /nfs/dbraw/zinc/24/28/07/1435242807.db2.gz LWABTHBLUYUGQB-APWZRJJASA-N 2 1 397.523 3.123 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[N@@H+]2CCC[C@@H]2C(N)=O)no1)[NH+]1CCCCCC1 ZINC000276917697 1435242895 /nfs/dbraw/zinc/24/28/95/1435242895.db2.gz LWABTHBLUYUGQB-VQIMIIECSA-N 2 1 397.523 3.123 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[N@H+]2CCC[C@@H]2C(N)=O)no1)[NH+]1CCCCCC1 ZINC000276917697 1435242897 /nfs/dbraw/zinc/24/28/97/1435242897.db2.gz LWABTHBLUYUGQB-VQIMIIECSA-N 2 1 397.523 3.123 20 0 GGADMP COc1ccc(CC[C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1O ZINC000276968386 1435248150 /nfs/dbraw/zinc/24/81/50/1435248150.db2.gz CMIXURSQFVQSLC-UTKZUKDTSA-N 2 1 384.520 3.078 20 0 GGADMP COc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1O ZINC000276968389 1435248172 /nfs/dbraw/zinc/24/81/72/1435248172.db2.gz CMIXURSQFVQSLC-UWJYYQICSA-N 2 1 384.520 3.078 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000277047076 1435255992 /nfs/dbraw/zinc/25/59/92/1435255992.db2.gz GUJIFUNJTHESES-GOSISDBHSA-N 2 1 376.570 3.183 20 0 GGADMP COc1cc2c(cc1OC)C[N@H+](Cc1ccccc1NC(=O)[C@H](C)[C@H](C)[NH3+])CC2 ZINC000277111753 1435263127 /nfs/dbraw/zinc/26/31/27/1435263127.db2.gz VOEIVRAJZKPRTA-CVEARBPZSA-N 2 1 397.519 3.184 20 0 GGADMP COc1cc2c(cc1OC)C[N@@H+](Cc1ccccc1NC(=O)[C@H](C)[C@H](C)[NH3+])CC2 ZINC000277111753 1435263132 /nfs/dbraw/zinc/26/31/32/1435263132.db2.gz VOEIVRAJZKPRTA-CVEARBPZSA-N 2 1 397.519 3.184 20 0 GGADMP COc1ccc(C[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1OCc1cccnc1 ZINC000277646367 1435318726 /nfs/dbraw/zinc/31/87/26/1435318726.db2.gz DGZVMGWWCMUOSO-LJQANCHMSA-N 2 1 399.535 3.260 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)NCC2CC[NH+](C3CC3)CC2)CC1 ZINC000278029777 1435351818 /nfs/dbraw/zinc/35/18/18/1435351818.db2.gz BCIUOBVEERZYNH-UHFFFAOYSA-N 2 1 398.595 3.414 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NCC1CC[NH+](C2CC2)CC1 ZINC000278031542 1435352022 /nfs/dbraw/zinc/35/20/22/1435352022.db2.gz KCRRPKLQQPCBMH-AVRDEDQJSA-N 2 1 384.568 3.071 20 0 GGADMP Cn1nccc1N1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000278506204 1435395743 /nfs/dbraw/zinc/39/57/43/1435395743.db2.gz QXSGYZRRQOKWSR-MYGLTJDJSA-N 2 1 379.552 3.174 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1 ZINC000278516125 1435396503 /nfs/dbraw/zinc/39/65/03/1435396503.db2.gz MLVHANQLINYVCT-ROUUACIJSA-N 2 1 376.545 3.368 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1 ZINC000278516125 1435396506 /nfs/dbraw/zinc/39/65/06/1435396506.db2.gz MLVHANQLINYVCT-ROUUACIJSA-N 2 1 376.545 3.368 20 0 GGADMP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)c(Cl)c1 ZINC000278611091 1435405214 /nfs/dbraw/zinc/40/52/14/1435405214.db2.gz RGGBWKAPYOAMCX-IAGOWNOFSA-N 2 1 381.948 3.456 20 0 GGADMP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)c(Cl)c1 ZINC000278611091 1435405216 /nfs/dbraw/zinc/40/52/16/1435405216.db2.gz RGGBWKAPYOAMCX-IAGOWNOFSA-N 2 1 381.948 3.456 20 0 GGADMP Cc1ccc(NC(=O)C[C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)c(Cl)c1 ZINC000278611093 1435405256 /nfs/dbraw/zinc/40/52/56/1435405256.db2.gz RGGBWKAPYOAMCX-IRXDYDNUSA-N 2 1 381.948 3.456 20 0 GGADMP Cc1ccc(NC(=O)C[C@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)c(Cl)c1 ZINC000278611093 1435405257 /nfs/dbraw/zinc/40/52/57/1435405257.db2.gz RGGBWKAPYOAMCX-IRXDYDNUSA-N 2 1 381.948 3.456 20 0 GGADMP C[C@H](C(=O)N(C)Cc1ccccc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278822734 1435427221 /nfs/dbraw/zinc/42/72/21/1435427221.db2.gz HPOWNISSMCSORZ-GOSISDBHSA-N 2 1 380.536 3.446 20 0 GGADMP COC(=O)c1coc([C@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)c1 ZINC000278839664 1435429461 /nfs/dbraw/zinc/42/94/61/1435429461.db2.gz UTGLUPBDEGBQBP-AWEZNQCLSA-N 2 1 375.469 3.234 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH+](C3CCOCC3)C[C@H]2C)cc1)C(C)C ZINC000278859899 1435432216 /nfs/dbraw/zinc/43/22/16/1435432216.db2.gz MYGMJONVXIZHBM-LJQANCHMSA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)cc1)C(C)C ZINC000278859899 1435432219 /nfs/dbraw/zinc/43/22/19/1435432219.db2.gz MYGMJONVXIZHBM-LJQANCHMSA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N2CC[N@H+](C3CCOCC3)C[C@H]2C)cc1)C(C)C ZINC000278859899 1435432224 /nfs/dbraw/zinc/43/22/24/1435432224.db2.gz MYGMJONVXIZHBM-LJQANCHMSA-N 2 1 387.568 3.242 20 0 GGADMP O[C@@H](COCc1ccccc1F)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278902502 1435437713 /nfs/dbraw/zinc/43/77/13/1435437713.db2.gz PMSRNQGHIBVMHB-HXUWFJFHSA-N 2 1 387.499 3.116 20 0 GGADMP O[C@H](COCc1ccccc1F)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278902497 1435437798 /nfs/dbraw/zinc/43/77/98/1435437798.db2.gz PMSRNQGHIBVMHB-FQEVSTJZSA-N 2 1 387.499 3.116 20 0 GGADMP C[NH+](C)Cc1ccc(-c2noc([C@@H](c3ccccc3)N3CC[NH+](C)CC3)n2)cc1 ZINC000278997378 1435450246 /nfs/dbraw/zinc/45/02/46/1435450246.db2.gz QXDBZFCSKMWTAX-OAQYLSRUSA-N 2 1 391.519 3.135 20 0 GGADMP COCCN(C)c1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cn1 ZINC000279337695 1435488140 /nfs/dbraw/zinc/48/81/40/1435488140.db2.gz DVBQDPQCLYWWPC-UHFFFAOYSA-N 2 1 383.540 3.077 20 0 GGADMP Cn1cc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c(-c2cccnc2)n1 ZINC000279375663 1435492519 /nfs/dbraw/zinc/49/25/19/1435492519.db2.gz IKBQHWQAAJKBFC-UHFFFAOYSA-N 2 1 376.508 3.395 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)C23CCC[NH+]2CCC3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000279533825 1435510678 /nfs/dbraw/zinc/51/06/78/1435510678.db2.gz UWQLBTBONCJXDR-YJBOKZPZSA-N 2 1 379.907 3.217 20 0 GGADMP O=C(C1CC[NH+](C2CC2)CC1)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000279661108 1435525192 /nfs/dbraw/zinc/52/51/92/1435525192.db2.gz DFXGBOGFNHHBAC-UHFFFAOYSA-N 2 1 375.944 3.249 20 0 GGADMP O=C(C1CC[NH+](C2CC2)CC1)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000279661108 1435525197 /nfs/dbraw/zinc/52/51/97/1435525197.db2.gz DFXGBOGFNHHBAC-UHFFFAOYSA-N 2 1 375.944 3.249 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](C[C@H](O)Cc2ccc3ccccc3c2)CC1 ZINC000279705292 1435532925 /nfs/dbraw/zinc/53/29/25/1435532925.db2.gz KEVRMIDLPAPNQS-TYBLODHISA-N 2 1 395.591 3.234 20 0 GGADMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccnn1-c1ccc(F)cc1 ZINC000279776137 1435541574 /nfs/dbraw/zinc/54/15/74/1435541574.db2.gz AORSROGKKNRGBZ-HSZRJFAPSA-N 2 1 394.494 3.258 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)[C@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000279907300 1435561205 /nfs/dbraw/zinc/56/12/05/1435561205.db2.gz LPLKNVOKYAYWTA-OALUTQOASA-N 2 1 377.573 3.203 20 0 GGADMP COc1cc2c(cc1OC)[C@H]([NH2+]C1CCN(c3cc(C)[nH+]c(C)n3)CC1)CC2 ZINC000279930714 1435565204 /nfs/dbraw/zinc/56/52/04/1435565204.db2.gz ASBRXNZRJCALOS-LJQANCHMSA-N 2 1 382.508 3.357 20 0 GGADMP COc1cc2c(cc1OC)[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)CC2 ZINC000279961704 1435569920 /nfs/dbraw/zinc/56/99/20/1435569920.db2.gz CIDRXHOIBVXLHC-RBBKRZOGSA-N 2 1 396.531 3.438 20 0 GGADMP COc1cc2c(cc1OC)[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)CC2 ZINC000279961695 1435570152 /nfs/dbraw/zinc/57/01/52/1435570152.db2.gz CIDRXHOIBVXLHC-IFMALSPDSA-N 2 1 396.531 3.438 20 0 GGADMP Cc1ccccc1-n1nccc1C[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000280209917 1435609334 /nfs/dbraw/zinc/60/93/34/1435609334.db2.gz IZMZAVQEVXHYED-UHFFFAOYSA-N 2 1 381.568 3.171 20 0 GGADMP CN(CCC[NH+]1CCCC1)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000281163605 1435787190 /nfs/dbraw/zinc/78/71/90/1435787190.db2.gz KTKYRDHKBYKRNX-SFHVURJKSA-N 2 1 378.586 3.087 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H](c3cncc(F)c3)C3CC3)c2)C1 ZINC000281172539 1435789421 /nfs/dbraw/zinc/78/94/21/1435789421.db2.gz HYZKTSQETQFGID-UGKGYDQZSA-N 2 1 396.510 3.159 20 0 GGADMP COc1cc(NC(=O)CC[N@@H+](C)CCC[NH+]2CCCC2)c(OC)cc1Cl ZINC000281211097 1435796836 /nfs/dbraw/zinc/79/68/36/1435796836.db2.gz DFGSCVRFZAQMRP-UHFFFAOYSA-N 2 1 383.920 3.104 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ncc(Cl)n2C)cc1OC ZINC000281648951 1435817148 /nfs/dbraw/zinc/81/71/48/1435817148.db2.gz JTHWQQXFPZAHJL-UHFFFAOYSA-N 2 1 380.920 3.093 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccnn1-c1ccccc1 ZINC000281725889 1435819562 /nfs/dbraw/zinc/81/95/62/1435819562.db2.gz USEISJPSYXGIAS-GCJKJVERSA-N 2 1 376.504 3.290 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccnn1-c1ccccc1 ZINC000281725894 1435819582 /nfs/dbraw/zinc/81/95/82/1435819582.db2.gz USEISJPSYXGIAS-XMSQKQJNSA-N 2 1 376.504 3.290 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3cnn(C)c3)s2)[C@H](C)C1 ZINC000282208006 1435838478 /nfs/dbraw/zinc/83/84/78/1435838478.db2.gz IUZYQEGHDVDYPC-VQIMIIECSA-N 2 1 376.570 3.375 20 0 GGADMP Cn1cc(-c2ccc(C[NH2+]Cc3ccccc3C[N@H+]3CC[C@H](O)C3)s2)cn1 ZINC000282270958 1435841094 /nfs/dbraw/zinc/84/10/94/1435841094.db2.gz OQNNVAHKLPDZGA-IBGZPJMESA-N 2 1 382.533 3.005 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000282479437 1435848726 /nfs/dbraw/zinc/84/87/26/1435848726.db2.gz QCADLXFGFBSUTL-HXUWFJFHSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282479437 1435848727 /nfs/dbraw/zinc/84/87/27/1435848727.db2.gz QCADLXFGFBSUTL-HXUWFJFHSA-N 2 1 383.540 3.182 20 0 GGADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000282557319 1435851477 /nfs/dbraw/zinc/85/14/77/1435851477.db2.gz XRAVQXIKNMZPRB-OAQYLSRUSA-N 2 1 384.568 3.213 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825289 1435861812 /nfs/dbraw/zinc/86/18/12/1435861812.db2.gz JGVMXJCKXNWRSU-NHCUHLMSSA-N 2 1 386.584 3.270 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825289 1435861813 /nfs/dbraw/zinc/86/18/13/1435861813.db2.gz JGVMXJCKXNWRSU-NHCUHLMSSA-N 2 1 386.584 3.270 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825289 1435861814 /nfs/dbraw/zinc/86/18/14/1435861814.db2.gz JGVMXJCKXNWRSU-NHCUHLMSSA-N 2 1 386.584 3.270 20 0 GGADMP CN(C)C(=O)[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000284421068 1436020580 /nfs/dbraw/zinc/02/05/80/1436020580.db2.gz OEXGDCYZVZDTAP-JOCHJYFZSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ncc([C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)cc1Cl ZINC000284548210 1436029483 /nfs/dbraw/zinc/02/94/83/1436029483.db2.gz XUSHEWLDTQBMRQ-CYBMUJFWSA-N 2 1 375.904 3.470 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@@H]4[NH2+]CC[C@H]42)n1)CCC3)[NH+]1CCCCC1 ZINC001164411098 718875611 /nfs/dbraw/zinc/87/56/11/718875611.db2.gz MKBWJHNODLPHBN-JKSUJKDBSA-N 2 1 383.565 3.107 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CC[C@@H]5[NH2+]CC[C@H]54)c23)C1 ZINC001164412792 718876128 /nfs/dbraw/zinc/87/61/28/718876128.db2.gz ZFGJHHATWNICON-HYVNUMGLSA-N 2 1 397.592 3.353 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@H]4[NH2+]CC[C@@H]42)n1)CCCC3)[NH+]1CCCCC1 ZINC001164411262 718876155 /nfs/dbraw/zinc/87/61/55/718876155.db2.gz OZBJAJFHJOTZCQ-SJORKVTESA-N 2 1 397.592 3.497 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CC[C@H]5[NH2+]CC[C@@H]53)n2)CCC4)CC1 ZINC001164410548 718876175 /nfs/dbraw/zinc/87/61/75/718876175.db2.gz CUFDJTBQABQYQK-SJORKVTESA-N 2 1 397.592 3.353 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CC[C@@H]3[NH2+]CC[C@H]32)n1 ZINC001164411748 718876637 /nfs/dbraw/zinc/87/66/37/718876637.db2.gz RZISNGYJPGJGDZ-DLBZAZTESA-N 2 1 379.533 3.361 20 0 GGADMP c1ccc(C[N@@H+]2CCc3c(ncnc3N3C[C@@H]4[NH2+]Cc5ccccc5[C@H]4C3)C2)cc1 ZINC001164425179 718941938 /nfs/dbraw/zinc/94/19/38/718941938.db2.gz SRKLKARVFQRBLE-VWNXMTODSA-N 2 1 397.526 3.111 20 0 GGADMP c1ccc(C[N@H+]2CCc3c(ncnc3N3C[C@@H]4[NH2+]Cc5ccccc5[C@H]4C3)C2)cc1 ZINC001164425179 718941943 /nfs/dbraw/zinc/94/19/43/718941943.db2.gz SRKLKARVFQRBLE-VWNXMTODSA-N 2 1 397.526 3.111 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@H]4[NH2+]C[C@@H]42)n1)CCC3)[NH+]1CCCCC1 ZINC001164448423 718999945 /nfs/dbraw/zinc/99/99/45/718999945.db2.gz IBYJTXTZQQFBRE-CVEARBPZSA-N 2 1 383.565 3.107 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@H]4[NH2+]C[C@H]42)n1)CCCC3)[NH+]1CCCCC1 ZINC001164450314 719000070 /nfs/dbraw/zinc/00/00/70/719000070.db2.gz UPOZJMJHLJBVCK-IAGOWNOFSA-N 2 1 397.592 3.497 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@@H]4[NH2+]C[C@H]42)n1)CCCC3)[NH+]1CCCC1 ZINC001164447152 719000142 /nfs/dbraw/zinc/00/01/42/719000142.db2.gz AWWIGJJSUCBVLK-JKSUJKDBSA-N 2 1 383.565 3.107 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CCC[C@H]5[NH2+]C[C@H]54)c32)C1 ZINC001164447680 719000810 /nfs/dbraw/zinc/00/08/10/719000810.db2.gz DHTZPADZNORVAE-DJIMGWMZSA-N 2 1 397.592 3.353 20 0 GGADMP CCOC(=O)C1CC[NH+](C2CCN(c3[nH+]cnc4c3ccn4C(C)C)CC2)CC1 ZINC001164616332 719030804 /nfs/dbraw/zinc/03/08/04/719030804.db2.gz AUFPBMWTEUHDSO-UHFFFAOYSA-N 2 1 399.539 3.256 20 0 GGADMP C[NH+]1CCC(Oc2ccnc(N3CC[C@@]4(C[NH2+]C[C@H]4c4ccccc4)C3)c2)CC1 ZINC001164619622 719048943 /nfs/dbraw/zinc/04/89/43/719048943.db2.gz CZBKUUWMIDMURJ-LADGPHEKSA-N 2 1 392.547 3.138 20 0 GGADMP C[NH+]1CCC(Oc2ccnc(N3CC[C@]4(C[NH2+]C[C@@H]4c4ccccc4)C3)c2)CC1 ZINC001164619627 719049077 /nfs/dbraw/zinc/04/90/77/719049077.db2.gz CZBKUUWMIDMURJ-VWNXMTODSA-N 2 1 392.547 3.138 20 0 GGADMP c1ccc(C[N@H+]2C[C@@H]3CCCN(c4nccc(C5CC[NH2+]CC5)n4)[C@@H]3C2)cc1 ZINC001164628799 719089457 /nfs/dbraw/zinc/08/94/57/719089457.db2.gz OIPOAXXVQQFWJO-RBBKRZOGSA-N 2 1 377.536 3.044 20 0 GGADMP [NH3+]C1CCN(c2cccc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)n2)CC1 ZINC001164626722 719092099 /nfs/dbraw/zinc/09/20/99/719092099.db2.gz IOKXGACRBQYETL-UNMCSNQZSA-N 2 1 391.563 3.110 20 0 GGADMP [NH3+]C1([C@@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]2CF)CC1 ZINC001164627456 719117083 /nfs/dbraw/zinc/11/70/83/719117083.db2.gz KMDOKBICULVFII-WOJBJXKFSA-N 2 1 380.511 3.153 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)c2ccnc(Cl)c2F)c2c1CC[NH2+]C2 ZINC001164685243 719604404 /nfs/dbraw/zinc/60/44/04/719604404.db2.gz UDZSRICBHKGUQF-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)c2ccnc(Cl)c2F)c2c1CC[NH2+]C2 ZINC001164685243 719604414 /nfs/dbraw/zinc/60/44/14/719604414.db2.gz UDZSRICBHKGUQF-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP Cc1cccc2c(Cl)nnc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)c12 ZINC001164681145 719619083 /nfs/dbraw/zinc/61/90/83/719619083.db2.gz BSVVOMFFWXKCLM-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1cccc2c(Cl)nnc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)c12 ZINC001164681145 719619090 /nfs/dbraw/zinc/61/90/90/719619090.db2.gz BSVVOMFFWXKCLM-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1nc2cc(Cl)ccc2c(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164683330 719623081 /nfs/dbraw/zinc/62/30/81/719623081.db2.gz SBPHBIYARMJJAF-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1nc2cc(Cl)ccc2c(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164683330 719623085 /nfs/dbraw/zinc/62/30/85/719623085.db2.gz SBPHBIYARMJJAF-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1ccc(C(F)(F)n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1Cl ZINC001164684578 719625987 /nfs/dbraw/zinc/62/59/87/719625987.db2.gz VEPWQTSEXWRENR-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP Cc1ccc(C(F)(F)n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1Cl ZINC001164684578 719626003 /nfs/dbraw/zinc/62/60/03/719626003.db2.gz VEPWQTSEXWRENR-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP Cc1ccc(Cl)nc1C(F)(F)n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164681149 719629463 /nfs/dbraw/zinc/62/94/63/719629463.db2.gz BTPBHUMFUFPYCL-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP Cc1ccc(Cl)nc1C(F)(F)n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164681149 719629468 /nfs/dbraw/zinc/62/94/68/719629468.db2.gz BTPBHUMFUFPYCL-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2ccc(-c3ccccc3Cl)nn2)c2c1CC[NH2+]C2 ZINC001164681629 719630151 /nfs/dbraw/zinc/63/01/51/719630151.db2.gz JTQSIXJYBUBOAS-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2ccc(-c3ccccc3Cl)nn2)c2c1CC[NH2+]C2 ZINC001164681629 719630156 /nfs/dbraw/zinc/63/01/56/719630156.db2.gz JTQSIXJYBUBOAS-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2ncccc2OCc2ccccc2)c2c1CC[NH2+]C2 ZINC001164679521 719637732 /nfs/dbraw/zinc/63/77/32/719637732.db2.gz FABPKFKODMSINY-UHFFFAOYSA-N 2 1 391.519 3.332 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2ncccc2OCc2ccccc2)c2c1CC[NH2+]C2 ZINC001164679521 719637743 /nfs/dbraw/zinc/63/77/43/719637743.db2.gz FABPKFKODMSINY-UHFFFAOYSA-N 2 1 391.519 3.332 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2ccc(-c3c(F)cccc3F)nn2)c2c1CC[NH2+]C2 ZINC001164680223 719644739 /nfs/dbraw/zinc/64/47/39/719644739.db2.gz SKZIUWRGAPGLNQ-UHFFFAOYSA-N 2 1 398.461 3.093 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2ccc(-c3c(F)cccc3F)nn2)c2c1CC[NH2+]C2 ZINC001164680223 719644747 /nfs/dbraw/zinc/64/47/47/719644747.db2.gz SKZIUWRGAPGLNQ-UHFFFAOYSA-N 2 1 398.461 3.093 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2c(F)ccc3c(Cl)ncnc32)c2c1CC[NH2+]C2 ZINC001164680710 719651420 /nfs/dbraw/zinc/65/14/20/719651420.db2.gz HZDHXXQRGJXPJA-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2c(F)ccc3c(Cl)ncnc32)c2c1CC[NH2+]C2 ZINC001164680710 719651431 /nfs/dbraw/zinc/65/14/31/719651431.db2.gz HZDHXXQRGJXPJA-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1[nH+]ccc3cc(OC)ccc31)C2 ZINC001164809803 720090453 /nfs/dbraw/zinc/09/04/53/720090453.db2.gz KMVUIESNRXIXRG-WMZHIEFXSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1[nH+]ccc3cc(OC)ccc31)C2 ZINC001164809803 720090461 /nfs/dbraw/zinc/09/04/61/720090461.db2.gz KMVUIESNRXIXRG-WMZHIEFXSA-N 2 1 381.520 3.428 20 0 GGADMP CCc1nc(N2CCC3(C[C@H](COC)[N@H+](Cc4ccccn4)C3)CC2)cc(C)[nH+]1 ZINC001164713554 720142668 /nfs/dbraw/zinc/14/26/68/720142668.db2.gz RWRKUROJBGXZSH-HXUWFJFHSA-N 2 1 395.551 3.250 20 0 GGADMP CCc1nc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)cc(C)[nH+]1 ZINC001164713554 720142670 /nfs/dbraw/zinc/14/26/70/720142670.db2.gz RWRKUROJBGXZSH-HXUWFJFHSA-N 2 1 395.551 3.250 20 0 GGADMP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1cc3cc(OC)ccc3c[nH+]1)C2 ZINC001164810552 720146651 /nfs/dbraw/zinc/14/66/51/720146651.db2.gz KBVRVWAVVKPXCU-NZQKXSOJSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc3cc(OC)ccc3c[nH+]1)C2 ZINC001164810552 720146656 /nfs/dbraw/zinc/14/66/56/720146656.db2.gz KBVRVWAVVKPXCU-NZQKXSOJSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1[nH+]cnc3c1ccn3C(C)C)C2 ZINC001164816011 720155170 /nfs/dbraw/zinc/15/51/70/720155170.db2.gz JSVHEIALGOWDMY-GCJKJVERSA-N 2 1 383.540 3.197 20 0 GGADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1[nH+]cnc3c1ccn3C(C)C)C2 ZINC001164816011 720155176 /nfs/dbraw/zinc/15/51/76/720155176.db2.gz JSVHEIALGOWDMY-GCJKJVERSA-N 2 1 383.540 3.197 20 0 GGADMP Cc1cccc2cc[nH+]c(N3CC[C@H]4[C@@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c12 ZINC001164830740 720346807 /nfs/dbraw/zinc/34/68/07/720346807.db2.gz WTRSCSVPJFKKOY-SFTDATJTSA-N 2 1 392.547 3.455 20 0 GGADMP Cc1cccc2cc[nH+]c(N3CC[C@@H]4[C@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c12 ZINC001164830735 720347557 /nfs/dbraw/zinc/34/75/57/720347557.db2.gz WTRSCSVPJFKKOY-NHCUHLMSSA-N 2 1 392.547 3.455 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3nccn3C[C@@H](C[NH+](C)C)C2)nc1 ZINC001164735014 720532197 /nfs/dbraw/zinc/53/21/97/720532197.db2.gz MPBGMTOURNUCEH-TZIWHRDSSA-N 2 1 396.583 3.413 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3nccn3C[C@H](C[NH+](C)C)C2)nc1 ZINC001164736051 720532278 /nfs/dbraw/zinc/53/22/78/720532278.db2.gz UVYYNHPNKORRDZ-AZUAARDMSA-N 2 1 382.556 3.023 20 0 GGADMP Cc1cc2[nH]ccc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)[nH+]1 ZINC001164835519 720555750 /nfs/dbraw/zinc/55/57/50/720555750.db2.gz HQRIIIUGGKJJHI-DBXWQHBBSA-N 2 1 378.524 3.446 20 0 GGADMP CC(C)[N@@H+]1[C@@H]2CCN(c3cc(N4CCCC4)cc[nH+]3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164842459 720570230 /nfs/dbraw/zinc/57/02/30/720570230.db2.gz XMZSLXHNGPXTIF-ILWGZMRPSA-N 2 1 394.567 3.256 20 0 GGADMP COc1ccc2c[nH+]c(N3CCc4ncc(C[NH+]5CCCC5)n4CC3)cc2c1 ZINC001164736725 720573613 /nfs/dbraw/zinc/57/36/13/720573613.db2.gz RTQVUQFUNVMUJK-UHFFFAOYSA-N 2 1 377.492 3.098 20 0 GGADMP Cc1[nH+]c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)cc2[nH]ccc21 ZINC001164841277 720588625 /nfs/dbraw/zinc/58/86/25/720588625.db2.gz RUKQFHGEMVMUAD-BBTUJRGHSA-N 2 1 378.524 3.446 20 0 GGADMP CCN(C)c1cc[nH+]c(N2CCC3(C[C@@H]([N@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164839862 720655437 /nfs/dbraw/zinc/65/54/37/720655437.db2.gz KLQHJYKSEUZZAI-HXUWFJFHSA-N 2 1 395.551 3.193 20 0 GGADMP CCN(C)c1cc[nH+]c(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164839862 720655443 /nfs/dbraw/zinc/65/54/43/720655443.db2.gz KLQHJYKSEUZZAI-HXUWFJFHSA-N 2 1 395.551 3.193 20 0 GGADMP C[N@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(NC3CC3)cc[nH+]1)CC2 ZINC001164841739 720655482 /nfs/dbraw/zinc/65/54/82/720655482.db2.gz PTXDIRORAQNIFR-FQEVSTJZSA-N 2 1 393.535 3.311 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(NC3CC3)cc[nH+]1)CC2 ZINC001164841739 720655496 /nfs/dbraw/zinc/65/54/96/720655496.db2.gz PTXDIRORAQNIFR-FQEVSTJZSA-N 2 1 393.535 3.311 20 0 GGADMP CN(C)c1cc[nH+]c(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164839752 720688637 /nfs/dbraw/zinc/68/86/37/720688637.db2.gz BOCZTAXUFUWYSX-OAQYLSRUSA-N 2 1 380.536 3.408 20 0 GGADMP Cc1cnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c(C[NH3+])c1 ZINC001164842879 720705671 /nfs/dbraw/zinc/70/56/71/720705671.db2.gz ZQSOCMDIXSRRPA-NRFANRHFSA-N 2 1 380.536 3.109 20 0 GGADMP COCC[N@@H+]1CCO[C@H]2CN(c3cc(C)c4ccc(C)c(C)c4[nH+]3)CC[C@H]2C1 ZINC001164853832 720878700 /nfs/dbraw/zinc/87/87/00/720878700.db2.gz CXGYQSLMEZJRQZ-FPOVZHCZSA-N 2 1 383.536 3.334 20 0 GGADMP COCC[N@H+]1CCO[C@H]2CN(c3cc(C)c4ccc(C)c(C)c4[nH+]3)CC[C@H]2C1 ZINC001164853832 720878702 /nfs/dbraw/zinc/87/87/02/720878702.db2.gz CXGYQSLMEZJRQZ-FPOVZHCZSA-N 2 1 383.536 3.334 20 0 GGADMP COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(C)cc(C)[nH+]1)CC2 ZINC001164790584 721450787 /nfs/dbraw/zinc/45/07/87/721450787.db2.gz ZUIWTSPKNQVOKF-OAQYLSRUSA-N 2 1 387.568 3.432 20 0 GGADMP COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc3[nH]ccc3c[nH+]1)CC2 ZINC001164790237 721452440 /nfs/dbraw/zinc/45/24/40/721452440.db2.gz XNMJPFDBYVBOQB-FQEVSTJZSA-N 2 1 398.551 3.297 20 0 GGADMP COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(C)c(C)[nH+]1)CC2 ZINC001164784145 721457666 /nfs/dbraw/zinc/45/76/66/721457666.db2.gz HBHQVXQKZBFWLH-NRFANRHFSA-N 2 1 387.568 3.432 20 0 GGADMP C[N@@H+](Cc1ccc(N2CC[NH+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1)C1CC1 ZINC001164908714 721557447 /nfs/dbraw/zinc/55/74/47/721557447.db2.gz RTIWCLSPQQSVHJ-IFMALSPDSA-N 2 1 396.510 3.157 20 0 GGADMP C[NH+](Cc1ccc(N2CC[N@@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1)C1CC1 ZINC001164908714 721557452 /nfs/dbraw/zinc/55/74/52/721557452.db2.gz RTIWCLSPQQSVHJ-IFMALSPDSA-N 2 1 396.510 3.157 20 0 GGADMP C[NH+](Cc1ccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1)C1CC1 ZINC001164908714 721557455 /nfs/dbraw/zinc/55/74/55/721557455.db2.gz RTIWCLSPQQSVHJ-IFMALSPDSA-N 2 1 396.510 3.157 20 0 GGADMP Cc1cc2[nH]ccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)[nH+]1 ZINC001164806717 721560116 /nfs/dbraw/zinc/56/01/16/721560116.db2.gz RFZJRMJEWNNNSS-ACRUOGEOSA-N 2 1 377.492 3.135 20 0 GGADMP Cc1cc2[nH]ccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)[nH+]1 ZINC001164806721 721560292 /nfs/dbraw/zinc/56/02/92/721560292.db2.gz RFZJRMJEWNNNSS-PCCBWWKXSA-N 2 1 377.492 3.135 20 0 GGADMP Cc1[nH+]c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)cc2[nH]ccc21 ZINC001164805379 721572507 /nfs/dbraw/zinc/57/25/07/721572507.db2.gz NDKGDDVXSYNOCU-RZUBCFFCSA-N 2 1 377.492 3.135 20 0 GGADMP CN(C)c1cc[nH+]c(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164906708 721702185 /nfs/dbraw/zinc/70/21/85/721702185.db2.gz PDZIVNWDMFJYQS-HXUWFJFHSA-N 2 1 387.478 3.280 20 0 GGADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(N4CCCC4)cc[nH+]3)C[C@@H]21 ZINC001165028634 721797777 /nfs/dbraw/zinc/79/77/77/721797777.db2.gz ZINSSHNORPSFDD-HLAWJBBLSA-N 2 1 392.551 3.209 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(N4CCCC4)cc[nH+]3)C[C@@H]21 ZINC001165028634 721797781 /nfs/dbraw/zinc/79/77/81/721797781.db2.gz ZINSSHNORPSFDD-HLAWJBBLSA-N 2 1 392.551 3.209 20 0 GGADMP Cc1c[nH]c2nc[nH+]c(N3C[C@@H]4CCC[C@@H]([N@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165021366 721798526 /nfs/dbraw/zinc/79/85/26/721798526.db2.gz GNCILNQNCXEMOM-YTQUADARSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1c[nH]c2nc[nH+]c(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165021366 721798531 /nfs/dbraw/zinc/79/85/31/721798531.db2.gz GNCILNQNCXEMOM-YTQUADARSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)[nH]1 ZINC001165027501 721807567 /nfs/dbraw/zinc/80/75/67/721807567.db2.gz VYYYYEUEMWJPSD-DBVUQKKJSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)[nH]1 ZINC001165027501 721807568 /nfs/dbraw/zinc/80/75/68/721807568.db2.gz VYYYYEUEMWJPSD-DBVUQKKJSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)[nH]1 ZINC001165027508 721807647 /nfs/dbraw/zinc/80/76/47/721807647.db2.gz VYYYYEUEMWJPSD-VDGAXYAQSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)[nH]1 ZINC001165027508 721807648 /nfs/dbraw/zinc/80/76/48/721807648.db2.gz VYYYYEUEMWJPSD-VDGAXYAQSA-N 2 1 376.508 3.398 20 0 GGADMP CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001164925205 721867835 /nfs/dbraw/zinc/86/78/35/721867835.db2.gz MXGXBVOWZMLJID-PKTZIBPZSA-N 2 1 389.547 3.299 20 0 GGADMP C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001164925205 721867837 /nfs/dbraw/zinc/86/78/37/721867837.db2.gz MXGXBVOWZMLJID-PKTZIBPZSA-N 2 1 389.547 3.299 20 0 GGADMP c1cncc(C[N@@H+]2CCC3(C2)CCN(c2cc[nH+]c(N4CCCCC4)n2)CC3)c1 ZINC001164956128 722021079 /nfs/dbraw/zinc/02/10/79/722021079.db2.gz WTKRHUJYZOAZJC-UHFFFAOYSA-N 2 1 392.551 3.354 20 0 GGADMP c1cncc(C[N@H+]2CCC3(C2)CCN(c2cc[nH+]c(N4CCCCC4)n2)CC3)c1 ZINC001164956128 722021081 /nfs/dbraw/zinc/02/10/81/722021081.db2.gz WTKRHUJYZOAZJC-UHFFFAOYSA-N 2 1 392.551 3.354 20 0 GGADMP c1cc2c(cc[nH+]c2N2CCC3(CC2)COCC[N@H+](Cc2ccncc2)C3)[nH]1 ZINC001164960491 722053077 /nfs/dbraw/zinc/05/30/77/722053077.db2.gz PMLPZQGJGGXAHZ-UHFFFAOYSA-N 2 1 377.492 3.077 20 0 GGADMP Cc1[nH+]c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)cc2[nH]ccc21 ZINC001164960001 722058602 /nfs/dbraw/zinc/05/86/02/722058602.db2.gz CIFMNFJNDDQNNP-UHFFFAOYSA-N 2 1 391.519 3.385 20 0 GGADMP CC(C)(C[NH2+]C1CC[NH+](Cc2ccc(-c3nn[nH]n3)cc2)CC1)c1cccs1 ZINC000824158603 946604389 /nfs/dbraw/zinc/60/43/89/946604389.db2.gz ZYTWSEABRBWTEV-UHFFFAOYSA-N 2 1 396.564 3.460 20 0 GGADMP CC(C)(C)[C@@]1(C[NH2+]C2CC[NH+](CC(=O)[O-])CC2)CC[N@H+](Cc2ccccc2)C1 ZINC001588640330 959682812 /nfs/dbraw/zinc/68/28/12/959682812.db2.gz VVGPMWNUJAAECV-HSZRJFAPSA-N 2 1 387.568 3.063 20 0 GGADMP CC(C)(C)[C@@]1(C[NH2+]C2CC[NH+](CC(=O)[O-])CC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001588640330 959682824 /nfs/dbraw/zinc/68/28/24/959682824.db2.gz VVGPMWNUJAAECV-HSZRJFAPSA-N 2 1 387.568 3.063 20 0 GGADMP Cc1cc(NC(=O)C[NH+]2CCC(CC[NH+](C)C)CC2)ccc1Br ZINC000118868667 564247454 /nfs/dbraw/zinc/24/74/54/564247454.db2.gz VXIIFNTWJPMVBC-UHFFFAOYSA-N 2 1 382.346 3.360 20 0 GGADMP COc1ccc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cc1Br ZINC000120711163 564333519 /nfs/dbraw/zinc/33/35/19/564333519.db2.gz NZBJCYSVUBQQQL-UHFFFAOYSA-N 2 1 383.330 3.002 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@H]2CCc3c2cc(Br)cc3F)CC1 ZINC000124355380 564479739 /nfs/dbraw/zinc/47/97/39/564479739.db2.gz MNIGOPICNGAJPU-IBGZPJMESA-N 2 1 398.364 3.439 20 0 GGADMP COc1ccc(Br)cc1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051958515 564566910 /nfs/dbraw/zinc/56/69/10/564566910.db2.gz OPPSQIWEIOLLEN-UHFFFAOYSA-N 2 1 383.330 3.002 20 0 GGADMP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1cccc(Br)c1 ZINC000128169705 564609694 /nfs/dbraw/zinc/60/96/94/564609694.db2.gz DORSDYZETQQNBX-DOTOQJQBSA-N 2 1 382.346 3.077 20 0 GGADMP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc(Br)cc1 ZINC000128205286 564610407 /nfs/dbraw/zinc/61/04/07/564610407.db2.gz GLFAYJKPBZQQRE-RDJZCZTQSA-N 2 1 382.346 3.077 20 0 GGADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000058061204 564679519 /nfs/dbraw/zinc/67/95/19/564679519.db2.gz BUQWCBVNFXVWHA-CQSZACIVSA-N 2 1 383.330 3.430 20 0 GGADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000058061204 564679521 /nfs/dbraw/zinc/67/95/21/564679521.db2.gz BUQWCBVNFXVWHA-CQSZACIVSA-N 2 1 383.330 3.430 20 0 GGADMP CC[N@H+](C)CCNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000066977697 564780255 /nfs/dbraw/zinc/78/02/55/564780255.db2.gz OISROBPFNSBSGH-UHFFFAOYSA-N 2 1 387.355 3.209 20 0 GGADMP CC[N@@H+](C)CCNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000066977697 564780261 /nfs/dbraw/zinc/78/02/61/564780261.db2.gz OISROBPFNSBSGH-UHFFFAOYSA-N 2 1 387.355 3.209 20 0 GGADMP Brc1cc(C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc2c1OCCCO2 ZINC000071939935 564858883 /nfs/dbraw/zinc/85/88/83/564858883.db2.gz IGRSGDCGYOTRPI-ZDUSSCGKSA-N 2 1 381.314 3.184 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000081516681 564867966 /nfs/dbraw/zinc/86/79/66/564867966.db2.gz JFWUTMGBZXRONG-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000081516681 564867972 /nfs/dbraw/zinc/86/79/72/564867972.db2.gz JFWUTMGBZXRONG-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000081516681 564867975 /nfs/dbraw/zinc/86/79/75/564867975.db2.gz JFWUTMGBZXRONG-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000081516681 564867980 /nfs/dbraw/zinc/86/79/80/564867980.db2.gz JFWUTMGBZXRONG-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000081516684 564868251 /nfs/dbraw/zinc/86/82/51/564868251.db2.gz JFWUTMGBZXRONG-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000081516684 564868257 /nfs/dbraw/zinc/86/82/57/564868257.db2.gz JFWUTMGBZXRONG-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000081516684 564868261 /nfs/dbraw/zinc/86/82/61/564868261.db2.gz JFWUTMGBZXRONG-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000081516684 564868264 /nfs/dbraw/zinc/86/82/64/564868264.db2.gz JFWUTMGBZXRONG-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP O=C(CC[N@H+]1CC[C@H](C[NH+]2CCCC2)C1)Nc1ccccc1Br ZINC000150750979 564888730 /nfs/dbraw/zinc/88/87/30/564888730.db2.gz KSJWJUGGGSBXEV-OAHLLOKOSA-N 2 1 380.330 3.195 20 0 GGADMP O=C(CC[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1)Nc1ccccc1Br ZINC000150750995 564889085 /nfs/dbraw/zinc/88/90/85/564889085.db2.gz KSJWJUGGGSBXEV-HNNXBMFYSA-N 2 1 380.330 3.195 20 0 GGADMP O=C(CC[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1)Nc1ccc(Br)cc1F ZINC000150834724 564892707 /nfs/dbraw/zinc/89/27/07/564892707.db2.gz QGFMRLKFQXELBY-AWEZNQCLSA-N 2 1 398.320 3.335 20 0 GGADMP O=C(CC[N@H+]1CC[C@H](C[NH+]2CCCC2)C1)Nc1ccc(Br)cc1F ZINC000150834690 564893338 /nfs/dbraw/zinc/89/33/38/564893338.db2.gz QGFMRLKFQXELBY-CQSZACIVSA-N 2 1 398.320 3.335 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000151097763 564905115 /nfs/dbraw/zinc/90/51/15/564905115.db2.gz VDLWJAJKXSBGED-GJZGRUSLSA-N 2 1 382.346 3.488 20 0 GGADMP CN(CC(=O)Nc1ccc(OC(F)F)c(Cl)c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000152378259 564957253 /nfs/dbraw/zinc/95/72/53/564957253.db2.gz KGUVHXURVHMZTF-GFCCVEGCSA-N 2 1 375.847 3.154 20 0 GGADMP CCCOc1ccc(Br)cc1C[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000105477066 564967227 /nfs/dbraw/zinc/96/72/27/564967227.db2.gz RRZPLVOYZCXTLR-UHFFFAOYSA-N 2 1 398.389 3.355 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)Cn2cc(Br)cn2)cc1F ZINC000153715017 565007091 /nfs/dbraw/zinc/00/70/91/565007091.db2.gz UVZADXJRZUSPDD-GFCCVEGCSA-N 2 1 392.276 3.457 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(Cl)s3)c2)C1 ZINC000108421034 565011160 /nfs/dbraw/zinc/01/11/60/565011160.db2.gz AISHOTLKZDPDES-INIZCTEOSA-N 2 1 377.941 3.389 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]CC1=Cc2cc(Br)ccc2OC1 ZINC000111386576 565054156 /nfs/dbraw/zinc/05/41/56/565054156.db2.gz FWIUQRTWVJXOHI-SFHVURJKSA-N 2 1 395.341 3.051 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(I)cc2)CC1 ZINC000154877088 565055736 /nfs/dbraw/zinc/05/57/36/565055736.db2.gz JNHDIEVSPBIAAB-ZDUSSCGKSA-N 2 1 388.293 3.053 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H](C)c2ccc(I)cc2)CC1 ZINC000154877211 565055739 /nfs/dbraw/zinc/05/57/39/565055739.db2.gz JNHDIEVSPBIAAB-CYBMUJFWSA-N 2 1 388.293 3.053 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3cncc(Br)c3)CC2)nc(C)[nH+]1 ZINC000183726990 565090750 /nfs/dbraw/zinc/09/07/50/565090750.db2.gz QNMKLMQFERXFDR-UHFFFAOYSA-N 2 1 376.302 3.010 20 0 GGADMP O=C(CC[C@H]1CCC[NH2+]1)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000292015318 565092436 /nfs/dbraw/zinc/09/24/36/565092436.db2.gz DSIQVVZQSXFJJL-QGZVFWFLSA-N 2 1 394.357 3.062 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1Br ZINC000157602404 565138162 /nfs/dbraw/zinc/13/81/62/565138162.db2.gz KHXLWHLSVYDBLA-OAHLLOKOSA-N 2 1 397.361 3.329 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3ccc(Br)cc3F)CC[C@@H]21 ZINC000158970900 565189653 /nfs/dbraw/zinc/18/96/53/565189653.db2.gz IKUXEZJGOJNGLQ-GUYCJALGSA-N 2 1 398.320 3.333 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CCC(=O)Nc3ccc(Br)cc3F)CC[C@@H]21 ZINC000158970900 565189658 /nfs/dbraw/zinc/18/96/58/565189658.db2.gz IKUXEZJGOJNGLQ-GUYCJALGSA-N 2 1 398.320 3.333 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CCC(=O)Nc3ccc(Br)cc3F)CC[C@@H]21 ZINC000158970900 565189662 /nfs/dbraw/zinc/18/96/62/565189662.db2.gz IKUXEZJGOJNGLQ-GUYCJALGSA-N 2 1 398.320 3.333 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3ccc(Br)cc3F)CC[C@@H]21 ZINC000158971028 565189946 /nfs/dbraw/zinc/18/99/46/565189946.db2.gz IKUXEZJGOJNGLQ-DYVFJYSZSA-N 2 1 398.320 3.333 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CCC(=O)Nc3ccc(Br)cc3F)CC[C@@H]21 ZINC000158971028 565189951 /nfs/dbraw/zinc/18/99/51/565189951.db2.gz IKUXEZJGOJNGLQ-DYVFJYSZSA-N 2 1 398.320 3.333 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCC(=O)Nc3ccc(Br)cc3F)CC[C@@H]21 ZINC000158971028 565189954 /nfs/dbraw/zinc/18/99/54/565189954.db2.gz IKUXEZJGOJNGLQ-DYVFJYSZSA-N 2 1 398.320 3.333 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000295122606 565246606 /nfs/dbraw/zinc/24/66/06/565246606.db2.gz XLZVWLAQYIVVTG-RJCAOGMDSA-N 2 1 380.330 3.381 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@@H](c3nccn3C)C2)cc1O ZINC000373234591 565275181 /nfs/dbraw/zinc/27/51/81/565275181.db2.gz YTJJCKRSVKYJSB-GFCCVEGCSA-N 2 1 380.286 3.276 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@H](c3nccn3C)C2)cc1O ZINC000373234594 565275728 /nfs/dbraw/zinc/27/57/28/565275728.db2.gz YTJJCKRSVKYJSB-LBPRGKRZSA-N 2 1 380.286 3.276 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2ncc(Br)cc2F)CC1 ZINC000186999377 565301200 /nfs/dbraw/zinc/30/12/00/565301200.db2.gz POYIXKQYPJLKAY-AWEZNQCLSA-N 2 1 387.341 3.052 20 0 GGADMP C[C@H](C[NH+](C)CCOCC[N@H+](C)C[C@H](C)c1nccs1)c1nccs1 ZINC000273090921 565307208 /nfs/dbraw/zinc/30/72/08/565307208.db2.gz SOTKZVPYJRYUNS-IYBDPMFKSA-N 2 1 382.599 3.387 20 0 GGADMP C[C@H](C[N@@H+](C)CCOCC[NH+](C)C[C@H](C)c1nccs1)c1nccs1 ZINC000273090921 565307213 /nfs/dbraw/zinc/30/72/13/565307213.db2.gz SOTKZVPYJRYUNS-IYBDPMFKSA-N 2 1 382.599 3.387 20 0 GGADMP C[C@H](C[N@H+](C)CCOCC[NH+](C)C[C@H](C)c1nccs1)c1nccs1 ZINC000273090921 565307217 /nfs/dbraw/zinc/30/72/17/565307217.db2.gz SOTKZVPYJRYUNS-IYBDPMFKSA-N 2 1 382.599 3.387 20 0 GGADMP C[C@H](Cn1cc(Br)cn1)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165315364 565369552 /nfs/dbraw/zinc/36/95/52/565369552.db2.gz QKOAQPCUPAATDB-AEFFLSMTSA-N 2 1 391.357 3.188 20 0 GGADMP Brc1ccc(N2CC[C@H](C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000166333747 565375001 /nfs/dbraw/zinc/37/50/01/565375001.db2.gz NZPTXHHXXSSNBG-SZVBFZGTSA-N 2 1 378.358 3.492 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C[C@H]1CCc2[nH+]ccn2C1 ZINC000275540212 565417025 /nfs/dbraw/zinc/41/70/25/565417025.db2.gz MPURBMVSOKBHBV-UONOGXRCSA-N 2 1 391.313 3.215 20 0 GGADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000188706951 565419354 /nfs/dbraw/zinc/41/93/54/565419354.db2.gz UHRNWOSPNODJGG-MRXNPFEDSA-N 2 1 396.373 3.107 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000188706951 565419359 /nfs/dbraw/zinc/41/93/59/565419359.db2.gz UHRNWOSPNODJGG-MRXNPFEDSA-N 2 1 396.373 3.107 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)CC(=O)Nc1ccc(Br)cc1 ZINC000298689069 565424885 /nfs/dbraw/zinc/42/48/85/565424885.db2.gz JYGBCBQUHUEICW-ZDUSSCGKSA-N 2 1 379.302 3.351 20 0 GGADMP C[NH+](C)C1CCN(CCNc2cc[nH+]c3cc(Br)ccc23)CC1 ZINC000301547229 565494635 /nfs/dbraw/zinc/49/46/35/565494635.db2.gz PUPGWSUVLNIRFT-UHFFFAOYSA-N 2 1 377.330 3.435 20 0 GGADMP C[C@H]1CN(c2cc[nH+]c3cc(Br)ccc32)CC[N@@H+]1CC(C)(C)O ZINC000302501930 565543099 /nfs/dbraw/zinc/54/30/99/565543099.db2.gz PADAGQRYGLTTSN-ZDUSSCGKSA-N 2 1 378.314 3.279 20 0 GGADMP C[C@H]1CN(c2cc[nH+]c3cc(Br)ccc32)CC[N@H+]1CC(C)(C)O ZINC000302501930 565543100 /nfs/dbraw/zinc/54/31/00/565543100.db2.gz PADAGQRYGLTTSN-ZDUSSCGKSA-N 2 1 378.314 3.279 20 0 GGADMP C[C@H](NC(=O)C[N@@H+]1CCC[C@H](C)[C@H]1CC[NH3+])c1ccc(Br)cc1 ZINC000404285060 565582567 /nfs/dbraw/zinc/58/25/67/565582567.db2.gz RNFTZVYHUQJCQJ-GRDNDAEWSA-N 2 1 382.346 3.076 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@H](C)[C@H]1CC[NH3+])c1ccc(Br)cc1 ZINC000404285060 565582571 /nfs/dbraw/zinc/58/25/71/565582571.db2.gz RNFTZVYHUQJCQJ-GRDNDAEWSA-N 2 1 382.346 3.076 20 0 GGADMP C[C@H](NC(=O)C[N@@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+])c1ccc(Br)cc1 ZINC000404285063 565583275 /nfs/dbraw/zinc/58/32/75/565583275.db2.gz RNFTZVYHUQJCQJ-KEYYUXOJSA-N 2 1 382.346 3.076 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+])c1ccc(Br)cc1 ZINC000404285063 565583277 /nfs/dbraw/zinc/58/32/77/565583277.db2.gz RNFTZVYHUQJCQJ-KEYYUXOJSA-N 2 1 382.346 3.076 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000173790732 565586544 /nfs/dbraw/zinc/58/65/44/565586544.db2.gz KROUWKYVUGZSPK-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP Cc1nn(C)c(CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1Br ZINC000279134571 565597020 /nfs/dbraw/zinc/59/70/20/565597020.db2.gz NEUSOQVDXOCWFU-KRWDZBQOSA-N 2 1 391.357 3.145 20 0 GGADMP C[C@@H](C[NH2+]Cc1cc(Br)c2c(c1)OCCO2)C[NH+]1CCCCC1 ZINC000321338566 565605674 /nfs/dbraw/zinc/60/56/74/565605674.db2.gz VOQUHHLWEKEBME-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000191489898 565607887 /nfs/dbraw/zinc/60/78/87/565607887.db2.gz OASNOPMGYFPZJT-QGZVFWFLSA-N 2 1 393.329 3.147 20 0 GGADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H](C(N)=O)c1ccc(Br)cc1 ZINC000191490474 565608160 /nfs/dbraw/zinc/60/81/60/565608160.db2.gz IQCAUPCYKRGJQH-QGZVFWFLSA-N 2 1 393.329 3.147 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000174219608 565621791 /nfs/dbraw/zinc/62/17/91/565621791.db2.gz LEGTUEHPKHRJGQ-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000174219608 565621792 /nfs/dbraw/zinc/62/17/92/565621792.db2.gz LEGTUEHPKHRJGQ-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]Cc2cnc3ccc(Br)cn23)C[C@H](C)O1 ZINC000174316456 565630008 /nfs/dbraw/zinc/63/00/08/565630008.db2.gz YTNCJIRCXLYLMV-GASCZTMLSA-N 2 1 395.345 3.076 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]Cc1ccc(Br)c(Cl)c1 ZINC000192167495 565664246 /nfs/dbraw/zinc/66/42/46/565664246.db2.gz JSLAYYNKOCJWNC-CQSZACIVSA-N 2 1 375.738 3.429 20 0 GGADMP C[C@@H]1CC[N@H+](CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)CCS1 ZINC000192184614 565666612 /nfs/dbraw/zinc/66/66/12/565666612.db2.gz LPIDWUAQXNQEAB-MRXNPFEDSA-N 2 1 379.595 3.001 20 0 GGADMP C[C@H]1CC[N@H+](CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)CCS1 ZINC000192184621 565667136 /nfs/dbraw/zinc/66/71/36/565667136.db2.gz LPIDWUAQXNQEAB-INIZCTEOSA-N 2 1 379.595 3.001 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000280876111 565701169 /nfs/dbraw/zinc/70/11/69/565701169.db2.gz ZTZSAILADVPPHV-CQSZACIVSA-N 2 1 392.219 3.296 20 0 GGADMP C[C@H](Cn1cc(Br)cn1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192935001 565720106 /nfs/dbraw/zinc/72/01/06/565720106.db2.gz KBJPNXHBDKMMQL-WBVHZDCISA-N 2 1 377.330 3.146 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[NH2+]C(C)(C)c2ccccc2Br)CC1 ZINC000411481071 565732703 /nfs/dbraw/zinc/73/27/03/565732703.db2.gz ZDRUOMXCYCHAMT-UHFFFAOYSA-N 2 1 396.373 3.263 20 0 GGADMP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000176280840 565761675 /nfs/dbraw/zinc/76/16/75/565761675.db2.gz NXPOOJFZZRWTHD-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000176280840 565761684 /nfs/dbraw/zinc/76/16/84/565761684.db2.gz NXPOOJFZZRWTHD-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000176280840 565761690 /nfs/dbraw/zinc/76/16/90/565761690.db2.gz NXPOOJFZZRWTHD-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000176280840 565761695 /nfs/dbraw/zinc/76/16/95/565761695.db2.gz NXPOOJFZZRWTHD-ZBFHGGJFSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000176280824 565762244 /nfs/dbraw/zinc/76/22/44/565762244.db2.gz NXPOOJFZZRWTHD-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000176280824 565762250 /nfs/dbraw/zinc/76/22/50/565762250.db2.gz NXPOOJFZZRWTHD-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000176280824 565762251 /nfs/dbraw/zinc/76/22/51/565762251.db2.gz NXPOOJFZZRWTHD-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000176280824 565762256 /nfs/dbraw/zinc/76/22/56/565762256.db2.gz NXPOOJFZZRWTHD-HOCLYGCPSA-N 2 1 375.340 3.397 20 0 GGADMP C[C@H]1[C@@H]([NH3+])CCN1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000332295729 565826948 /nfs/dbraw/zinc/82/69/48/565826948.db2.gz KLRZKJNXUWZTMT-SJCJKPOMSA-N 2 1 385.339 3.089 20 0 GGADMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2nc3ccc(Br)cc3o2)CC1 ZINC000332335769 565830098 /nfs/dbraw/zinc/83/00/98/565830098.db2.gz QZGMIWQGTKSQLE-ZDUSSCGKSA-N 2 1 396.329 3.115 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1Cc1nc(-c3cccc(Br)c3)no1)CC[NH2+]CC2 ZINC000333622800 565889751 /nfs/dbraw/zinc/88/97/51/565889751.db2.gz UPMNPXSSOQVKGL-CYBMUJFWSA-N 2 1 391.313 3.463 20 0 GGADMP C[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(F)cc(Br)c2)[C@H]2CCC[C@H]21 ZINC000414173022 565900277 /nfs/dbraw/zinc/90/02/77/565900277.db2.gz FJOZKAPZEYKVTJ-DQEVTTJGSA-N 2 1 399.348 3.202 20 0 GGADMP CC[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000414192570 565903278 /nfs/dbraw/zinc/90/32/78/565903278.db2.gz SLGRMIQANZERQR-RHSMWYFYSA-N 2 1 387.977 3.021 20 0 GGADMP CCCC[C@H]([NH3+])C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000236786372 565945280 /nfs/dbraw/zinc/94/52/80/565945280.db2.gz UPXVMHHLGKZDGY-KRWDZBQOSA-N 2 1 382.346 3.047 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc(Br)c1OC ZINC000237354986 565957859 /nfs/dbraw/zinc/95/78/59/565957859.db2.gz OVKJMUMMFSDSOV-UHFFFAOYSA-N 2 1 383.330 3.430 20 0 GGADMP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2cscc2Br)cc1 ZINC000286442415 565960476 /nfs/dbraw/zinc/96/04/76/565960476.db2.gz JKFMONLJZGAPQL-UHFFFAOYSA-N 2 1 396.354 3.092 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414829676 565962828 /nfs/dbraw/zinc/96/28/28/565962828.db2.gz NXURFYBFAPLBIJ-HNNXBMFYSA-N 2 1 377.330 3.341 20 0 GGADMP CCCC[C@@H](C[NH3+])[NH2+]C1CCN(C(=O)c2ccc(Br)cc2C)CC1 ZINC000414817758 565962887 /nfs/dbraw/zinc/96/28/87/565962887.db2.gz SYVMYNPHPFLEAG-KRWDZBQOSA-N 2 1 396.373 3.469 20 0 GGADMP C[NH2+]C[C@H](C)C[NH2+]Cc1cc(Br)cc(Br)c1OC ZINC000414839701 565963453 /nfs/dbraw/zinc/96/34/53/565963453.db2.gz MKCOUFGMGWGZSK-VIFPVBQESA-N 2 1 380.124 3.165 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414849629 565964126 /nfs/dbraw/zinc/96/41/26/565964126.db2.gz HKIIDALVTLUUAY-ZFWWWQNUSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414849626 565964232 /nfs/dbraw/zinc/96/42/32/565964232.db2.gz HKIIDALVTLUUAY-DZGCQCFKSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000414978688 565967256 /nfs/dbraw/zinc/96/72/56/565967256.db2.gz UGHMYASDCIHCJJ-KRWDZBQOSA-N 2 1 377.330 3.421 20 0 GGADMP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+]Cc2ccc(Br)cn2)cc1 ZINC000415006740 565969146 /nfs/dbraw/zinc/96/91/46/565969146.db2.gz QUUFPLUUHBJWKM-KDOFPFPSSA-N 2 1 378.289 3.466 20 0 GGADMP C[C@@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000415037496 565970645 /nfs/dbraw/zinc/97/06/45/565970645.db2.gz LHFIOXSYLLKNBB-IFXJQAMLSA-N 2 1 393.325 3.338 20 0 GGADMP COc1c(Br)cccc1C[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000415102954 565972975 /nfs/dbraw/zinc/97/29/75/565972975.db2.gz FBQBSHFQSFRHMQ-AEFFLSMTSA-N 2 1 383.330 3.176 20 0 GGADMP [NH3+]CCCC(=O)N1CC[NH+](Cc2ccc(-c3ccccc3Cl)s2)CC1 ZINC000237908421 565973555 /nfs/dbraw/zinc/97/35/55/565973555.db2.gz PDNANQFPZSSYFD-UHFFFAOYSA-N 2 1 377.941 3.452 20 0 GGADMP COc1sc(C[NH+]2CCC([C@@H]3C[C@H]([NH3+])CCO3)CC2)cc1Br ZINC000415121256 565974401 /nfs/dbraw/zinc/97/44/01/565974401.db2.gz HWWHOPXSQWCOSA-DOMZBBRYSA-N 2 1 389.359 3.238 20 0 GGADMP COc1ccc(Br)cc1C[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000415119284 565974764 /nfs/dbraw/zinc/97/47/64/565974764.db2.gz FFNRXNCTMWPFNV-AEFFLSMTSA-N 2 1 383.330 3.176 20 0 GGADMP [NH3+][C@H]1CCC[C@H](C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)C1 ZINC000238038784 565979302 /nfs/dbraw/zinc/97/93/02/565979302.db2.gz GLNJOCLLFYULJD-RDJZCZTQSA-N 2 1 394.357 3.047 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](Cc2cncc(Br)c2)CC1 ZINC000179680163 565999683 /nfs/dbraw/zinc/99/96/83/565999683.db2.gz VERGDYSKQSMAFO-UHFFFAOYSA-N 2 1 384.362 3.415 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cncc(Br)c2)CC1 ZINC000179680163 565999686 /nfs/dbraw/zinc/99/96/86/565999686.db2.gz VERGDYSKQSMAFO-UHFFFAOYSA-N 2 1 384.362 3.415 20 0 GGADMP Cn1ccnc1C[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc(Br)c2)C1 ZINC000245878140 566009196 /nfs/dbraw/zinc/00/91/96/566009196.db2.gz MWVXCNGHKZZYRB-WMLDXEAASA-N 2 1 378.314 3.171 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)N(C)C[C@H]2CCC[N@@H+](C)C2)c(Br)c1 ZINC000246214098 566021300 /nfs/dbraw/zinc/02/13/00/566021300.db2.gz YJSAWYBLXFSVOS-GJZGRUSLSA-N 2 1 382.346 3.358 20 0 GGADMP C[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2c(cc1Br)OCCO2 ZINC000246983702 566049187 /nfs/dbraw/zinc/04/91/87/566049187.db2.gz TVKRBFSSFUXALQ-IHRRRGAJSA-N 2 1 381.314 3.498 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000247494307 566061182 /nfs/dbraw/zinc/06/11/82/566061182.db2.gz LEGTUEHPKHRJGQ-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000247494307 566061188 /nfs/dbraw/zinc/06/11/88/566061188.db2.gz LEGTUEHPKHRJGQ-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3cccc(Br)c3)CC[C@H]21 ZINC000247979737 566069679 /nfs/dbraw/zinc/06/96/79/566069679.db2.gz MESOBNYSSFOSNI-RHSMWYFYSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CCC(=O)Nc3cccc(Br)c3)CC[C@H]21 ZINC000247979737 566069685 /nfs/dbraw/zinc/06/96/85/566069685.db2.gz MESOBNYSSFOSNI-RHSMWYFYSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCC(=O)Nc3cccc(Br)c3)CC[C@H]21 ZINC000247979737 566069689 /nfs/dbraw/zinc/06/96/89/566069689.db2.gz MESOBNYSSFOSNI-RHSMWYFYSA-N 2 1 380.330 3.194 20 0 GGADMP C[C@H](c1ccccc1Br)[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000261624925 566126614 /nfs/dbraw/zinc/12/66/14/566126614.db2.gz GORUTNLJDAVFMX-VKJFTORMSA-N 2 1 394.357 3.090 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181277747 566129543 /nfs/dbraw/zinc/12/95/43/566129543.db2.gz OLYXVLXULHLQJW-LALPHHSUSA-N 2 1 378.318 3.053 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181277747 566129545 /nfs/dbraw/zinc/12/95/45/566129545.db2.gz OLYXVLXULHLQJW-LALPHHSUSA-N 2 1 378.318 3.053 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181277727 566130018 /nfs/dbraw/zinc/13/00/18/566130018.db2.gz OLYXVLXULHLQJW-XUJVJEKNSA-N 2 1 378.318 3.053 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181277727 566130023 /nfs/dbraw/zinc/13/00/23/566130023.db2.gz OLYXVLXULHLQJW-XUJVJEKNSA-N 2 1 378.318 3.053 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181277707 566130105 /nfs/dbraw/zinc/13/01/05/566130105.db2.gz OLYXVLXULHLQJW-JMSVASOKSA-N 2 1 378.318 3.053 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181277707 566130111 /nfs/dbraw/zinc/13/01/11/566130111.db2.gz OLYXVLXULHLQJW-JMSVASOKSA-N 2 1 378.318 3.053 20 0 GGADMP C[C@H](CNC(=O)[C@@](C)([NH3+])c1ccc(Br)cc1)[N@H+]1CCCC[C@H]1C ZINC000261721081 566130803 /nfs/dbraw/zinc/13/08/03/566130803.db2.gz KDRDZEHMIVZIAZ-LBTNJELSSA-N 2 1 382.346 3.002 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000181459460 566142300 /nfs/dbraw/zinc/14/23/00/566142300.db2.gz IPTWOHIVEQJJFV-VKJFTORMSA-N 2 1 396.373 3.104 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000181459460 566142302 /nfs/dbraw/zinc/14/23/02/566142302.db2.gz IPTWOHIVEQJJFV-VKJFTORMSA-N 2 1 396.373 3.104 20 0 GGADMP C[NH2+]CCC1CC[NH+](Cc2nc(Cc3cccc(Br)c3)no2)CC1 ZINC000262009524 566143921 /nfs/dbraw/zinc/14/39/21/566143921.db2.gz SUVBDLKQSOAVRK-UHFFFAOYSA-N 2 1 393.329 3.244 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000366262007 566144457 /nfs/dbraw/zinc/14/44/57/566144457.db2.gz XCOGLMAVDNBIRR-XYPHTWIQSA-N 2 1 380.330 3.383 20 0 GGADMP C[NH2+]CCC1CC[NH+](Cc2nc(-c3cc(Br)cs3)no2)CC1 ZINC000262004457 566144807 /nfs/dbraw/zinc/14/48/07/566144807.db2.gz QYBKRYRDIOTIKI-UHFFFAOYSA-N 2 1 385.331 3.382 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000262130269 566147286 /nfs/dbraw/zinc/14/72/86/566147286.db2.gz YASHZNHNEOMMMM-SFHVURJKSA-N 2 1 375.314 3.129 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000262130269 566147288 /nfs/dbraw/zinc/14/72/88/566147288.db2.gz YASHZNHNEOMMMM-SFHVURJKSA-N 2 1 375.314 3.129 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)N[C@H]1CC[N@H+](C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000262127272 566147322 /nfs/dbraw/zinc/14/73/22/566147322.db2.gz LTGGEXUYBCZDTF-ULQDDVLXSA-N 2 1 387.952 3.200 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000262130267 566147390 /nfs/dbraw/zinc/14/73/90/566147390.db2.gz YASHZNHNEOMMMM-GOSISDBHSA-N 2 1 375.314 3.129 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000262130267 566147395 /nfs/dbraw/zinc/14/73/95/566147395.db2.gz YASHZNHNEOMMMM-GOSISDBHSA-N 2 1 375.314 3.129 20 0 GGADMP [NH3+]C1(CNC(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CCC1 ZINC000417569247 566159782 /nfs/dbraw/zinc/15/97/82/566159782.db2.gz LLAGLIPUKHXGPN-UHFFFAOYSA-N 2 1 385.339 3.138 20 0 GGADMP C[N@@H+](Cc1ccc(F)cc1I)CC1CC[NH+](C)CC1 ZINC000417770950 566174818 /nfs/dbraw/zinc/17/48/18/566174818.db2.gz UVPIGNFLGJXFEV-UHFFFAOYSA-N 2 1 376.257 3.204 20 0 GGADMP C[N@H+](Cc1ccc(F)cc1I)CC1CC[NH+](C)CC1 ZINC000417770950 566174824 /nfs/dbraw/zinc/17/48/24/566174824.db2.gz UVPIGNFLGJXFEV-UHFFFAOYSA-N 2 1 376.257 3.204 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(F)cc1I ZINC000417857260 566178777 /nfs/dbraw/zinc/17/87/77/566178777.db2.gz NTXRSUFBZFYGTL-NSHDSACASA-N 2 1 387.240 3.361 20 0 GGADMP C[NH2+]C[C@H](C)CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000417999717 566187577 /nfs/dbraw/zinc/18/75/77/566187577.db2.gz VHLKKOOEPMUSOF-ZDUSSCGKSA-N 2 1 387.355 3.113 20 0 GGADMP CCC[NH2+]CCNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000418000309 566187631 /nfs/dbraw/zinc/18/76/31/566187631.db2.gz VSBIGAOUCDZCTL-UHFFFAOYSA-N 2 1 387.355 3.257 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(Br)nc1 ZINC000290762147 566187773 /nfs/dbraw/zinc/18/77/73/566187773.db2.gz ROZFWTCLABNCDI-RRQGHBQHSA-N 2 1 382.346 3.263 20 0 GGADMP CCC[N@@H+](C)[C@@H](CNC(=O)N[C@@H](CC[NH3+])C(F)F)c1ccc(Cl)cc1 ZINC000418186118 566202810 /nfs/dbraw/zinc/20/28/10/566202810.db2.gz RNYMVCJLOFQEMX-GJZGRUSLSA-N 2 1 376.879 3.005 20 0 GGADMP C[N@@H+](Cc1cnc(-c2cccs2)s1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000368050817 566229023 /nfs/dbraw/zinc/22/90/23/566229023.db2.gz IDXUMOOLWGITBK-INIZCTEOSA-N 2 1 376.595 3.472 20 0 GGADMP CC[C@@H]([NH2+]CCC[NH+](CC)CC)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481907449 566262934 /nfs/dbraw/zinc/26/29/34/566262934.db2.gz AQGHPAJDYYOAHU-MRXNPFEDSA-N 2 1 375.966 3.021 20 0 GGADMP CC[C@H]([NH2+]CCC[NH+](CC)CC)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481907448 566263069 /nfs/dbraw/zinc/26/30/69/566263069.db2.gz AQGHPAJDYYOAHU-INIZCTEOSA-N 2 1 375.966 3.021 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCc3cccc(Br)c3C2)CC1 ZINC000575234213 566263576 /nfs/dbraw/zinc/26/35/76/566263576.db2.gz GEPXKFPTMWNJDR-GOSISDBHSA-N 2 1 394.401 3.314 20 0 GGADMP CC[C@H]([NH2+]C[C@@H](C)C[NH+]1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481914938 566263597 /nfs/dbraw/zinc/26/35/97/566263597.db2.gz CAIIGUVZBZNFOO-PBHICJAKSA-N 2 1 387.977 3.021 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H]2CCc3cccc(Br)c3C2)CC1 ZINC000575234214 566263826 /nfs/dbraw/zinc/26/38/26/566263826.db2.gz GEPXKFPTMWNJDR-SFHVURJKSA-N 2 1 394.401 3.314 20 0 GGADMP CC[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@@H](n2cc(C[NH3+])nn2)C1 ZINC000420387713 566275357 /nfs/dbraw/zinc/27/53/57/566275357.db2.gz WFUVLPSVSPPDHJ-IAGOWNOFSA-N 2 1 378.318 3.288 20 0 GGADMP CC[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@H](n2cc(C[NH3+])nn2)C1 ZINC000420387709 566275797 /nfs/dbraw/zinc/27/57/97/566275797.db2.gz WFUVLPSVSPPDHJ-DLBZAZTESA-N 2 1 378.318 3.288 20 0 GGADMP C[N@@H+](Cc1ncc(Br)cc1Br)CC1CC[NH+](C)CC1 ZINC000482012987 566276330 /nfs/dbraw/zinc/27/63/30/566276330.db2.gz DVCZYUPTZPLDDI-UHFFFAOYSA-N 2 1 391.151 3.380 20 0 GGADMP C[N@H+](Cc1ncc(Br)cc1Br)CC1CC[NH+](C)CC1 ZINC000482012987 566276335 /nfs/dbraw/zinc/27/63/35/566276335.db2.gz DVCZYUPTZPLDDI-UHFFFAOYSA-N 2 1 391.151 3.380 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(Br)cc2)CCOCC1 ZINC000482026049 566277037 /nfs/dbraw/zinc/27/70/37/566277037.db2.gz MGOPTMUJPIBWHX-CRAIPNDOSA-N 2 1 381.358 3.427 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc(Br)cn1 ZINC000482155229 566287049 /nfs/dbraw/zinc/28/70/49/566287049.db2.gz HRTMECVOPTUKIT-HOCLYGCPSA-N 2 1 397.361 3.273 20 0 GGADMP Cc1ccc(C[NH+]2CCC(C[NH+]3CCN(C)CC3)CC2)cc1Br ZINC000575837498 566290643 /nfs/dbraw/zinc/29/06/43/566290643.db2.gz BYFIGKMBAZZNBF-UHFFFAOYSA-N 2 1 380.374 3.217 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@@H]3CCc4cc(Br)ccc4NC3=O)CC[C@H]21 ZINC000625221494 566291389 /nfs/dbraw/zinc/29/13/89/566291389.db2.gz AYIXLZJVFAAOGN-ZTFGCOKTSA-N 2 1 392.341 3.119 20 0 GGADMP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCC[NH2+]CCCc1c(Cl)cccc1Cl ZINC000482234036 566293641 /nfs/dbraw/zinc/29/36/41/566293641.db2.gz KEAHRVBEUGIBAE-GOSISDBHSA-N 2 1 386.367 3.458 20 0 GGADMP CN(C)C(=O)[C@H]1CCC[N@H+]1CCC[NH2+]CCCc1c(Cl)cccc1Cl ZINC000482234036 566293642 /nfs/dbraw/zinc/29/36/42/566293642.db2.gz KEAHRVBEUGIBAE-GOSISDBHSA-N 2 1 386.367 3.458 20 0 GGADMP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+]CCCc1c(Cl)cccc1Cl ZINC000482234037 566294632 /nfs/dbraw/zinc/29/46/32/566294632.db2.gz KEAHRVBEUGIBAE-SFHVURJKSA-N 2 1 386.367 3.458 20 0 GGADMP CN(C)C(=O)[C@@H]1CCC[N@H+]1CCC[NH2+]CCCc1c(Cl)cccc1Cl ZINC000482234037 566294637 /nfs/dbraw/zinc/29/46/37/566294637.db2.gz KEAHRVBEUGIBAE-SFHVURJKSA-N 2 1 386.367 3.458 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CCc3ccc(Br)cc3C2)CC1 ZINC000556544058 566310184 /nfs/dbraw/zinc/31/01/84/566310184.db2.gz JUHASCSZTDCLHZ-UHFFFAOYSA-N 2 1 380.374 3.223 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCc3ccc(Br)cc3C2)CC1 ZINC000556544058 566310187 /nfs/dbraw/zinc/31/01/87/566310187.db2.gz JUHASCSZTDCLHZ-UHFFFAOYSA-N 2 1 380.374 3.223 20 0 GGADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1 ZINC000482539751 566315792 /nfs/dbraw/zinc/31/57/92/566315792.db2.gz SLBSYBXPBFOSSE-RDJZCZTQSA-N 2 1 383.989 3.388 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2cccc(I)c2)C1 ZINC000556601619 566316599 /nfs/dbraw/zinc/31/65/99/566316599.db2.gz QTDWKBDNIRYVPR-INIZCTEOSA-N 2 1 384.305 3.455 20 0 GGADMP CN(CCC[N@@H+](C)Cc1cc(Br)cc2cccnc21)CC[NH+](C)C ZINC000576261386 566329996 /nfs/dbraw/zinc/32/99/96/566329996.db2.gz NBRVTDWWQCFYQY-UHFFFAOYSA-N 2 1 393.373 3.313 20 0 GGADMP CN(C)C(=O)CC[NH+]1CCC([NH2+][C@@H]2CCSc3c(Cl)cccc32)CC1 ZINC000482888620 566340928 /nfs/dbraw/zinc/34/09/28/566340928.db2.gz SNFVJHLQABIIAR-QGZVFWFLSA-N 2 1 381.973 3.409 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000576498971 566351251 /nfs/dbraw/zinc/35/12/51/566351251.db2.gz VBBHLYSVYKPBKU-KBRIMQKVSA-N 2 1 380.330 3.383 20 0 GGADMP Brc1cc(C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc2c1OCCCO2 ZINC000576943721 566392773 /nfs/dbraw/zinc/39/27/73/566392773.db2.gz IBIQQJWHQLOWMH-HOTGVXAUSA-N 2 1 395.341 3.432 20 0 GGADMP Brc1cc(C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc2c1OCCCO2 ZINC000576943719 566393412 /nfs/dbraw/zinc/39/34/12/566393412.db2.gz IBIQQJWHQLOWMH-CVEARBPZSA-N 2 1 395.341 3.432 20 0 GGADMP Brc1cc(C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc2c1OCCCO2 ZINC000576943723 566393499 /nfs/dbraw/zinc/39/34/99/566393499.db2.gz IBIQQJWHQLOWMH-HZPDHXFCSA-N 2 1 395.341 3.432 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(Br)cc1OCCCO ZINC000463362243 566403416 /nfs/dbraw/zinc/40/34/16/566403416.db2.gz SXWMORJHLUSIHT-CQSZACIVSA-N 2 1 396.329 3.456 20 0 GGADMP CN(C(=O)CSc1ccccc1Cl)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000601477940 566408578 /nfs/dbraw/zinc/40/85/78/566408578.db2.gz NEERAQKKIKKYQX-MRXNPFEDSA-N 2 1 381.973 3.059 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC[N@@H+]1C ZINC000536890244 566409050 /nfs/dbraw/zinc/40/90/50/566409050.db2.gz PUCMZKAAJINMGL-YJBOKZPZSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC[N@H+]1C ZINC000536890244 566409051 /nfs/dbraw/zinc/40/90/51/566409051.db2.gz PUCMZKAAJINMGL-YJBOKZPZSA-N 2 1 380.374 3.486 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1cccc(Br)c1C ZINC000463619507 566422409 /nfs/dbraw/zinc/42/24/09/566422409.db2.gz RGOUCYMKKRYTEA-MRXNPFEDSA-N 2 1 396.373 3.246 20 0 GGADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)[C@@H](C)C1 ZINC000557827111 566424284 /nfs/dbraw/zinc/42/42/84/566424284.db2.gz JCQILMZKKWLSBT-KBXCAEBGSA-N 2 1 377.330 3.455 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)[C@@H](C)C1 ZINC000557827111 566424290 /nfs/dbraw/zinc/42/42/90/566424290.db2.gz JCQILMZKKWLSBT-KBXCAEBGSA-N 2 1 377.330 3.455 20 0 GGADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)[C@H](C)C1 ZINC000557827121 566425092 /nfs/dbraw/zinc/42/50/92/566425092.db2.gz JCQILMZKKWLSBT-KDOFPFPSSA-N 2 1 377.330 3.455 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)[C@H](C)C1 ZINC000557827121 566425098 /nfs/dbraw/zinc/42/50/98/566425098.db2.gz JCQILMZKKWLSBT-KDOFPFPSSA-N 2 1 377.330 3.455 20 0 GGADMP COC(=O)CC[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1cccc(Br)c1 ZINC000484312428 566425108 /nfs/dbraw/zinc/42/51/08/566425108.db2.gz QHTLHRCSSVATJO-KRWDZBQOSA-N 2 1 383.330 3.299 20 0 GGADMP COC(=O)CC[N@@H+](CC[C@@H]1CCC[NH+]1C)Cc1cccc(Br)c1 ZINC000484312428 566425117 /nfs/dbraw/zinc/42/51/17/566425117.db2.gz QHTLHRCSSVATJO-KRWDZBQOSA-N 2 1 383.330 3.299 20 0 GGADMP COC(=O)CC[NH+](CC[C@@H]1CCC[N@@H+]1C)Cc1cccc(Br)c1 ZINC000484312428 566425123 /nfs/dbraw/zinc/42/51/23/566425123.db2.gz QHTLHRCSSVATJO-KRWDZBQOSA-N 2 1 383.330 3.299 20 0 GGADMP COC(=O)CC[NH+](CC[C@@H]1CCC[N@H+]1C)Cc1cccc(Br)c1 ZINC000484312428 566425132 /nfs/dbraw/zinc/42/51/32/566425132.db2.gz QHTLHRCSSVATJO-KRWDZBQOSA-N 2 1 383.330 3.299 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C1CCN(Cc2ccc(Br)cc2)CC1 ZINC000484389752 566428074 /nfs/dbraw/zinc/42/80/74/566428074.db2.gz QHFXONSQBXXRBG-DNVCBOLYSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]C1CCN(Cc2ccc(Br)cc2)CC1 ZINC000484389752 566428081 /nfs/dbraw/zinc/42/80/81/566428081.db2.gz QHFXONSQBXXRBG-DNVCBOLYSA-N 2 1 380.374 3.343 20 0 GGADMP Fc1cc(Br)ccc1CCC[NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1 ZINC000484778321 566453264 /nfs/dbraw/zinc/45/32/64/566453264.db2.gz SPEPBORSYFPBGH-KBAYOESNSA-N 2 1 385.321 3.268 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](Cc2cc(O)ccc2Br)CC1 ZINC000537661910 566460599 /nfs/dbraw/zinc/46/05/99/566460599.db2.gz XLIQVAYHLLESIW-UHFFFAOYSA-N 2 1 385.346 3.478 20 0 GGADMP COc1cc(Br)c(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1OC ZINC000422939520 566466648 /nfs/dbraw/zinc/46/66/48/566466648.db2.gz FZQCAHPCPBXIJW-CWRNSKLLSA-N 2 1 383.330 3.477 20 0 GGADMP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000422989143 566469268 /nfs/dbraw/zinc/46/92/68/566469268.db2.gz KMESZRBPHFHEBF-IAGOWNOFSA-N 2 1 382.346 3.035 20 0 GGADMP COc1sc(C[N@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)cc1Br ZINC000650708054 566471606 /nfs/dbraw/zinc/47/16/06/566471606.db2.gz SQIKEQYGMKDVHV-YWPYICTPSA-N 2 1 389.359 3.238 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](Cc3cc(Br)cc4c3OCC4)C2)C1 ZINC000650708109 566471647 /nfs/dbraw/zinc/47/16/47/566471647.db2.gz TUGJNAXJLJXDLK-ZTFGCOKTSA-N 2 1 395.341 3.102 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](Cc3cc(Br)cc4c3OCC4)C2)C1 ZINC000650708107 566471804 /nfs/dbraw/zinc/47/18/04/566471804.db2.gz TUGJNAXJLJXDLK-OLMNPRSZSA-N 2 1 395.341 3.102 20 0 GGADMP Cc1cc(N2CCC[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)C2=O)ccc1Br ZINC000423046964 566471830 /nfs/dbraw/zinc/47/18/30/566471830.db2.gz GJUZLYBYWKSASW-JCHQDKQGSA-N 2 1 392.341 3.126 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](Cc3cc(Br)cc4c3OCC4)C2)C1 ZINC000650708106 566472037 /nfs/dbraw/zinc/47/20/37/566472037.db2.gz TUGJNAXJLJXDLK-BMGDILEWSA-N 2 1 395.341 3.102 20 0 GGADMP COc1cc(I)c(Cl)cc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423094118 566475525 /nfs/dbraw/zinc/47/55/25/566475525.db2.gz JLDQTFQHYOBSIE-IUCAKERBSA-N 2 1 382.673 3.169 20 0 GGADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Br)cc1OCCCO ZINC000423122756 566477513 /nfs/dbraw/zinc/47/75/13/566477513.db2.gz CTQGWRPOHSVLEJ-SLHHOWHOSA-N 2 1 383.330 3.144 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCOc3ccc(I)cc32)CC[NH2+]1 ZINC000423381314 566486673 /nfs/dbraw/zinc/48/66/73/566486673.db2.gz OJJRERSDHBPVST-ZLDLUXBVSA-N 2 1 386.277 3.235 20 0 GGADMP Cc1c([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)nnn1-c1cccc(Br)c1 ZINC000423364460 566486842 /nfs/dbraw/zinc/48/68/42/566486842.db2.gz ASOURXOOYWSFHO-GLQYFDAESA-N 2 1 378.318 3.259 20 0 GGADMP Cc1cc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@@H](C(N)=O)C2)sc1Br ZINC000512050876 566509158 /nfs/dbraw/zinc/50/91/58/566509158.db2.gz FGTAELLBTWPOTD-CHWSQXEVSA-N 2 1 388.375 3.057 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1CC(=O)N(C)Cc1ccc(Cl)c(Cl)c1)CC[NH2+]CC2 ZINC000424286056 566524472 /nfs/dbraw/zinc/52/44/72/566524472.db2.gz GVWREHYVYLXYCH-CQSZACIVSA-N 2 1 384.351 3.416 20 0 GGADMP COc1ccc(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c(Br)c1OC ZINC000424285593 566524725 /nfs/dbraw/zinc/52/47/25/566524725.db2.gz FZTMJSDCQMFPQY-CYBMUJFWSA-N 2 1 383.330 3.430 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c(OC)c1 ZINC000424379262 566530107 /nfs/dbraw/zinc/53/01/07/566530107.db2.gz OHOQURVYGXPEJZ-CYBMUJFWSA-N 2 1 383.330 3.430 20 0 GGADMP Clc1cc(I)cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000424376359 566531018 /nfs/dbraw/zinc/53/10/18/566531018.db2.gz LLSFPDFUINPERW-PBWFPOADSA-N 2 1 376.669 3.317 20 0 GGADMP O[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2cc(F)cc(Br)c2)CC1 ZINC000449195578 566536212 /nfs/dbraw/zinc/53/62/12/566536212.db2.gz ZMFKKNWYFNUAKG-MSOLQXFVSA-N 2 1 385.321 3.446 20 0 GGADMP O[C@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(F)cc(Br)c2)C1 ZINC000449233889 566538514 /nfs/dbraw/zinc/53/85/14/566538514.db2.gz NVAOJQLHWXTSJH-IBGZPJMESA-N 2 1 393.300 3.445 20 0 GGADMP O[C@@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc(Br)c2F)C1 ZINC000449233240 566538923 /nfs/dbraw/zinc/53/89/23/566538923.db2.gz KRUXUQYKVGTVMU-QGZVFWFLSA-N 2 1 393.300 3.445 20 0 GGADMP O[C@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc(Br)c2F)C1 ZINC000449233239 566539642 /nfs/dbraw/zinc/53/96/42/566539642.db2.gz KRUXUQYKVGTVMU-KRWDZBQOSA-N 2 1 393.300 3.445 20 0 GGADMP C[N@H+]1CCC[C@]2(CC[NH+](CCC(=O)Nc3cccc(Br)c3)C2)C1 ZINC000559311893 566540488 /nfs/dbraw/zinc/54/04/88/566540488.db2.gz PGKACPRCDLLXFJ-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CCC[C@]2(CC[N@H+](CCC(=O)Nc3cccc(Br)c3)C2)C1 ZINC000559311893 566540498 /nfs/dbraw/zinc/54/04/98/566540498.db2.gz PGKACPRCDLLXFJ-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCC(=O)Nc3cccc(Br)c3)C2)C1 ZINC000559311893 566540505 /nfs/dbraw/zinc/54/05/05/566540505.db2.gz PGKACPRCDLLXFJ-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCC(=O)Nc3ccc(Br)cc3)C2)C1 ZINC000559311305 566540956 /nfs/dbraw/zinc/54/09/56/566540956.db2.gz KMKOFOQJISXLMD-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCC(=O)Nc3ccc(Br)cc3)C2)C1 ZINC000559311305 566540964 /nfs/dbraw/zinc/54/09/64/566540964.db2.gz KMKOFOQJISXLMD-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCC(=O)Nc3ccc(Br)cc3)C2)C1 ZINC000559311305 566540968 /nfs/dbraw/zinc/54/09/68/566540968.db2.gz KMKOFOQJISXLMD-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCn3cc(Br)ccc3=O)CC2)C1 ZINC000449380549 566555953 /nfs/dbraw/zinc/55/59/53/566555953.db2.gz WILPNFWJFIDXTA-QAPCUYQASA-N 2 1 396.373 3.244 20 0 GGADMP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCn3cc(Br)ccc3=O)CC2)C1 ZINC000449380551 566556754 /nfs/dbraw/zinc/55/67/54/566556754.db2.gz WILPNFWJFIDXTA-YJBOKZPZSA-N 2 1 396.373 3.244 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046748 566573728 /nfs/dbraw/zinc/57/37/28/566573728.db2.gz BJNSIWMOIXSRCR-LSDHHAIUSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046748 566573734 /nfs/dbraw/zinc/57/37/34/566573734.db2.gz BJNSIWMOIXSRCR-LSDHHAIUSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046748 566573738 /nfs/dbraw/zinc/57/37/38/566573738.db2.gz BJNSIWMOIXSRCR-LSDHHAIUSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046748 566573743 /nfs/dbraw/zinc/57/37/43/566573743.db2.gz BJNSIWMOIXSRCR-LSDHHAIUSA-N 2 1 375.340 3.397 20 0 GGADMP Cc1ccc(C[C@@H](CO)C[NH2+]Cc2c[nH+]ccc2N(C)C)cc1Br ZINC000449596499 566579123 /nfs/dbraw/zinc/57/91/23/566579123.db2.gz BNVACFOKGGMOMH-MRXNPFEDSA-N 2 1 392.341 3.159 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000449684990 566592514 /nfs/dbraw/zinc/59/25/14/566592514.db2.gz QSAIBONAXIDRFN-RYQLBKOJSA-N 2 1 381.358 3.125 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3cn4cc(Cl)cc(Cl)c4n3)C2)C1 ZINC000652348382 566602858 /nfs/dbraw/zinc/60/28/58/566602858.db2.gz BOBUJLOOVHQVHF-DXCKQFNASA-N 2 1 383.323 3.359 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](Cc3cn4cc(Cl)cc(Cl)c4n3)C2)C1 ZINC000652348382 566602862 /nfs/dbraw/zinc/60/28/62/566602862.db2.gz BOBUJLOOVHQVHF-DXCKQFNASA-N 2 1 383.323 3.359 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](CC(=O)Nc3cc(Cl)ccc3Cl)C2)C1 ZINC000652346158 566603213 /nfs/dbraw/zinc/60/32/13/566603213.db2.gz UYOJLRQIGSEZRG-QEORTHHSSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](CC(=O)Nc3cc(Cl)ccc3Cl)C2)C1 ZINC000652346158 566603220 /nfs/dbraw/zinc/60/32/20/566603220.db2.gz UYOJLRQIGSEZRG-QEORTHHSSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2CC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000652360308 566605259 /nfs/dbraw/zinc/60/52/59/566605259.db2.gz FEXMIKJQYFVULH-CSMYWGQOSA-N 2 1 386.323 3.293 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@H+]2CC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000652360308 566605268 /nfs/dbraw/zinc/60/52/68/566605268.db2.gz FEXMIKJQYFVULH-CSMYWGQOSA-N 2 1 386.323 3.293 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)[C@H]1CC[NH3+] ZINC000652353995 566605707 /nfs/dbraw/zinc/60/57/07/566605707.db2.gz KARKIISMXPDGRG-WBMJQRKESA-N 2 1 386.309 3.366 20 0 GGADMP CN(C)c1ncc(C[N@H+]2CCC[C@H](Nc3cccc(Br)c3)C2)n1C ZINC000425333678 566631312 /nfs/dbraw/zinc/63/13/12/566631312.db2.gz FJEBDPJRRHIVSU-INIZCTEOSA-N 2 1 392.345 3.325 20 0 GGADMP CN(C)c1ncc(CN2CCC[C@H](Nc3cccc(Br)c3)C2)n1C ZINC000425333678 566631321 /nfs/dbraw/zinc/63/13/21/566631321.db2.gz FJEBDPJRRHIVSU-INIZCTEOSA-N 2 1 392.345 3.325 20 0 GGADMP COc1c(Br)cc(C[NH2+]C[C@@H]([NH3+])C(C)C)cc1Br ZINC000560961407 566666913 /nfs/dbraw/zinc/66/69/13/566666913.db2.gz NBCMZCPGKVNYEI-GFCCVEGCSA-N 2 1 380.124 3.293 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)N[C@H]1CCC[NH2+]C1 ZINC000579812666 566642015 /nfs/dbraw/zinc/64/20/15/566642015.db2.gz UYFTUORVNCVVKN-HNNXBMFYSA-N 2 1 385.339 3.009 20 0 GGADMP C[NH+]1CCN(C(=O)CC[NH+]2CCC(Sc3ccc(Cl)cc3)CC2)CC1 ZINC000514115919 566643012 /nfs/dbraw/zinc/64/30/12/566643012.db2.gz WMWABEXIYXBFJL-UHFFFAOYSA-N 2 1 381.973 3.061 20 0 GGADMP C[C@H]1C[N@H+](C)C[C@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487013162 566643634 /nfs/dbraw/zinc/64/36/34/566643634.db2.gz LGBYQCHWTJQERE-SCLBCKFNSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@H]1C[N@@H+](C)C[C@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487013162 566643638 /nfs/dbraw/zinc/64/36/38/566643638.db2.gz LGBYQCHWTJQERE-SCLBCKFNSA-N 2 1 384.351 3.272 20 0 GGADMP C[NH+]1CCN(CC[N@H+](Cc2ccc(Br)cc2F)CC2CC2)CC1 ZINC000580006058 566657247 /nfs/dbraw/zinc/65/72/47/566657247.db2.gz JVXDKMQQKKCJMW-UHFFFAOYSA-N 2 1 384.337 3.048 20 0 GGADMP CC[C@]1(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)CCC[NH2+]1 ZINC000467698437 566659706 /nfs/dbraw/zinc/65/97/06/566659706.db2.gz XNFKYQPTGJEZJV-LJQANCHMSA-N 2 1 394.357 3.062 20 0 GGADMP CC[C@@]1(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)CCC[NH2+]1 ZINC000467698436 566659746 /nfs/dbraw/zinc/65/97/46/566659746.db2.gz XNFKYQPTGJEZJV-IBGZPJMESA-N 2 1 394.357 3.062 20 0 GGADMP O=C1Nc2ccc(Br)cc2CC[C@@H]1[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000629533133 566664750 /nfs/dbraw/zinc/66/47/50/566664750.db2.gz ITYGZQYMNVTZNB-VKJFTORMSA-N 2 1 392.341 3.024 20 0 GGADMP O=C1Nc2ccc(Br)cc2CC[C@@H]1[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000629533132 566664852 /nfs/dbraw/zinc/66/48/52/566664852.db2.gz ITYGZQYMNVTZNB-RKVPGOIHSA-N 2 1 392.341 3.024 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](CCOc2cc(F)cc(Br)c2)CC[C@H]1C(F)(F)F ZINC000629560484 566666204 /nfs/dbraw/zinc/66/62/04/566666204.db2.gz DLJMFUNTSGAEID-IINYFYTJSA-N 2 1 399.226 3.426 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCOc2cc(F)cc(Br)c2)CC[C@H]1C(F)(F)F ZINC000629560484 566666208 /nfs/dbraw/zinc/66/62/08/566666208.db2.gz DLJMFUNTSGAEID-IINYFYTJSA-N 2 1 399.226 3.426 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(Cl)c1Cl)[N@@H+](C)CCCN(C)CC[NH+](C)C ZINC000580121543 566666771 /nfs/dbraw/zinc/66/67/71/566666771.db2.gz QWWZFHYOKHCJQT-AWEZNQCLSA-N 2 1 389.371 3.136 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](CCC(=O)Nc2ccc(Cl)cc2F)CC[C@H]1C(F)(F)F ZINC000629569614 566667651 /nfs/dbraw/zinc/66/76/51/566667651.db2.gz YEJVOVINCWLIDS-CMPLNLGQSA-N 2 1 381.801 3.267 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCC(=O)Nc2ccc(Cl)cc2F)CC[C@H]1C(F)(F)F ZINC000629569614 566667657 /nfs/dbraw/zinc/66/76/57/566667657.db2.gz YEJVOVINCWLIDS-CMPLNLGQSA-N 2 1 381.801 3.267 20 0 GGADMP O[C@@H]1CCCC[C@H]1C[N@@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000580198019 566672846 /nfs/dbraw/zinc/67/28/46/566672846.db2.gz OBMMKGMXPJOJHH-GOEBONIOSA-N 2 1 382.302 3.292 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1O ZINC000580245654 566676437 /nfs/dbraw/zinc/67/64/37/566676437.db2.gz YJQCLFBSDCZLQI-CQSZACIVSA-N 2 1 383.330 3.327 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](C[NH2+]C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000514932704 566679259 /nfs/dbraw/zinc/67/92/59/566679259.db2.gz KNKJBKNUZZYGIO-HOCLYGCPSA-N 2 1 375.340 3.301 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)N[C@@H]1CCC[NH2+]C1 ZINC000561174536 566680758 /nfs/dbraw/zinc/68/07/58/566680758.db2.gz UYFTUORVNCVVKN-OAHLLOKOSA-N 2 1 385.339 3.009 20 0 GGADMP CC[NH+]1CCC([NH+]2CCC(C(=O)NCCc3ccc(Cl)s3)CC2)CC1 ZINC000561164422 566681169 /nfs/dbraw/zinc/68/11/69/566681169.db2.gz UTWGUIFCYDHYLG-UHFFFAOYSA-N 2 1 383.989 3.257 20 0 GGADMP C[C@H](C[NH2+][C@@H]1CCCOc2ccc(I)cc21)C[NH+](C)C ZINC000425927761 566682273 /nfs/dbraw/zinc/68/22/73/566682273.db2.gz UMDQULXWYITMFQ-IUODEOHRSA-N 2 1 388.293 3.292 20 0 GGADMP C[C@@H](C[NH2+][C@H]1CCCOc2ccc(I)cc21)C[NH+](C)C ZINC000425927763 566682625 /nfs/dbraw/zinc/68/26/25/566682625.db2.gz UMDQULXWYITMFQ-WFASDCNBSA-N 2 1 388.293 3.292 20 0 GGADMP O=C(NC1CC[NH2+]CC1)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000561186341 566683036 /nfs/dbraw/zinc/68/30/36/566683036.db2.gz RGYXQOXCJFXNHJ-UHFFFAOYSA-N 2 1 385.339 3.009 20 0 GGADMP O=C(C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000515053347 566687190 /nfs/dbraw/zinc/68/71/90/566687190.db2.gz QKARDBQBVVUEHQ-GVDBMIGSSA-N 2 1 380.330 3.288 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](CC(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000561283677 566690297 /nfs/dbraw/zinc/69/02/97/566690297.db2.gz VKXYGGLNZSXKBZ-CXAGYDPISA-N 2 1 386.323 3.150 20 0 GGADMP O[C@@H]1CCC[C@@H]1[NH+]1CCN(c2cc[nH+]c3cc(Br)ccc32)CC1 ZINC000608014034 566691394 /nfs/dbraw/zinc/69/13/94/566691394.db2.gz BSBNKMHFHWJPRR-ZWKOTPCHSA-N 2 1 376.298 3.033 20 0 GGADMP Clc1cccc(-n2cc(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)nn2)c1Cl ZINC000580551151 566704357 /nfs/dbraw/zinc/70/43/57/566704357.db2.gz CBONUTBSFHFYRA-CQSZACIVSA-N 2 1 380.323 3.396 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000608507948 566721992 /nfs/dbraw/zinc/72/19/92/566721992.db2.gz HDXFSWZQYLDZAQ-LSDHHAIUSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000608507948 566721997 /nfs/dbraw/zinc/72/19/97/566721997.db2.gz HDXFSWZQYLDZAQ-LSDHHAIUSA-N 2 1 375.340 3.397 20 0 GGADMP Cc1csc(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)c1Br ZINC000515577517 566722497 /nfs/dbraw/zinc/72/24/97/566722497.db2.gz CAOQTPSXJUVGCR-UHFFFAOYSA-N 2 1 395.326 3.218 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cc4c(cc3Br)OCCCO4)C[C@@H]21 ZINC000515649768 566724903 /nfs/dbraw/zinc/72/49/03/566724903.db2.gz PUSHSEROCNLSEC-IVMMDQJWSA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3cc4c(cc3Br)OCCCO4)C[C@@H]21 ZINC000515649768 566724911 /nfs/dbraw/zinc/72/49/11/566724911.db2.gz PUSHSEROCNLSEC-IVMMDQJWSA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cc4c(cc3Br)OCCCO4)C[C@H]21 ZINC000515649911 566725256 /nfs/dbraw/zinc/72/52/56/566725256.db2.gz PUSHSEROCNLSEC-XNRPHZJLSA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3cc4c(cc3Br)OCCCO4)C[C@H]21 ZINC000515649911 566725260 /nfs/dbraw/zinc/72/52/60/566725260.db2.gz PUSHSEROCNLSEC-XNRPHZJLSA-N 2 1 381.314 3.170 20 0 GGADMP CC[C@H]1[NH2+]CC[C@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000581130572 566752782 /nfs/dbraw/zinc/75/27/82/566752782.db2.gz RHNWQEVPQBBXRX-QZTJIDSGSA-N 2 1 384.351 3.462 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cnc2c(C)cc(Br)cn12 ZINC000561981140 566754048 /nfs/dbraw/zinc/75/40/48/566754048.db2.gz YYOLJRPYPQMEJO-UHFFFAOYSA-N 2 1 376.302 3.432 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cnc2c(C)cc(Br)cn12 ZINC000561981140 566754055 /nfs/dbraw/zinc/75/40/55/566754055.db2.gz YYOLJRPYPQMEJO-UHFFFAOYSA-N 2 1 376.302 3.432 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccnc(-c4ccc(Br)cc4)n3)C[C@@H]21 ZINC000581251702 566762729 /nfs/dbraw/zinc/76/27/29/566762729.db2.gz GEADLVIKOWKJMT-FHLIZLRMSA-N 2 1 387.325 3.465 20 0 GGADMP Clc1ccc(-n2cc(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)nn2)c(Cl)c1 ZINC000516468511 566765029 /nfs/dbraw/zinc/76/50/29/566765029.db2.gz XBUYWEMRFYFWKT-CQSZACIVSA-N 2 1 380.323 3.396 20 0 GGADMP CC(C)c1nn(-c2ccc(Br)cc2)cc1C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000678343527 566795371 /nfs/dbraw/zinc/79/53/71/566795371.db2.gz SGJIHXLWPLKYEN-HUUCEWRRSA-N 2 1 389.341 3.409 20 0 GGADMP COc1ccc(Br)cc1C[N@H+](C)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000678719983 566813997 /nfs/dbraw/zinc/81/39/97/566813997.db2.gz TYXBDHKRWZQWCI-SFHVURJKSA-N 2 1 396.373 3.058 20 0 GGADMP COc1ccc(Br)cc1C[N@@H+](C)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000678719983 566814004 /nfs/dbraw/zinc/81/40/04/566814004.db2.gz TYXBDHKRWZQWCI-SFHVURJKSA-N 2 1 396.373 3.058 20 0 GGADMP CCOc1cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc(Br)c1OC ZINC000469871428 566823159 /nfs/dbraw/zinc/82/31/59/566823159.db2.gz GUHGMOSDSQXNRS-LZWOXQAQSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1cc(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc(Br)c1OC ZINC000469871428 566823165 /nfs/dbraw/zinc/82/31/65/566823165.db2.gz GUHGMOSDSQXNRS-LZWOXQAQSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc(Br)c1OC ZINC000469871427 566823777 /nfs/dbraw/zinc/82/37/77/566823777.db2.gz GUHGMOSDSQXNRS-DZKIICNBSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1cc(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc(Br)c1OC ZINC000469871427 566823782 /nfs/dbraw/zinc/82/37/82/566823782.db2.gz GUHGMOSDSQXNRS-DZKIICNBSA-N 2 1 383.330 3.416 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cc(Br)c4c(c3)OCCCO4)C[C@@H]21 ZINC000469873616 566823807 /nfs/dbraw/zinc/82/38/07/566823807.db2.gz NLCKGEKNPLLELR-OFQRWUPVSA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3cc(Br)c4c(c3)OCCCO4)C[C@@H]21 ZINC000469873616 566823814 /nfs/dbraw/zinc/82/38/14/566823814.db2.gz NLCKGEKNPLLELR-OFQRWUPVSA-N 2 1 381.314 3.170 20 0 GGADMP C[N@H+](Cc1cc(Br)c2c(c1)OCCCO2)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000469991150 566835337 /nfs/dbraw/zinc/83/53/37/566835337.db2.gz IJCAZJBTEVPAQZ-YIONKMFJSA-N 2 1 381.314 3.325 20 0 GGADMP C[N@@H+](Cc1cc(Br)c2c(c1)OCCCO2)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000469991150 566835343 /nfs/dbraw/zinc/83/53/43/566835343.db2.gz IJCAZJBTEVPAQZ-YIONKMFJSA-N 2 1 381.314 3.325 20 0 GGADMP Fc1ccc(Br)cc1CC[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000655700937 566835939 /nfs/dbraw/zinc/83/59/39/566835939.db2.gz RDQNGVNJYDGTCN-KRWDZBQOSA-N 2 1 385.321 3.364 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)Oc1ccc(Br)cc1 ZINC000655718712 566838017 /nfs/dbraw/zinc/83/80/17/566838017.db2.gz QFKNVJZCKHZMPL-KXBFYZLASA-N 2 1 397.357 3.449 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)Oc1cccc(Br)c1 ZINC000655719843 566838252 /nfs/dbraw/zinc/83/82/52/566838252.db2.gz YTIWKQUSYBITFB-BEFAXECRSA-N 2 1 397.357 3.449 20 0 GGADMP COc1cc(C[N@H+](C)C2CC[NH2+]CC2)cc(Br)c1OC(F)F ZINC000470015722 566838615 /nfs/dbraw/zinc/83/86/15/566838615.db2.gz CILDYDHSWSEFNR-UHFFFAOYSA-N 2 1 379.245 3.243 20 0 GGADMP COc1cc(C[N@@H+](C)C2CC[NH2+]CC2)cc(Br)c1OC(F)F ZINC000470015722 566838622 /nfs/dbraw/zinc/83/86/22/566838622.db2.gz CILDYDHSWSEFNR-UHFFFAOYSA-N 2 1 379.245 3.243 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)Oc1ccccc1Br ZINC000655718502 566838835 /nfs/dbraw/zinc/83/88/35/566838835.db2.gz KXEGGVIXDWCRBI-HOCLYGCPSA-N 2 1 383.330 3.059 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)Oc1ccccc1Br ZINC000655718500 566839123 /nfs/dbraw/zinc/83/91/23/566839123.db2.gz KXEGGVIXDWCRBI-GDBMZVCRSA-N 2 1 383.330 3.059 20 0 GGADMP Cc1nn(-c2cccc(Br)c2)cc1C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000655733159 566840251 /nfs/dbraw/zinc/84/02/51/566840251.db2.gz JJUCBWAYEHYYRH-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP Cc1nn(-c2cccc(Br)c2)cc1C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000655733159 566840257 /nfs/dbraw/zinc/84/02/57/566840257.db2.gz JJUCBWAYEHYYRH-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP Brc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1 ZINC000562980659 566840802 /nfs/dbraw/zinc/84/08/02/566840802.db2.gz GKAYOEAHOIMTMJ-MRXNPFEDSA-N 2 1 390.329 3.201 20 0 GGADMP Cc1nn(-c2ccccc2Br)cc1C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000655734055 566841530 /nfs/dbraw/zinc/84/15/30/566841530.db2.gz YFHXEFWKFNQQEZ-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP Cc1nn(-c2ccccc2Br)cc1C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000655734055 566841540 /nfs/dbraw/zinc/84/15/40/566841540.db2.gz YFHXEFWKFNQQEZ-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@H](O)COc1cccc(Br)c1 ZINC000562986957 566842109 /nfs/dbraw/zinc/84/21/09/566842109.db2.gz DYFBMXVKLLTGJY-AEFFLSMTSA-N 2 1 399.373 3.433 20 0 GGADMP Cc1cc(Br)ccc1C[N@H+](C)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000679218089 566842514 /nfs/dbraw/zinc/84/25/14/566842514.db2.gz JRVOWLUKUGZMOR-IBGZPJMESA-N 2 1 380.374 3.358 20 0 GGADMP Brc1cccc2[nH]cc(CC[NH2+]C3CC[NH+]([C@H]4CCOC4)CC3)c21 ZINC000655767924 566847652 /nfs/dbraw/zinc/84/76/52/566847652.db2.gz NNTYGZUUQQWBQT-INIZCTEOSA-N 2 1 392.341 3.316 20 0 GGADMP O=C1[C@@H]([NH+]2CCC([C@H]3CC[NH2+]C3)CC2)CCN1c1ccc(Cl)cc1Cl ZINC000563149538 566860705 /nfs/dbraw/zinc/86/07/05/566860705.db2.gz BMKHDYKIKXSEHN-KSSFIOAISA-N 2 1 382.335 3.420 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1Br)[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000582726770 566889387 /nfs/dbraw/zinc/88/93/87/566889387.db2.gz LRFSUVOGBMNCJP-RBSFLKMASA-N 2 1 380.330 3.098 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1Br)[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000582726770 566889393 /nfs/dbraw/zinc/88/93/93/566889393.db2.gz LRFSUVOGBMNCJP-RBSFLKMASA-N 2 1 380.330 3.098 20 0 GGADMP CC[C@@H]1[NH2+]CC[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000518528224 566889675 /nfs/dbraw/zinc/88/96/75/566889675.db2.gz SEPKPBRKJUOILC-YJBOKZPZSA-N 2 1 384.351 3.462 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1Br)[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000582726767 566890045 /nfs/dbraw/zinc/89/00/45/566890045.db2.gz LRFSUVOGBMNCJP-ILXRZTDVSA-N 2 1 380.330 3.098 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1Br)[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000582726767 566890051 /nfs/dbraw/zinc/89/00/51/566890051.db2.gz LRFSUVOGBMNCJP-ILXRZTDVSA-N 2 1 380.330 3.098 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+]2CC[C@@H](Sc3cccc(Cl)c3)C2)CC1 ZINC000429164132 566912724 /nfs/dbraw/zinc/91/27/24/566912724.db2.gz PSHPBIYXJIPSCQ-GOSISDBHSA-N 2 1 381.973 3.107 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+]2CC[C@@H](Sc3cccc(Cl)c3)C2)CC1 ZINC000429164132 566912729 /nfs/dbraw/zinc/91/27/29/566912729.db2.gz PSHPBIYXJIPSCQ-GOSISDBHSA-N 2 1 381.973 3.107 20 0 GGADMP C(C[NH+]1CCC[C@]2(CCSC2)C1)OCC[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451986414 566918414 /nfs/dbraw/zinc/91/84/14/566918414.db2.gz XNUHOLVPIDHEHG-PMACEKPBSA-N 2 1 384.655 3.441 20 0 GGADMP COCC[N@H+](C)CC[C@@H](Nc1cc[nH+]cc1Br)c1ccccc1 ZINC000492178261 566926145 /nfs/dbraw/zinc/92/61/45/566926145.db2.gz KZXGJQPTQPESAV-QGZVFWFLSA-N 2 1 378.314 3.388 20 0 GGADMP COCC[N@@H+](C)CC[C@@H](Nc1cc[nH+]cc1Br)c1ccccc1 ZINC000492178261 566926149 /nfs/dbraw/zinc/92/61/49/566926149.db2.gz KZXGJQPTQPESAV-QGZVFWFLSA-N 2 1 378.314 3.388 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+][C@H]2CCCc3c(Br)cccc32)C1 ZINC000544010926 566928798 /nfs/dbraw/zinc/92/87/98/566928798.db2.gz IPPKNNGTCRVDDA-KDOFPFPSSA-N 2 1 394.357 3.004 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](C[NH2+]C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000564078553 566943866 /nfs/dbraw/zinc/94/38/66/566943866.db2.gz SSKXILIFPSBFAQ-HOCLYGCPSA-N 2 1 375.340 3.301 20 0 GGADMP Brc1ccc2ncc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)n2c1 ZINC000656784089 566950928 /nfs/dbraw/zinc/95/09/28/566950928.db2.gz CMQPDWAVKKBDQM-OAHLLOKOSA-N 2 1 377.330 3.308 20 0 GGADMP COCC[NH+]1CCC([NH2+]CCc2c[nH]c3ccc(Br)cc23)CC1 ZINC000544372469 566958261 /nfs/dbraw/zinc/95/82/61/566958261.db2.gz BUMUQDXORAECCW-UHFFFAOYSA-N 2 1 380.330 3.173 20 0 GGADMP Cc1cc(Br)cc2c1[C@H]([NH2+]C[C@H](O)C[NH+]1CCC(C)CC1)CC2 ZINC000493892333 566958620 /nfs/dbraw/zinc/95/86/20/566958620.db2.gz VBNAFYDGFCDHIG-ZWKOTPCHSA-N 2 1 381.358 3.427 20 0 GGADMP Cc1cc(Br)cc2c1[C@H]([NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1)CC2 ZINC000493892331 566959001 /nfs/dbraw/zinc/95/90/01/566959001.db2.gz VBNAFYDGFCDHIG-QZTJIDSGSA-N 2 1 381.358 3.427 20 0 GGADMP Cc1cc(Br)cc2c1[C@@H]([NH2+]C[C@H](O)C[NH+]1CCC(C)CC1)CC2 ZINC000493892332 566959074 /nfs/dbraw/zinc/95/90/74/566959074.db2.gz VBNAFYDGFCDHIG-ROUUACIJSA-N 2 1 381.358 3.427 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(F)c(Br)c3)CC2)CC1 ZINC000544488664 566966134 /nfs/dbraw/zinc/96/61/34/566966134.db2.gz LEFGQPHETLXEKM-UHFFFAOYSA-N 2 1 398.364 3.438 20 0 GGADMP Brc1csc(-c2noc(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)n2)c1 ZINC000583813035 566986028 /nfs/dbraw/zinc/98/60/28/566986028.db2.gz MBSHQFZKEAAGPX-GFCCVEGCSA-N 2 1 397.342 3.382 20 0 GGADMP C[C@@]1(NC(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC[NH2+]C1 ZINC000612878657 567001735 /nfs/dbraw/zinc/00/17/35/567001735.db2.gz LALAVEILLDAGBN-GOSISDBHSA-N 2 1 385.339 3.009 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2nnc(C3CC[NH2+]CC3)[nH]2)c2cccc(Br)c21 ZINC000564841024 567012495 /nfs/dbraw/zinc/01/24/95/567012495.db2.gz LSVNCCMDPMJKDH-NHYWBVRUSA-N 2 1 390.329 3.372 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)[C@@](C)([NH3+])c1ccc(Br)cc1 ZINC000564892499 567018188 /nfs/dbraw/zinc/01/81/88/567018188.db2.gz YZTSKKVWVJCHLL-KDOFPFPSSA-N 2 1 382.346 3.004 20 0 GGADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469162 567026806 /nfs/dbraw/zinc/02/68/06/567026806.db2.gz HOYJVIDXTINSBH-DOTOQJQBSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469162 567026816 /nfs/dbraw/zinc/02/68/16/567026816.db2.gz HOYJVIDXTINSBH-DOTOQJQBSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469162 567026821 /nfs/dbraw/zinc/02/68/21/567026821.db2.gz HOYJVIDXTINSBH-DOTOQJQBSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000472469162 567026830 /nfs/dbraw/zinc/02/68/30/567026830.db2.gz HOYJVIDXTINSBH-DOTOQJQBSA-N 2 1 387.351 3.397 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Br)cc1)[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000564988730 567028241 /nfs/dbraw/zinc/02/82/41/567028241.db2.gz OSFCSYXZFCNQJL-QLFBSQMISA-N 2 1 380.330 3.098 20 0 GGADMP Fc1cc(Br)cc(OCC[NH+]2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000682085535 567031720 /nfs/dbraw/zinc/03/17/20/567031720.db2.gz WAMBWXNWHAGWKX-UHFFFAOYSA-N 2 1 380.261 3.184 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)[N@@H+](C)CCCN(C)CC[NH+](C)C ZINC000565115667 567039572 /nfs/dbraw/zinc/03/95/72/567039572.db2.gz LHBNROQVSRLFAB-CQSZACIVSA-N 2 1 389.371 3.136 20 0 GGADMP Brc1csc(-c2noc(C[NH+]3CCC4(CC[NH2+]C4)CC3)n2)c1 ZINC000431035968 567048442 /nfs/dbraw/zinc/04/84/42/567048442.db2.gz GZNDJAGZNZKVIO-UHFFFAOYSA-N 2 1 383.315 3.136 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2cc3cc(Br)ccc3o2)CC1 ZINC000657350701 567049829 /nfs/dbraw/zinc/04/98/29/567049829.db2.gz XFMSQAFSBGFMOJ-UHFFFAOYSA-N 2 1 380.330 3.313 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cncc(Br)c2C)[C@@H](C)C1 ZINC000657362344 567052345 /nfs/dbraw/zinc/05/23/45/567052345.db2.gz AJGGCYZRYGGOEO-KSSFIOAISA-N 2 1 384.362 3.379 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cncc(Br)c2C)[C@@H](C)C1 ZINC000657362344 567052351 /nfs/dbraw/zinc/05/23/51/567052351.db2.gz AJGGCYZRYGGOEO-KSSFIOAISA-N 2 1 384.362 3.379 20 0 GGADMP Cc1c(Br)cncc1C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000657398527 567053565 /nfs/dbraw/zinc/05/35/65/567053565.db2.gz CQGJOMRAJUQMCC-MSOLQXFVSA-N 2 1 382.346 3.010 20 0 GGADMP Cc1c(Br)cncc1C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1 ZINC000657398530 567054542 /nfs/dbraw/zinc/05/45/42/567054542.db2.gz CQGJOMRAJUQMCC-ZWKOTPCHSA-N 2 1 382.346 3.010 20 0 GGADMP C[C@@H](C[NH+](C)C)NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000495369300 567058895 /nfs/dbraw/zinc/05/88/95/567058895.db2.gz PWWOBBDTCOEUTC-ZDUSSCGKSA-N 2 1 387.355 3.207 20 0 GGADMP COc1ccc(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c(Br)c1O ZINC000584687563 567061215 /nfs/dbraw/zinc/06/12/15/567061215.db2.gz CZKYRQVXHRNWEH-AWEZNQCLSA-N 2 1 383.330 3.327 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000584721728 567065021 /nfs/dbraw/zinc/06/50/21/567065021.db2.gz WRIBSGILFALEPB-HUUCEWRRSA-N 2 1 380.330 3.018 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000584721728 567065027 /nfs/dbraw/zinc/06/50/27/567065027.db2.gz WRIBSGILFALEPB-HUUCEWRRSA-N 2 1 380.330 3.018 20 0 GGADMP Brc1ccc2c(c1)[C@H]([NH2+]Cc1nnc(C3CC[NH2+]CC3)[nH]1)CCC2 ZINC000565475815 567070431 /nfs/dbraw/zinc/07/04/31/567070431.db2.gz FPTORXYBDZYDBN-MRXNPFEDSA-N 2 1 390.329 3.201 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H](CO)Cc1cc(Br)ccc1F ZINC000453370233 567082050 /nfs/dbraw/zinc/08/20/50/567082050.db2.gz NEIWSEXNFMERCB-ZUMXRPEOSA-N 2 1 387.337 3.058 20 0 GGADMP CC[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000453395340 567085422 /nfs/dbraw/zinc/08/54/22/567085422.db2.gz HUABLIYEIONHCG-QGZVFWFLSA-N 2 1 387.977 3.163 20 0 GGADMP C[C@@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@H+](C)CCCN(C)CC[NH+](C)C ZINC000565680732 567089824 /nfs/dbraw/zinc/08/98/24/567089824.db2.gz GSHQLDUNDZMGID-AWEZNQCLSA-N 2 1 389.371 3.136 20 0 GGADMP C[C@@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@@H+](C)CCCN(C)CC[NH+](C)C ZINC000565680732 567089829 /nfs/dbraw/zinc/08/98/29/567089829.db2.gz GSHQLDUNDZMGID-AWEZNQCLSA-N 2 1 389.371 3.136 20 0 GGADMP Cc1cc(Br)c(C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)s1 ZINC000453561907 567090932 /nfs/dbraw/zinc/09/09/32/567090932.db2.gz ADGDOTANRKFWSO-UHFFFAOYSA-N 2 1 384.343 3.444 20 0 GGADMP C[C@@H]1C[N@H+](CCC[NH2+]CC2=Cc3cc(Br)ccc3OC2)CCCO1 ZINC000432361275 567153471 /nfs/dbraw/zinc/15/34/71/567153471.db2.gz CNICAXBZKHGRKO-OAHLLOKOSA-N 2 1 395.341 3.315 20 0 GGADMP C[C@@H]1C[N@@H+](CCC[NH2+]CC2=Cc3cc(Br)ccc3OC2)CCCO1 ZINC000432361275 567153476 /nfs/dbraw/zinc/15/34/76/567153476.db2.gz CNICAXBZKHGRKO-OAHLLOKOSA-N 2 1 395.341 3.315 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474714735 567193927 /nfs/dbraw/zinc/19/39/27/567193927.db2.gz OPOSZCMJDJIFMX-CWRNSKLLSA-N 2 1 383.989 3.426 20 0 GGADMP C[C@H]1C[N@H+](CCCNc2cc[nH+]c3ccc(Br)cc23)CCCO1 ZINC000432874778 567200048 /nfs/dbraw/zinc/20/00/48/567200048.db2.gz CCSWUTDDLBOVNH-AWEZNQCLSA-N 2 1 378.314 3.332 20 0 GGADMP C[C@H]1C[N@@H+](CCCNc2cc[nH+]c3ccc(Br)cc23)CCCO1 ZINC000432874778 567200052 /nfs/dbraw/zinc/20/00/52/567200052.db2.gz CCSWUTDDLBOVNH-AWEZNQCLSA-N 2 1 378.314 3.332 20 0 GGADMP C[NH2+][C@@H](C(=O)Nc1cnc2c(c1)C[C@@H]([NH3+])CC2)c1cccc(Cl)c1Cl ZINC000659303803 567202323 /nfs/dbraw/zinc/20/23/23/567202323.db2.gz VXKOQGLEQPFBCH-APPDUMDISA-N 2 1 379.291 3.104 20 0 GGADMP CSCc1cnc(C[NH2+]CCCN2CCN(c3ccccc3)CC2)s1 ZINC000590181288 567212100 /nfs/dbraw/zinc/21/21/00/567212100.db2.gz UJLXCVDYFAXKMY-UHFFFAOYSA-N 2 1 376.595 3.308 20 0 GGADMP CN(CC(C)(C)[NH3+])C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000659453228 567216483 /nfs/dbraw/zinc/21/64/83/567216483.db2.gz XIBVMLMZMWGJTP-UHFFFAOYSA-N 2 1 387.355 3.337 20 0 GGADMP Fc1ccc(OCC[NH+]2CCC(Nc3cc[nH+]cc3Br)CC2)cc1 ZINC000547835741 567250756 /nfs/dbraw/zinc/25/07/56/567250756.db2.gz HXJIOOWZGLPXIN-UHFFFAOYSA-N 2 1 394.288 3.360 20 0 GGADMP C[NH2+][C@H](C(=O)N1CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C1)c1cccc(Cl)c1Cl ZINC000638564735 567258683 /nfs/dbraw/zinc/25/86/83/567258683.db2.gz WBHPMOVUKVYCEV-UDZFHETQSA-N 2 1 398.256 3.240 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](C[NH2+]CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000567685052 567266768 /nfs/dbraw/zinc/26/67/68/567266768.db2.gz UUPVCYJZNLBWLG-HNNXBMFYSA-N 2 1 382.346 3.345 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](C[NH2+]CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000567685053 567266911 /nfs/dbraw/zinc/26/69/11/567266911.db2.gz UUPVCYJZNLBWLG-OAHLLOKOSA-N 2 1 382.346 3.345 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000567681647 567267048 /nfs/dbraw/zinc/26/70/48/567267048.db2.gz XWIXNWSGYYWQSJ-GOEBONIOSA-N 2 1 375.340 3.443 20 0 GGADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc4c(c(Br)c3)OCO4)C2)CC1 ZINC000685463104 567277106 /nfs/dbraw/zinc/27/71/06/567277106.db2.gz DUEWHCMAZNSGPH-HNNXBMFYSA-N 2 1 381.314 3.342 20 0 GGADMP C[C@@H]1C[C@H]1C[N@@H+](CCN1CC[NH+](C)CC1)Cc1ccc(Br)cc1F ZINC000685469249 567278110 /nfs/dbraw/zinc/27/81/10/567278110.db2.gz UBQVVNFLLKIONF-WBVHZDCISA-N 2 1 398.364 3.294 20 0 GGADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc4c(c(Br)c3)OCO4)C2)CC1 ZINC000685463105 567278237 /nfs/dbraw/zinc/27/82/37/567278237.db2.gz DUEWHCMAZNSGPH-OAHLLOKOSA-N 2 1 381.314 3.342 20 0 GGADMP C[NH+]1CCN(c2cc[nH+]cc2NC(=O)Nc2ccc(Br)cc2)CC1 ZINC000548153056 567283143 /nfs/dbraw/zinc/28/31/43/567283143.db2.gz KNTJOZACRZUAEW-UHFFFAOYSA-N 2 1 390.285 3.240 20 0 GGADMP CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000567894642 567288490 /nfs/dbraw/zinc/28/84/90/567288490.db2.gz KZBCDVHWIBPOPW-JKSUJKDBSA-N 2 1 384.351 3.273 20 0 GGADMP CN(CCC[N@@H+](C)Cc1ccco1)Cc1cnn2cc(Br)cnc12 ZINC000639165864 567292694 /nfs/dbraw/zinc/29/26/94/567292694.db2.gz ADDWOINTTWGPBL-UHFFFAOYSA-N 2 1 392.301 3.039 20 0 GGADMP CN(CCC[N@H+](C)Cc1cnn2cc(Br)cnc12)Cc1ccco1 ZINC000639165864 567292707 /nfs/dbraw/zinc/29/27/07/567292707.db2.gz ADDWOINTTWGPBL-UHFFFAOYSA-N 2 1 392.301 3.039 20 0 GGADMP CN(CCC[N@@H+](C)Cc1cnn2cc(Br)cnc12)Cc1ccco1 ZINC000639165864 567292709 /nfs/dbraw/zinc/29/27/09/567292709.db2.gz ADDWOINTTWGPBL-UHFFFAOYSA-N 2 1 392.301 3.039 20 0 GGADMP CN(CCC[N@@H+](C)Cc1ccc(Br)c2cccnc12)CC[NH+](C)C ZINC000567958781 567293356 /nfs/dbraw/zinc/29/33/56/567293356.db2.gz ZWRBZHFEEWMPJX-UHFFFAOYSA-N 2 1 393.373 3.313 20 0 GGADMP C[C@H]([NH2+]CCCc1c[nH+]cn1C)c1cc2c(cc1Br)OCCO2 ZINC000568166389 567309044 /nfs/dbraw/zinc/30/90/44/567309044.db2.gz JXTYNIDRFXDDIT-LBPRGKRZSA-N 2 1 380.286 3.237 20 0 GGADMP Cc1c(Br)scc1C(=O)Nc1c[nH+]ccc1N1CC[NH+](C)CC1 ZINC000548451052 567317317 /nfs/dbraw/zinc/31/73/17/567317317.db2.gz UMXDLTDLBDJVLJ-UHFFFAOYSA-N 2 1 395.326 3.218 20 0 GGADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCC(=O)Nc1ccc(Br)cc1F)C2 ZINC000660656429 567318020 /nfs/dbraw/zinc/31/80/20/567318020.db2.gz UHFAPOPJMVYDAS-GOSISDBHSA-N 2 1 398.320 3.335 20 0 GGADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCC(=O)Nc1ccc(Br)cc1F)C2 ZINC000660656429 567318024 /nfs/dbraw/zinc/31/80/24/567318024.db2.gz UHFAPOPJMVYDAS-GOSISDBHSA-N 2 1 398.320 3.335 20 0 GGADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCC(=O)Nc1ccc(Br)cc1F)C2 ZINC000660656429 567318027 /nfs/dbraw/zinc/31/80/27/567318027.db2.gz UHFAPOPJMVYDAS-GOSISDBHSA-N 2 1 398.320 3.335 20 0 GGADMP Cc1nccn1CCCC[N@H+]1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000639771173 567319648 /nfs/dbraw/zinc/31/96/48/567319648.db2.gz BJCOCUDBRLYYCU-INIZCTEOSA-N 2 1 379.302 3.283 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000639771173 567319660 /nfs/dbraw/zinc/31/96/60/567319660.db2.gz BJCOCUDBRLYYCU-INIZCTEOSA-N 2 1 379.302 3.283 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]Cc2cc3cc(Br)ccc3o2)CC1(C)C ZINC000568664742 567346256 /nfs/dbraw/zinc/34/62/56/567346256.db2.gz RULFSHQMWQOWNU-UHFFFAOYSA-N 2 1 380.330 3.311 20 0 GGADMP C[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1ccc(Br)cn1 ZINC000568690119 567349224 /nfs/dbraw/zinc/34/92/24/567349224.db2.gz FMVIAWHNZPVJEA-CYBMUJFWSA-N 2 1 379.302 3.030 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000435374822 567357892 /nfs/dbraw/zinc/35/78/92/567357892.db2.gz YSRLWOJOXMPIHP-KPZWWZAWSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000435374822 567357897 /nfs/dbraw/zinc/35/78/97/567357897.db2.gz YSRLWOJOXMPIHP-KPZWWZAWSA-N 2 1 377.330 3.421 20 0 GGADMP CC[N@@H+](CCC(=O)Nc1ccc(Br)cc1F)[C@@H]1CCC[NH2+]CC1 ZINC000435623424 567379981 /nfs/dbraw/zinc/37/99/81/567379981.db2.gz CNYVAYWBSNDAFF-CQSZACIVSA-N 2 1 386.309 3.381 20 0 GGADMP CC[N@H+](CC(=O)N[C@@H](C)c1ccc(Br)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000435628962 567381614 /nfs/dbraw/zinc/38/16/14/567381614.db2.gz RZRFREVFCVYDSY-WMLDXEAASA-N 2 1 382.346 3.090 20 0 GGADMP CC[N@@H+](CC(=O)N[C@@H](C)c1ccc(Br)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000435628962 567381617 /nfs/dbraw/zinc/38/16/17/567381617.db2.gz RZRFREVFCVYDSY-WMLDXEAASA-N 2 1 382.346 3.090 20 0 GGADMP CC[N@H+](CC(=O)N[C@H](C)c1ccc(Br)cc1)[C@H]1CCC[NH2+]CC1 ZINC000435628959 567381732 /nfs/dbraw/zinc/38/17/32/567381732.db2.gz RZRFREVFCVYDSY-PBHICJAKSA-N 2 1 382.346 3.090 20 0 GGADMP CC[N@@H+](CC(=O)N[C@H](C)c1ccc(Br)cc1)[C@H]1CCC[NH2+]CC1 ZINC000435628959 567381736 /nfs/dbraw/zinc/38/17/36/567381736.db2.gz RZRFREVFCVYDSY-PBHICJAKSA-N 2 1 382.346 3.090 20 0 GGADMP O=C(C[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2)NCc1cccs1 ZINC000435691738 567384702 /nfs/dbraw/zinc/38/47/02/567384702.db2.gz HTBKTXLXGFBXBU-KRWDZBQOSA-N 2 1 375.563 3.070 20 0 GGADMP O=C(C[N@@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2)NCc1cccs1 ZINC000435691738 567384707 /nfs/dbraw/zinc/38/47/07/567384707.db2.gz HTBKTXLXGFBXBU-KRWDZBQOSA-N 2 1 375.563 3.070 20 0 GGADMP Brc1csc(-c2noc(C[N@H+]3CCC[C@H]([C@@H]4CC[NH2+]C4)C3)n2)c1 ZINC000569245475 567389498 /nfs/dbraw/zinc/38/94/98/567389498.db2.gz KLVGTOFYTLMEKW-NEPJUHHUSA-N 2 1 397.342 3.382 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]Cc1c(F)ccc(Br)c1F ZINC000501492728 567393244 /nfs/dbraw/zinc/39/32/44/567393244.db2.gz WJSHXQMNBTUQEP-LBPRGKRZSA-N 2 1 377.273 3.054 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@H]2CCc3cccc(Br)c3C2)CC1 ZINC000549733998 567407303 /nfs/dbraw/zinc/40/73/03/567407303.db2.gz RFYSDUVXGGASIU-SFHVURJKSA-N 2 1 394.401 3.170 20 0 GGADMP C[N@H+](CC(=O)Nc1ccccc1Br)Cc1cccc2c1CC[NH2+]C2 ZINC000662249599 567422250 /nfs/dbraw/zinc/42/22/50/567422250.db2.gz PIUOMBMWZCDLNO-UHFFFAOYSA-N 2 1 388.309 3.165 20 0 GGADMP C[N@@H+](CC(=O)Nc1ccccc1Br)Cc1cccc2c1CC[NH2+]C2 ZINC000662249599 567422254 /nfs/dbraw/zinc/42/22/54/567422254.db2.gz PIUOMBMWZCDLNO-UHFFFAOYSA-N 2 1 388.309 3.165 20 0 GGADMP C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662402370 567432890 /nfs/dbraw/zinc/43/28/90/567432890.db2.gz IJNGUJHZJKWBHC-CZUORRHYSA-N 2 1 382.346 3.076 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662402370 567432903 /nfs/dbraw/zinc/43/29/03/567432903.db2.gz IJNGUJHZJKWBHC-CZUORRHYSA-N 2 1 382.346 3.076 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)c1ccc(F)cc1 ZINC000662396437 567432936 /nfs/dbraw/zinc/43/29/36/567432936.db2.gz BDRDFTNEZRXPGL-DLBZAZTESA-N 2 1 394.288 3.007 20 0 GGADMP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)[C@@H]([NH3+])c1ccccc1Br ZINC000662390134 567433102 /nfs/dbraw/zinc/43/31/02/567433102.db2.gz WEHUXYXJTLNNLM-YOEHRIQHSA-N 2 1 382.346 3.220 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)[C@@H]([NH3+])c1ccccc1Br ZINC000662390134 567433104 /nfs/dbraw/zinc/43/31/04/567433104.db2.gz WEHUXYXJTLNNLM-YOEHRIQHSA-N 2 1 382.346 3.220 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)[C@@H]([NH3+])c2ccccc2Br)c1 ZINC000662404912 567433794 /nfs/dbraw/zinc/43/37/94/567433794.db2.gz KCWPNVZBPXYLLC-SFHVURJKSA-N 2 1 390.325 3.217 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)[C@@H]([NH3+])c2ccccc2Br)c1 ZINC000662404912 567433800 /nfs/dbraw/zinc/43/38/00/567433800.db2.gz KCWPNVZBPXYLLC-SFHVURJKSA-N 2 1 390.325 3.217 20 0 GGADMP C[C@@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)[N@H+](C)Cc1ccccc1 ZINC000662454474 567438113 /nfs/dbraw/zinc/43/81/13/567438113.db2.gz NZHVZBINUITWRH-KSSFIOAISA-N 2 1 390.325 3.086 20 0 GGADMP C[C@@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)[N@@H+](C)Cc1ccccc1 ZINC000662454474 567438117 /nfs/dbraw/zinc/43/81/17/567438117.db2.gz NZHVZBINUITWRH-KSSFIOAISA-N 2 1 390.325 3.086 20 0 GGADMP C[C@@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)[N@H+](C)Cc1ccccc1 ZINC000662454472 567438261 /nfs/dbraw/zinc/43/82/61/567438261.db2.gz NZHVZBINUITWRH-KBXCAEBGSA-N 2 1 390.325 3.086 20 0 GGADMP C[C@@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)[N@@H+](C)Cc1ccccc1 ZINC000662454472 567438266 /nfs/dbraw/zinc/43/82/66/567438266.db2.gz NZHVZBINUITWRH-KBXCAEBGSA-N 2 1 390.325 3.086 20 0 GGADMP C[NH+]1CCN(c2cc[nH+]cc2NC(=O)CSc2ccc(Cl)cc2)CC1 ZINC000619176626 567438384 /nfs/dbraw/zinc/43/83/84/567438384.db2.gz IWXCUDGLIHQGCS-UHFFFAOYSA-N 2 1 376.913 3.218 20 0 GGADMP [NH3+][C@@H](C(=O)NCCCCC[NH+]1CCCCC1)c1ccccc1Br ZINC000662454375 567438508 /nfs/dbraw/zinc/43/85/08/567438508.db2.gz MXIAOCRSBYQRCA-QGZVFWFLSA-N 2 1 382.346 3.221 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)c2cc3c(s2)CC[NH2+]C3)[C@H]1c1cccs1 ZINC000662474174 567439229 /nfs/dbraw/zinc/43/92/29/567439229.db2.gz UBOUFBWPEBGTDC-ACJLOTCBSA-N 2 1 375.563 3.268 20 0 GGADMP CC[NH+](CC)CC1CCN(C(=O)[C@H]([NH3+])c2ccccc2Br)CC1 ZINC000662473941 567439379 /nfs/dbraw/zinc/43/93/79/567439379.db2.gz QYYIRDJLCSWFMI-QGZVFWFLSA-N 2 1 382.346 3.029 20 0 GGADMP CC(C)CC[NH+]1CCC(CNC(=O)[C@H]([NH3+])c2ccccc2Br)CC1 ZINC000662492666 567440828 /nfs/dbraw/zinc/44/08/28/567440828.db2.gz OGTDIZVFTAMTKN-GOSISDBHSA-N 2 1 396.373 3.323 20 0 GGADMP C[NH2+][C@@H](C(=O)N1CC[C@H](C[N@H+](C)CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000662486161 567441879 /nfs/dbraw/zinc/44/18/79/567441879.db2.gz LZHHNGFWKXXHSZ-RDTXWAMCSA-N 2 1 384.351 3.444 20 0 GGADMP C[NH2+][C@@H](C(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000662486161 567441885 /nfs/dbraw/zinc/44/18/85/567441885.db2.gz LZHHNGFWKXXHSZ-RDTXWAMCSA-N 2 1 384.351 3.444 20 0 GGADMP C[N@H+](CCCNC(=O)[C@@H]([NH3+])c1ccccc1Br)C1CCCCC1 ZINC000662525855 567444781 /nfs/dbraw/zinc/44/47/81/567444781.db2.gz LBMXWJJLIJJCOW-KRWDZBQOSA-N 2 1 382.346 3.220 20 0 GGADMP C[N@@H+](CCCNC(=O)[C@@H]([NH3+])c1ccccc1Br)C1CCCCC1 ZINC000662525855 567444786 /nfs/dbraw/zinc/44/47/86/567444786.db2.gz LBMXWJJLIJJCOW-KRWDZBQOSA-N 2 1 382.346 3.220 20 0 GGADMP CC[N@@H+](CCN1CC[NH2+]CC1)[C@H]1CCSc2ccc(Br)cc21 ZINC000569971857 567447561 /nfs/dbraw/zinc/44/75/61/567447561.db2.gz JAMZPLWIBQSPTC-INIZCTEOSA-N 2 1 384.387 3.213 20 0 GGADMP C[NH2+][C@H](C(=O)N1CCC([C@@H]2CCC[NH2+]C2)CC1)c1cccc(Cl)c1Cl ZINC000662586593 567450739 /nfs/dbraw/zinc/45/07/39/567450739.db2.gz LYYMKRAWXDPMEG-KDOFPFPSSA-N 2 1 384.351 3.492 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@@H](O)COc1ccc(Br)cc1 ZINC000570037149 567454269 /nfs/dbraw/zinc/45/42/69/567454269.db2.gz OPRACTDWSJYHTB-SJLPKXTDSA-N 2 1 399.373 3.433 20 0 GGADMP CS(=O)(=O)CC1CCC([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000550642833 567455452 /nfs/dbraw/zinc/45/54/52/567455452.db2.gz VUEVCUYAUNILGL-ADKAHSJRSA-N 2 1 384.611 3.153 20 0 GGADMP CS(=O)(=O)CC1CCC([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000550642833 567455458 /nfs/dbraw/zinc/45/54/58/567455458.db2.gz VUEVCUYAUNILGL-ADKAHSJRSA-N 2 1 384.611 3.153 20 0 GGADMP C[C@]([NH3+])(C(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1)c1ccc(Br)cc1 ZINC000662667678 567456392 /nfs/dbraw/zinc/45/63/92/567456392.db2.gz CIVLOFKBFMQORY-QFBILLFUSA-N 2 1 394.357 3.146 20 0 GGADMP C[N@@H+](CCCOc1cccc(I)c1)[C@H]1CCC[NH2+]CC1 ZINC000478552454 567467024 /nfs/dbraw/zinc/46/70/24/567467024.db2.gz SPYHQRKJPUMGKY-HNNXBMFYSA-N 2 1 388.293 3.134 20 0 GGADMP C[NH2+][C@@H](C(=O)NCC1CC[NH+](CC2CC2)CC1)c1cccc(Cl)c1Cl ZINC000662977233 567471948 /nfs/dbraw/zinc/47/19/48/567471948.db2.gz HHUJISMIEIDRMZ-GOSISDBHSA-N 2 1 384.351 3.492 20 0 GGADMP CC(C)[C@@H](CNc1cc[nH+]c2ccc(Br)cc12)[NH+]1CCOCC1 ZINC000503569082 567495550 /nfs/dbraw/zinc/49/55/50/567495550.db2.gz NKVSYVNUYREORE-GOSISDBHSA-N 2 1 378.314 3.188 20 0 GGADMP Brc1ccc2ncc(C[NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)n2c1 ZINC000663345258 567499349 /nfs/dbraw/zinc/49/93/49/567499349.db2.gz HSDTXQFFNYASLA-HNNXBMFYSA-N 2 1 377.330 3.308 20 0 GGADMP Brc1ccc2ncc(C[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)n2c1 ZINC000663345258 567499353 /nfs/dbraw/zinc/49/93/53/567499353.db2.gz HSDTXQFFNYASLA-HNNXBMFYSA-N 2 1 377.330 3.308 20 0 GGADMP CC(C)C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000479061409 567499911 /nfs/dbraw/zinc/49/99/11/567499911.db2.gz MVULRTCGYVBICR-SFHVURJKSA-N 2 1 396.373 3.290 20 0 GGADMP Brc1cc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc2c1OCO2 ZINC000663347888 567500011 /nfs/dbraw/zinc/50/00/11/567500011.db2.gz ZGMCSXWILZTNSY-AWEZNQCLSA-N 2 1 381.314 3.389 20 0 GGADMP Brc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc2c1OCO2 ZINC000663347888 567500013 /nfs/dbraw/zinc/50/00/13/567500013.db2.gz ZGMCSXWILZTNSY-AWEZNQCLSA-N 2 1 381.314 3.389 20 0 GGADMP Brc1cc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc2c1OCCO2 ZINC000663347518 567500082 /nfs/dbraw/zinc/50/00/82/567500082.db2.gz NBOPWNBUMWMPMM-HNNXBMFYSA-N 2 1 395.341 3.432 20 0 GGADMP Brc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc2c1OCCO2 ZINC000663347518 567500084 /nfs/dbraw/zinc/50/00/84/567500084.db2.gz NBOPWNBUMWMPMM-HNNXBMFYSA-N 2 1 395.341 3.432 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccc(I)c(Cl)c1 ZINC000503900190 567511303 /nfs/dbraw/zinc/51/13/03/567511303.db2.gz DENQIBSUNAAYDM-HZMBPMFUSA-N 2 1 378.685 3.374 20 0 GGADMP Cc1cc([C@@H]([NH2+]CC(=O)N2CC[NH2+]CC2)c2cccc(Cl)c2)c(C)s1 ZINC000570792622 567513129 /nfs/dbraw/zinc/51/31/29/567513129.db2.gz UTJMLBJNLNAWNI-IBGZPJMESA-N 2 1 377.941 3.129 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CC2 ZINC000595010177 567534271 /nfs/dbraw/zinc/53/42/71/567534271.db2.gz IDUXPOJTJSYDJC-ZMSDIMECSA-N 2 1 382.289 3.495 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCc2ccc(I)cc21 ZINC000595018043 567535535 /nfs/dbraw/zinc/53/55/35/567535535.db2.gz OQZRGILRRMECOP-MRXNPFEDSA-N 2 1 381.261 3.463 20 0 GGADMP C[N@@H+](Cc1ccccc1)C[C@@H](O)C[NH2+]CCc1ccc(Br)s1 ZINC000644514722 567555390 /nfs/dbraw/zinc/55/53/90/567555390.db2.gz JDBOVRDZHWSIIE-HNNXBMFYSA-N 2 1 383.355 3.136 20 0 GGADMP C[N@H+](Cc1ccccc1)C[C@@H](O)C[NH2+]CCc1ccc(Br)s1 ZINC000644514722 567555395 /nfs/dbraw/zinc/55/53/95/567555395.db2.gz JDBOVRDZHWSIIE-HNNXBMFYSA-N 2 1 383.355 3.136 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]CCn3cc(Br)cn3)CC2)cc1 ZINC000552097007 567557874 /nfs/dbraw/zinc/55/78/74/567557874.db2.gz PTURFSHFOHWEAN-UHFFFAOYSA-N 2 1 395.320 3.081 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](C[NH2+]C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000644588778 567561490 /nfs/dbraw/zinc/56/14/90/567561490.db2.gz UBQNWKYCSQRVAV-HUUCEWRRSA-N 2 1 375.340 3.301 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1ccc(Br)cc1C ZINC000505791557 567597076 /nfs/dbraw/zinc/59/70/76/567597076.db2.gz YFSDJYIBNNHUBM-QGZVFWFLSA-N 2 1 396.373 3.246 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccsc3Cl)c2)C1 ZINC000480372629 567598786 /nfs/dbraw/zinc/59/87/86/567598786.db2.gz RNUUOMYDPFNMMF-KRWDZBQOSA-N 2 1 377.941 3.389 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccsc3Cl)c2)C1 ZINC000480372629 567598788 /nfs/dbraw/zinc/59/87/88/567598788.db2.gz RNUUOMYDPFNMMF-KRWDZBQOSA-N 2 1 377.941 3.389 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccsc3Cl)c2)C1 ZINC000480372630 567599889 /nfs/dbraw/zinc/59/98/89/567599889.db2.gz RNUUOMYDPFNMMF-QGZVFWFLSA-N 2 1 377.941 3.389 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccsc3Cl)c2)C1 ZINC000480372630 567599896 /nfs/dbraw/zinc/59/98/96/567599896.db2.gz RNUUOMYDPFNMMF-QGZVFWFLSA-N 2 1 377.941 3.389 20 0 GGADMP C[C@H](CCc1ccc(I)cc1)[NH2+]CCc1c[nH+]cn1C ZINC000530465611 567604629 /nfs/dbraw/zinc/60/46/29/567604629.db2.gz PJIWZIMAGBGIAV-CYBMUJFWSA-N 2 1 383.277 3.178 20 0 GGADMP C[C@H]1C[NH+](CC2CC[NH+](Cc3cccc(O)c3Br)CC2)C[C@H](C)O1 ZINC000459307888 567613270 /nfs/dbraw/zinc/61/32/70/567613270.db2.gz ABHHXHVQXKNCTO-GJZGRUSLSA-N 2 1 397.357 3.476 20 0 GGADMP Cc1cc(Br)c(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)s1 ZINC000572116886 567614790 /nfs/dbraw/zinc/61/47/90/567614790.db2.gz FWRLWODWGLGUCC-UHFFFAOYSA-N 2 1 395.326 3.218 20 0 GGADMP CCO[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3csc(CC)n3)CC2)[C@@H]1SC ZINC000459403964 567622112 /nfs/dbraw/zinc/62/21/12/567622112.db2.gz BYPGWXKMLCNNBK-SCTDSRPQSA-N 2 1 383.627 3.416 20 0 GGADMP Brc1cccc(N2CC[C@@H](C[NH2+]C3CC[NH+](C4CC4)CC3)C2)c1 ZINC000459401806 567622155 /nfs/dbraw/zinc/62/21/55/567622155.db2.gz YDZLWJXXYWVQNL-HNNXBMFYSA-N 2 1 378.358 3.492 20 0 GGADMP Clc1cnn(CC[N@H+](CCn2ccnc2)Cc2ccc(Br)o2)c1 ZINC000459455367 567625500 /nfs/dbraw/zinc/62/55/00/567625500.db2.gz CWQQHMQFGMPSCI-UHFFFAOYSA-N 2 1 398.692 3.291 20 0 GGADMP Clc1cnn(CC[N@@H+](CCn2ccnc2)Cc2ccc(Br)o2)c1 ZINC000459455367 567625509 /nfs/dbraw/zinc/62/55/09/567625509.db2.gz CWQQHMQFGMPSCI-UHFFFAOYSA-N 2 1 398.692 3.291 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)CC[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000459475041 567627508 /nfs/dbraw/zinc/62/75/08/567627508.db2.gz DPAVIVFLKGVSLZ-UHFFFAOYSA-N 2 1 380.330 3.303 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(Br)ccc2OC)C1 ZINC000530866574 567627816 /nfs/dbraw/zinc/62/78/16/567627816.db2.gz HLNSEHLDWFSGQF-QGZVFWFLSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cc(Br)ccc2OC)C1 ZINC000530866574 567627820 /nfs/dbraw/zinc/62/78/20/567627820.db2.gz HLNSEHLDWFSGQF-QGZVFWFLSA-N 2 1 385.346 3.390 20 0 GGADMP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](CC(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000572384422 567635461 /nfs/dbraw/zinc/63/54/61/567635461.db2.gz XIXSCVQRSWLXGJ-AEFFLSMTSA-N 2 1 386.323 3.150 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000645515955 567636813 /nfs/dbraw/zinc/63/68/13/567636813.db2.gz GCRHQBUYYJJYDH-BEFAXECRSA-N 2 1 396.373 3.251 20 0 GGADMP CC(C)(C[NH2+]Cc1cc(Br)c2c(c1)OCCO2)C[NH+]1CCCC1 ZINC000480921628 567642718 /nfs/dbraw/zinc/64/27/18/567642718.db2.gz RWDVHFTUOSKXDB-UHFFFAOYSA-N 2 1 383.330 3.432 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2CCOc1cccc(Br)c1 ZINC000441181876 567656060 /nfs/dbraw/zinc/65/60/60/567656060.db2.gz SURKODREDBXMGP-KBAYOESNSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2CCOc1cccc(Br)c1 ZINC000441181876 567656061 /nfs/dbraw/zinc/65/60/61/567656061.db2.gz SURKODREDBXMGP-KBAYOESNSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cnc4ccc(Br)cn34)C2)CC1 ZINC000572683411 567657659 /nfs/dbraw/zinc/65/76/59/567657659.db2.gz UXQNXPKVRRDFJU-OAHLLOKOSA-N 2 1 377.330 3.261 20 0 GGADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cnc4ccc(Br)cn34)C2)CC1 ZINC000572683411 567657660 /nfs/dbraw/zinc/65/76/60/567657660.db2.gz UXQNXPKVRRDFJU-OAHLLOKOSA-N 2 1 377.330 3.261 20 0 GGADMP CN(CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)c1cncc(Br)c1 ZINC000531428384 567658650 /nfs/dbraw/zinc/65/86/50/567658650.db2.gz USJUUKOSZRMTAS-UHFFFAOYSA-N 2 1 395.389 3.477 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1)Nc1ccccc1Br ZINC000572763847 567662463 /nfs/dbraw/zinc/66/24/63/567662463.db2.gz FAVRFHXJONXXTL-LSDHHAIUSA-N 2 1 380.330 3.099 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1)Nc1ccccc1Br ZINC000572763845 567663472 /nfs/dbraw/zinc/66/34/72/567663472.db2.gz FAVRFHXJONXXTL-GJZGRUSLSA-N 2 1 380.330 3.099 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cc4cc(Br)ccc4o3)C2)CC1 ZINC000597002784 567670197 /nfs/dbraw/zinc/67/01/97/567670197.db2.gz IJBUUMIEIGZECU-KRWDZBQOSA-N 2 1 392.341 3.407 20 0 GGADMP Cc1nc2c(s1)[C@H]([NH2+]C[C@@H](c1cccs1)N1CC[NH+](C)CC1)CCC2 ZINC000531676934 567673426 /nfs/dbraw/zinc/67/34/26/567673426.db2.gz TVCQFDFMRKERNS-WBVHZDCISA-N 2 1 376.595 3.469 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[C@H](C)[NH3+] ZINC000572999308 567681379 /nfs/dbraw/zinc/68/13/79/567681379.db2.gz QSKUUOIQYAQFRH-KBXCAEBGSA-N 2 1 396.373 3.149 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]CCc1c[nH+]cn1C ZINC000623086909 567684301 /nfs/dbraw/zinc/68/43/01/567684301.db2.gz QXUBACSPQJOSNO-UHFFFAOYSA-N 2 1 388.313 3.317 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000531937207 567690387 /nfs/dbraw/zinc/69/03/87/567690387.db2.gz MFEUFGBWQFWYPI-KBRIMQKVSA-N 2 1 380.330 3.383 20 0 GGADMP Brc1ccc(-c2noc(C[N@H+]3CCC[C@@H]([C@@H]4CC[NH2+]C4)C3)n2)s1 ZINC000573207343 567697117 /nfs/dbraw/zinc/69/71/17/567697117.db2.gz NQVJDVHDXVPOGD-VXGBXAGGSA-N 2 1 397.342 3.382 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1cc(Br)ccc1C ZINC000460906682 567709110 /nfs/dbraw/zinc/70/91/10/567709110.db2.gz DDOMTPUFXZLKKP-KRWDZBQOSA-N 2 1 396.373 3.246 20 0 GGADMP C[C@H](Cc1ccc(Br)c(F)c1)[NH2+]CCN1CC[N@@H+](C)C(C)(C)C1 ZINC000442860500 567712505 /nfs/dbraw/zinc/71/25/05/567712505.db2.gz BSGPROICVFDZQL-CQSZACIVSA-N 2 1 386.353 3.135 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@@H]2CCCc3cc(Br)ccc32)CC1(C)C ZINC000442880364 567713972 /nfs/dbraw/zinc/71/39/72/567713972.db2.gz XLUKTEAUYFODEC-GOSISDBHSA-N 2 1 380.374 3.442 20 0 GGADMP Cc1cc(Br)cc2c1[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)CC2 ZINC000442878634 567714053 /nfs/dbraw/zinc/71/40/53/567714053.db2.gz UEWUTVGAOOAYMZ-KRWDZBQOSA-N 2 1 380.374 3.360 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@@H]2CCCOc3c(Br)cccc32)CC1(C)C ZINC000442869700 567714346 /nfs/dbraw/zinc/71/43/46/567714346.db2.gz FBCYOFGCUPXBCU-QGZVFWFLSA-N 2 1 396.373 3.278 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@H]2CCCc3cc(Br)ccc32)CC1(C)C ZINC000442880367 567714575 /nfs/dbraw/zinc/71/45/75/567714575.db2.gz XLUKTEAUYFODEC-SFHVURJKSA-N 2 1 380.374 3.442 20 0 GGADMP Brc1cc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc2c1OCCCO2 ZINC000666998371 567717114 /nfs/dbraw/zinc/71/71/14/567717114.db2.gz PTMZNTMPPKJFFL-CQSZACIVSA-N 2 1 381.314 3.375 20 0 GGADMP Brc1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c(N2CCOCC2)c1 ZINC000666993788 567717709 /nfs/dbraw/zinc/71/77/09/567717709.db2.gz JYNPHBYVMNZQMZ-KRWDZBQOSA-N 2 1 394.357 3.050 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]CCCCc3ccc(Cl)s3)cn2)CC1 ZINC000573704707 567731447 /nfs/dbraw/zinc/73/14/47/567731447.db2.gz YAZWRIYHHAFEGT-UHFFFAOYSA-N 2 1 379.961 3.056 20 0 GGADMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000624123211 567761867 /nfs/dbraw/zinc/76/18/67/567761867.db2.gz ICOWEIYOXNVPBY-YOEHRIQHSA-N 2 1 387.977 3.021 20 0 GGADMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000624123211 567761870 /nfs/dbraw/zinc/76/18/70/567761870.db2.gz ICOWEIYOXNVPBY-YOEHRIQHSA-N 2 1 387.977 3.021 20 0 GGADMP Cc1c(Br)cncc1CN1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000667689283 567767468 /nfs/dbraw/zinc/76/74/68/567767468.db2.gz UCFNWLCRXBJRRC-UHFFFAOYSA-N 2 1 395.389 3.143 20 0 GGADMP C[N@H+](C[C@@H](O)C[NH2+]CC1(c2ccc(Br)cc2Cl)CC1)C1CC1 ZINC000574445365 567779312 /nfs/dbraw/zinc/77/93/12/567779312.db2.gz ZSXBKWBCPIYTQM-AWEZNQCLSA-N 2 1 387.749 3.179 20 0 GGADMP C[N@@H+](C[C@@H](O)C[NH2+]CC1(c2ccc(Br)cc2Cl)CC1)C1CC1 ZINC000574445365 567779315 /nfs/dbraw/zinc/77/93/15/567779315.db2.gz ZSXBKWBCPIYTQM-AWEZNQCLSA-N 2 1 387.749 3.179 20 0 GGADMP COc1c(Br)cc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1Br ZINC000574501306 567781912 /nfs/dbraw/zinc/78/19/12/567781912.db2.gz PMZNIHGXXWIOCZ-KOLCDFICSA-N 2 1 392.135 3.450 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(Br)c1O ZINC000647542930 567790444 /nfs/dbraw/zinc/79/04/44/567790444.db2.gz DVAKNXYJTWAICI-KGLIPLIRSA-N 2 1 383.330 3.375 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cc1O ZINC000647542960 567790745 /nfs/dbraw/zinc/79/07/45/567790745.db2.gz FGGMNZIRFXSIBV-ZIAGYGMSSA-N 2 1 383.330 3.375 20 0 GGADMP Brc1ccc2ncc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)n2c1 ZINC000647543400 567790913 /nfs/dbraw/zinc/79/09/13/567790913.db2.gz MQAXABAOURTKPJ-LSDHHAIUSA-N 2 1 377.330 3.308 20 0 GGADMP Brc1ccc2ncc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)n2c1 ZINC000647543397 567790961 /nfs/dbraw/zinc/79/09/61/567790961.db2.gz MQAXABAOURTKPJ-CABCVRRESA-N 2 1 377.330 3.308 20 0 GGADMP Brc1ccc2ncc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)n2c1 ZINC000647543398 567791147 /nfs/dbraw/zinc/79/11/47/567791147.db2.gz MQAXABAOURTKPJ-GJZGRUSLSA-N 2 1 377.330 3.308 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(F)c(I)c1 ZINC000574845294 567800024 /nfs/dbraw/zinc/80/00/24/567800024.db2.gz SOJUCKMPAFYHEB-VXGBXAGGSA-N 2 1 376.257 3.423 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(F)c(I)c1 ZINC000574845292 567800539 /nfs/dbraw/zinc/80/05/39/567800539.db2.gz SOJUCKMPAFYHEB-NWDGAFQWSA-N 2 1 376.257 3.423 20 0 GGADMP O=C(CC1CC[NH2+]CC1)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000574915108 567804168 /nfs/dbraw/zinc/80/41/68/567804168.db2.gz CKMPLPKZQSLHML-UHFFFAOYSA-N 2 1 384.351 3.464 20 0 GGADMP Brc1cccc(-c2noc(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)n2)c1 ZINC000574916919 567805035 /nfs/dbraw/zinc/80/50/35/567805035.db2.gz LIICGPAPKZEFEK-HNNXBMFYSA-N 2 1 391.313 3.321 20 0 GGADMP O=C(C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000647975226 567808710 /nfs/dbraw/zinc/80/87/10/567808710.db2.gz RFHBYCGQIMLKBX-LSDHHAIUSA-N 2 1 380.330 3.099 20 0 GGADMP O=C(C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000647975004 567808884 /nfs/dbraw/zinc/80/88/84/567808884.db2.gz GHTNPOULCSJZTF-KBPBESRZSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000647975004 567808885 /nfs/dbraw/zinc/80/88/85/567808885.db2.gz GHTNPOULCSJZTF-KBPBESRZSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccccc1Br ZINC000647976957 567809093 /nfs/dbraw/zinc/80/90/93/567809093.db2.gz WHJXSZFLNQTCSF-JKSUJKDBSA-N 2 1 394.357 3.489 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1OC ZINC000647986878 567809709 /nfs/dbraw/zinc/80/97/09/567809709.db2.gz ILBXBQPZEVYFFN-ZIAGYGMSSA-N 2 1 383.330 3.288 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1)c1ccc(Cl)cc1Cl ZINC000647987297 567810040 /nfs/dbraw/zinc/81/00/40/567810040.db2.gz GUOOLGAEIUZNMK-SOUVJXGZSA-N 2 1 384.351 3.492 20 0 GGADMP Cc1cccc(-c2noc(C[NH+]3CCC(C[N@@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)n2)c1 ZINC000058268654 570724126 /nfs/dbraw/zinc/72/41/26/570724126.db2.gz WCNFVGAPYHJWSC-HDICACEKSA-N 2 1 384.524 3.366 20 0 GGADMP Cc1cccc(-c2noc(C[NH+]3CCC(C[N@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)n2)c1 ZINC000058268654 570724128 /nfs/dbraw/zinc/72/41/28/570724128.db2.gz WCNFVGAPYHJWSC-HDICACEKSA-N 2 1 384.524 3.366 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cn3ccccc3c2-c2nn[nH]n2)C1 ZINC000736267943 598871145 /nfs/dbraw/zinc/87/11/45/598871145.db2.gz QWWXKPHMMRTKLO-MSOLQXFVSA-N 2 1 393.539 3.206 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cn3ccccc3c2-c2nn[nH]n2)C1 ZINC000736267943 598871146 /nfs/dbraw/zinc/87/11/46/598871146.db2.gz QWWXKPHMMRTKLO-MSOLQXFVSA-N 2 1 393.539 3.206 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cn3ccccc3c2-c2nn[nH]n2)C1 ZINC000736267943 598871147 /nfs/dbraw/zinc/87/11/47/598871147.db2.gz QWWXKPHMMRTKLO-MSOLQXFVSA-N 2 1 393.539 3.206 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cn3ccccc3c2-c2nn[nH]n2)C1 ZINC000736267943 598871148 /nfs/dbraw/zinc/87/11/48/598871148.db2.gz QWWXKPHMMRTKLO-MSOLQXFVSA-N 2 1 393.539 3.206 20 0 GGADMP C[NH+](C)CC1CC[NH+](c2ccc(NCc3cccc(-c4nn[nH]n4)c3)cc2)CC1 ZINC000821583100 607317807 /nfs/dbraw/zinc/31/78/07/607317807.db2.gz IPSZEMGVVFMDJB-UHFFFAOYSA-N 2 1 391.523 3.257 20 0 GGADMP c1cc(-c2nn[nH]n2)ccc1OCCC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000738413627 598717474 /nfs/dbraw/zinc/71/74/74/598717474.db2.gz ZBLZYOBWYXBHMQ-IBGZPJMESA-N 2 1 398.555 3.224 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccc(-c2nn[nH]n2)c1 ZINC000820409888 607084089 /nfs/dbraw/zinc/08/40/89/607084089.db2.gz BLRQNXULUPUYBE-LLGFUMIMSA-N 2 1 376.508 3.428 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1cccc(-c2nn[nH]n2)c1 ZINC000820409888 607084091 /nfs/dbraw/zinc/08/40/91/607084091.db2.gz BLRQNXULUPUYBE-LLGFUMIMSA-N 2 1 376.508 3.428 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccccc4-c4nn[nH]n4)cc3)CC[C@H]21 ZINC000821625012 607104178 /nfs/dbraw/zinc/10/41/78/607104178.db2.gz CNUPJYVUVFDMRR-DENIHFKCSA-N 2 1 388.519 3.450 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(-c4ccccc4-c4nn[nH]n4)cc3)CC[C@H]21 ZINC000821625012 607104180 /nfs/dbraw/zinc/10/41/80/607104180.db2.gz CNUPJYVUVFDMRR-DENIHFKCSA-N 2 1 388.519 3.450 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4-c4nn[nH]n4)cc3)CC[C@H]21 ZINC000821625012 607104183 /nfs/dbraw/zinc/10/41/83/607104183.db2.gz CNUPJYVUVFDMRR-DENIHFKCSA-N 2 1 388.519 3.450 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)cc1-c1nn[nH]n1 ZINC000826202877 608288296 /nfs/dbraw/zinc/28/82/96/608288296.db2.gz QXOZZIVZNVXNQH-YJBOKZPZSA-N 2 1 384.528 3.008 20 0 GGADMP c1ccc2c(c1)CC[N@@H+](CCC[NH2+][C@@H]1CCCc3cc(-c4nn[nH]n4)ccc31)C2 ZINC000826523491 608499593 /nfs/dbraw/zinc/49/95/93/608499593.db2.gz OKPVQOGVNZRGKF-JOCHJYFZSA-N 2 1 388.519 3.282 20 0 GGADMP c1ccc2c(c1)CC[N@H+](CCC[NH2+][C@@H]1CCCc3cc(-c4nn[nH]n4)ccc31)C2 ZINC000826523491 608499595 /nfs/dbraw/zinc/49/95/95/608499595.db2.gz OKPVQOGVNZRGKF-JOCHJYFZSA-N 2 1 388.519 3.282 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)c1ccc(-c2nn[nH]n2)cc1 ZINC000824540290 609165987 /nfs/dbraw/zinc/16/59/87/609165987.db2.gz VGSZWNQAHMOJFA-JJCGOBCMSA-N 2 1 388.519 3.428 20 0 GGADMP Fc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000826371563 609166418 /nfs/dbraw/zinc/16/64/18/609166418.db2.gz LHFSVCGYYOSVQU-IRFCIJBXSA-N 2 1 392.482 3.006 20 0 GGADMP Fc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000826371563 609166420 /nfs/dbraw/zinc/16/64/20/609166420.db2.gz LHFSVCGYYOSVQU-IRFCIJBXSA-N 2 1 392.482 3.006 20 0 GGADMP Fc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000826371564 609166475 /nfs/dbraw/zinc/16/64/75/609166475.db2.gz LHFSVCGYYOSVQU-QKNQBKEWSA-N 2 1 392.482 3.006 20 0 GGADMP Fc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000826371564 609166477 /nfs/dbraw/zinc/16/64/77/609166477.db2.gz LHFSVCGYYOSVQU-QKNQBKEWSA-N 2 1 392.482 3.006 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)c1cccc(-c2nn[nH]n2)c1 ZINC000824537621 609167324 /nfs/dbraw/zinc/16/73/24/609167324.db2.gz FDMMSWXMIHWOIT-HAFPXEGZSA-N 2 1 388.519 3.428 20 0 GGADMP C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000053753187 1406503231 /nfs/dbraw/zinc/50/32/31/1406503231.db2.gz DJTYYOCMFZVOIW-IBGZPJMESA-N 2 1 386.584 3.461 20 0 GGADMP COc1ccc(C[N@H+]2CCCN(C(=O)NCC[NH+](C(C)C)C(C)C)CC2)cc1 ZINC000053958438 1406569969 /nfs/dbraw/zinc/56/99/69/1406569969.db2.gz YHWFSZFZFGGHNT-UHFFFAOYSA-N 2 1 390.572 3.031 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000053963250 1406571250 /nfs/dbraw/zinc/57/12/50/1406571250.db2.gz KFTPFMLMGKXSLN-UHFFFAOYSA-N 2 1 392.975 3.430 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000053963250 1406571255 /nfs/dbraw/zinc/57/12/55/1406571255.db2.gz KFTPFMLMGKXSLN-UHFFFAOYSA-N 2 1 392.975 3.430 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2cccnc2-n2cc[nH+]c2C)cc1 ZINC000054165675 1406635748 /nfs/dbraw/zinc/63/57/48/1406635748.db2.gz SSJBUZIEKYWFBF-UHFFFAOYSA-N 2 1 377.492 3.348 20 0 GGADMP CCC[N@@H+]1CC[C@H](CNC(=O)N2CCC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509662 1406756595 /nfs/dbraw/zinc/75/65/95/1406756595.db2.gz NPTMLFNBHFVHOQ-LJQANCHMSA-N 2 1 392.975 3.289 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CCC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509662 1406756597 /nfs/dbraw/zinc/75/65/97/1406756597.db2.gz NPTMLFNBHFVHOQ-LJQANCHMSA-N 2 1 392.975 3.289 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509662 1406756605 /nfs/dbraw/zinc/75/66/05/1406756605.db2.gz NPTMLFNBHFVHOQ-LJQANCHMSA-N 2 1 392.975 3.289 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509662 1406756612 /nfs/dbraw/zinc/75/66/12/1406756612.db2.gz NPTMLFNBHFVHOQ-LJQANCHMSA-N 2 1 392.975 3.289 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509945 1406756775 /nfs/dbraw/zinc/75/67/75/1406756775.db2.gz YUJKMRRDCJTYIZ-SFHVURJKSA-N 2 1 392.975 3.336 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000054609189 1406782761 /nfs/dbraw/zinc/78/27/61/1406782761.db2.gz KFUFJQUQTKNPMU-ROUUACIJSA-N 2 1 398.555 3.133 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@H](C(C)C)[NH+]1CCC(C)CC1 ZINC000054609762 1406783528 /nfs/dbraw/zinc/78/35/28/1406783528.db2.gz MPIBXTAVOCGNFM-HXUWFJFHSA-N 2 1 398.555 3.131 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)o1 ZINC000054698740 1406808123 /nfs/dbraw/zinc/80/81/23/1406808123.db2.gz VHKXJYCHIUYUSZ-FPOVZHCZSA-N 2 1 398.551 3.497 20 0 GGADMP C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)NCc2ccc(C[NH+](C)C)cc2)C1 ZINC000054718013 1406811810 /nfs/dbraw/zinc/81/18/10/1406811810.db2.gz SIUFLPJPMPBPNY-AVRDEDQJSA-N 2 1 380.536 3.383 20 0 GGADMP C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)NCc2cccc(C[NH+](C)C)c2)C1 ZINC000054720572 1406813084 /nfs/dbraw/zinc/81/30/84/1406813084.db2.gz IXJRVPZRXBVAQW-AVRDEDQJSA-N 2 1 380.536 3.383 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC(C)(C)[NH+]2C[C@H](C)C[C@@H](C)C2)cn1 ZINC000054725357 1406814606 /nfs/dbraw/zinc/81/46/06/1406814606.db2.gz OQWMJHNXVUGPID-IAGOWNOFSA-N 2 1 398.555 3.131 20 0 GGADMP C[N@@H+](CCNC(=O)NCc1ccccc1C[NH+]1CCCC1)Cc1ccccc1 ZINC000054763449 1406820994 /nfs/dbraw/zinc/82/09/94/1406820994.db2.gz PFTSMVWUCAVUCQ-UHFFFAOYSA-N 2 1 380.536 3.214 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCC1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000054920670 1406851040 /nfs/dbraw/zinc/85/10/40/1406851040.db2.gz TUFGOKNYXBPPLN-HSZRJFAPSA-N 2 1 392.547 3.356 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCC1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000054920667 1406851276 /nfs/dbraw/zinc/85/12/76/1406851276.db2.gz TUFGOKNYXBPPLN-QHCPKHFHSA-N 2 1 392.547 3.356 20 0 GGADMP CCc1ccc(C[N@@H+](C)CC(=O)Nc2ccc(N3CC[NH+](CC)CC3)cc2)cc1 ZINC000007355882 1398658700 /nfs/dbraw/zinc/65/87/00/1398658700.db2.gz BFDURWBQDZWYGO-UHFFFAOYSA-N 2 1 394.563 3.461 20 0 GGADMP CCc1ccc(C[N@H+](C)CC(=O)Nc2ccc(N3CC[NH+](CC)CC3)cc2)cc1 ZINC000007355882 1398658710 /nfs/dbraw/zinc/65/87/10/1398658710.db2.gz BFDURWBQDZWYGO-UHFFFAOYSA-N 2 1 394.563 3.461 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](C)[C@@H](C)c3ccccc3)cc2)CC1 ZINC000015523839 1399168991 /nfs/dbraw/zinc/16/89/91/1399168991.db2.gz SPDKHQTTXVBHKC-IBGZPJMESA-N 2 1 380.536 3.460 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](C)[C@H](C)c3ccccc3)cc2)CC1 ZINC000015523840 1399169079 /nfs/dbraw/zinc/16/90/79/1399169079.db2.gz SPDKHQTTXVBHKC-LJQANCHMSA-N 2 1 380.536 3.460 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NCc3cccc(C[NH+](C)C)c3)cc2)C[C@H](C)O1 ZINC000025127645 1399751833 /nfs/dbraw/zinc/75/18/33/1399751833.db2.gz FYFIEZIZWQCRGE-OALUTQOASA-N 2 1 395.547 3.287 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[N@@H+]1CCc2sccc2C1 ZINC000028380932 1400157941 /nfs/dbraw/zinc/15/79/41/1400157941.db2.gz FCPMQENFLFANMN-ZBFHGGJFSA-N 2 1 392.594 3.158 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000028380932 1400157950 /nfs/dbraw/zinc/15/79/50/1400157950.db2.gz FCPMQENFLFANMN-ZBFHGGJFSA-N 2 1 392.594 3.158 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCc3ccccc3C[NH+](C)C)cc2)C[C@@H](C)O1 ZINC000028896289 1400209617 /nfs/dbraw/zinc/20/96/17/1400209617.db2.gz HYPCCXKBFSVVSN-RTBURBONSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C[C@H](C)O1 ZINC000028937781 1400214857 /nfs/dbraw/zinc/21/48/57/1400214857.db2.gz HNFFVCWKQZUZJU-CALCHBBNSA-N 2 1 387.568 3.335 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C[C@H](C)O1 ZINC000028937781 1400214860 /nfs/dbraw/zinc/21/48/60/1400214860.db2.gz HNFFVCWKQZUZJU-CALCHBBNSA-N 2 1 387.568 3.335 20 0 GGADMP COc1ccc([C@H](CNC(=O)C[N@@H+]2C[C@H](C)C[C@H](C)C2)[NH+]2CCCCC2)cc1 ZINC000029694463 1400338039 /nfs/dbraw/zinc/33/80/39/1400338039.db2.gz MFGWOVPDDZKQBW-JQVVWYNYSA-N 2 1 387.568 3.316 20 0 GGADMP COc1ccc([C@@H](CNC(=O)C[N@@H+]2C[C@H](C)C[C@H](C)C2)[NH+]2CCCCC2)cc1 ZINC000029694458 1400338096 /nfs/dbraw/zinc/33/80/96/1400338096.db2.gz MFGWOVPDDZKQBW-XQBPLPMBSA-N 2 1 387.568 3.316 20 0 GGADMP CC(C)CNC(=O)NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000056156190 1407232673 /nfs/dbraw/zinc/23/26/73/1407232673.db2.gz KDRKFFGCCXHTDZ-MSOLQXFVSA-N 2 1 388.556 3.021 20 0 GGADMP C[C@@H](CNC(=O)NCCC[NH2+]C1CCCCC1)[N@@H+]1CCc2sccc2C1 ZINC000043035953 1403693280 /nfs/dbraw/zinc/69/32/80/1403693280.db2.gz HASHPWKTPKLZFU-INIZCTEOSA-N 2 1 378.586 3.106 20 0 GGADMP C[C@@H](CNC(=O)NCCC[NH2+]C1CCCCC1)[N@H+]1CCc2sccc2C1 ZINC000043035953 1403693285 /nfs/dbraw/zinc/69/32/85/1403693285.db2.gz HASHPWKTPKLZFU-INIZCTEOSA-N 2 1 378.586 3.106 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)CC1 ZINC000043137662 1403714892 /nfs/dbraw/zinc/71/48/92/1403714892.db2.gz CWWVEQWYABROPA-HXUWFJFHSA-N 2 1 384.524 3.108 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)CC1 ZINC000043137662 1403714899 /nfs/dbraw/zinc/71/48/99/1403714899.db2.gz CWWVEQWYABROPA-HXUWFJFHSA-N 2 1 384.524 3.108 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=S)NCCC[NH+](C)C)cc2)C1 ZINC000044152573 1403888662 /nfs/dbraw/zinc/88/86/62/1403888662.db2.gz OIFULMDQVNENSR-HDICACEKSA-N 2 1 376.614 3.080 20 0 GGADMP C[N@@H+]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)[C@@H](c2ccccc2)C1 ZINC000045029507 1404039395 /nfs/dbraw/zinc/03/93/95/1404039395.db2.gz KLXKAOWKPBZYSL-HSZRJFAPSA-N 2 1 392.547 3.349 20 0 GGADMP C[N@H+]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)[C@@H](c2ccccc2)C1 ZINC000045029507 1404039400 /nfs/dbraw/zinc/03/94/00/1404039400.db2.gz KLXKAOWKPBZYSL-HSZRJFAPSA-N 2 1 392.547 3.349 20 0 GGADMP O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000045182394 1404068852 /nfs/dbraw/zinc/06/88/52/1404068852.db2.gz SHZDYXAEONPEFO-WOJBJXKFSA-N 2 1 390.959 3.230 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000045182258 1404069098 /nfs/dbraw/zinc/06/90/98/1404069098.db2.gz GZAKYJLHJUDQGL-QGZVFWFLSA-N 2 1 392.975 3.336 20 0 GGADMP C[C@H]1CCC[N@@H+](CCNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000045182260 1404069135 /nfs/dbraw/zinc/06/91/35/1404069135.db2.gz GZAKYJLHJUDQGL-KRWDZBQOSA-N 2 1 392.975 3.336 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)CC1 ZINC000045776857 1404201094 /nfs/dbraw/zinc/20/10/94/1404201094.db2.gz CGUIRKIBSXERNE-FGZHOGPDSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)N[C@@H]1CC[NH+]2CCCC[C@H]12 ZINC000045780853 1404202303 /nfs/dbraw/zinc/20/23/03/1404202303.db2.gz FVQPOHJZUIVHRZ-STZQEDGTSA-N 2 1 384.568 3.487 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N[C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000045780853 1404202309 /nfs/dbraw/zinc/20/23/09/1404202309.db2.gz FVQPOHJZUIVHRZ-STZQEDGTSA-N 2 1 384.568 3.487 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000045780853 1404202313 /nfs/dbraw/zinc/20/23/13/1404202313.db2.gz FVQPOHJZUIVHRZ-STZQEDGTSA-N 2 1 384.568 3.487 20 0 GGADMP O=[N+]([O-])c1ccc(-c2ncn(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)n2)cc1 ZINC000045801843 1404208722 /nfs/dbraw/zinc/20/87/22/1404208722.db2.gz FISQDWVXBUCNQB-UHFFFAOYSA-N 2 1 398.511 3.399 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)NCCc1ccc(F)cc1 ZINC000045806427 1404210679 /nfs/dbraw/zinc/21/06/79/1404210679.db2.gz KYWKXNJMAAEIQY-UHFFFAOYSA-N 2 1 375.532 3.072 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)Nc1ccccc1N1CC[NH+](C)CC1 ZINC000045983950 1404263216 /nfs/dbraw/zinc/26/32/16/1404263216.db2.gz QHLHZJLNYPYSDV-IBGZPJMESA-N 2 1 387.572 3.215 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)c1ccsc1 ZINC000046347148 1404377783 /nfs/dbraw/zinc/37/77/83/1404377783.db2.gz LATZFAICJMBYPA-FQEVSTJZSA-N 2 1 386.565 3.268 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)NCc2cccc(C[NH+](C)C)c2)CC1 ZINC000046926594 1404637181 /nfs/dbraw/zinc/63/71/81/1404637181.db2.gz URPMQDBIIFWIFH-UHFFFAOYSA-N 2 1 394.563 3.474 20 0 GGADMP O=C(NCC1([NH+]2CCOCC2)CCCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000047302485 1404795863 /nfs/dbraw/zinc/79/58/63/1404795863.db2.gz QGMZTEXAJMIMFJ-UHFFFAOYSA-N 2 1 399.579 3.050 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000047301916 1404796087 /nfs/dbraw/zinc/79/60/87/1404796087.db2.gz GMMNGELRDSIWLE-HSZRJFAPSA-N 2 1 377.532 3.289 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)C1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000047302488 1404796907 /nfs/dbraw/zinc/79/69/07/1404796907.db2.gz ZVQZYEWGXCQSJJ-JOCHJYFZSA-N 2 1 395.547 3.326 20 0 GGADMP CCN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(NC(C)=O)cc3)cc2)CC1 ZINC000047776059 1404938175 /nfs/dbraw/zinc/93/81/75/1404938175.db2.gz OYZWUIVJKFEDJN-UHFFFAOYSA-N 2 1 380.536 3.072 20 0 GGADMP C[NH+]1CCC(NC(=O)NC[C@@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CC1 ZINC000047886807 1404984627 /nfs/dbraw/zinc/98/46/27/1404984627.db2.gz TVOSVHZSSUSEOU-FQEVSTJZSA-N 2 1 398.576 3.241 20 0 GGADMP C[NH+]1CCC(NC(=O)NC[C@@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CC1 ZINC000047886807 1404984631 /nfs/dbraw/zinc/98/46/31/1404984631.db2.gz TVOSVHZSSUSEOU-FQEVSTJZSA-N 2 1 398.576 3.241 20 0 GGADMP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047950580 1405008417 /nfs/dbraw/zinc/00/84/17/1405008417.db2.gz BFEGPPSERFRGJE-PMACEKPBSA-N 2 1 398.576 3.459 20 0 GGADMP CC[NH+]1CCC(NC(=O)NCc2ccccc2C[N@@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000047978917 1405014979 /nfs/dbraw/zinc/01/49/79/1405014979.db2.gz FLUXGQJXULDAJC-KDURUIRLSA-N 2 1 386.584 3.448 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)NC2CC[NH+](C3CC3)CC2)cc1 ZINC000048394818 1405177062 /nfs/dbraw/zinc/17/70/62/1405177062.db2.gz RFTKCUQZYINACE-SFHVURJKSA-N 2 1 384.568 3.487 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000048394991 1405177387 /nfs/dbraw/zinc/17/73/87/1405177387.db2.gz GXJSNXYSCQCGEI-SFHVURJKSA-N 2 1 384.568 3.487 20 0 GGADMP CN(C)S(=O)(=O)c1cccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000048565354 1405226802 /nfs/dbraw/zinc/22/68/02/1405226802.db2.gz FEUVDRKGKSFVTD-UHFFFAOYSA-N 2 1 393.597 3.025 20 0 GGADMP Cc1ccc(NC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c(OCC[NH+](C)C)c1 ZINC000173475212 1426649154 /nfs/dbraw/zinc/64/91/54/1426649154.db2.gz KALUOHOJHUTKIQ-GOSISDBHSA-N 2 1 376.545 3.274 20 0 GGADMP CCc1ccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)cc1 ZINC000048778055 1405289145 /nfs/dbraw/zinc/28/91/45/1405289145.db2.gz MHAKWCCDALBZSN-UHFFFAOYSA-N 2 1 381.520 3.200 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C[NH+]1CCCCC1 ZINC000050136849 1405497508 /nfs/dbraw/zinc/49/75/08/1405497508.db2.gz HJELRMOUXDIUEF-MOPGFXCFSA-N 2 1 392.613 3.381 20 0 GGADMP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H](O)C[NH+]2CCCC2)cc1 ZINC000051188001 1405740651 /nfs/dbraw/zinc/74/06/51/1405740651.db2.gz KRQYGOYWFIMRFO-HSZRJFAPSA-N 2 1 390.531 3.394 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1 ZINC000176281798 1428219377 /nfs/dbraw/zinc/21/93/77/1428219377.db2.gz MDSVOFJTEUXIBL-OAHLLOKOSA-N 2 1 397.947 3.350 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](CCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1 ZINC000176281798 1428219387 /nfs/dbraw/zinc/21/93/87/1428219387.db2.gz MDSVOFJTEUXIBL-OAHLLOKOSA-N 2 1 397.947 3.350 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1 ZINC000176281798 1428219396 /nfs/dbraw/zinc/21/93/96/1428219396.db2.gz MDSVOFJTEUXIBL-OAHLLOKOSA-N 2 1 397.947 3.350 20 0 GGADMP C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051958898 1405889631 /nfs/dbraw/zinc/88/96/31/1405889631.db2.gz MMFYLIYRGCBFQC-HNNXBMFYSA-N 2 1 399.457 3.077 20 0 GGADMP Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959789 1405889698 /nfs/dbraw/zinc/88/96/98/1405889698.db2.gz FVHWUIWXNFNUBT-MRXNPFEDSA-N 2 1 379.932 3.020 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(C[NH+]2CCOCC2)CC1)c1ccc2ccccc2c1 ZINC000051957008 1405889940 /nfs/dbraw/zinc/88/99/40/1405889940.db2.gz MYJANODLSHZDFW-IBGZPJMESA-N 2 1 395.547 3.061 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000052290409 1406008683 /nfs/dbraw/zinc/00/86/83/1406008683.db2.gz MZNBFMMPTJDXNC-ROUUACIJSA-N 2 1 383.540 3.169 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000052295140 1406011204 /nfs/dbraw/zinc/01/12/04/1406011204.db2.gz OUWMJMDNMXDHQZ-UHFFFAOYSA-N 2 1 383.540 3.455 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000052295140 1406011211 /nfs/dbraw/zinc/01/12/11/1406011211.db2.gz OUWMJMDNMXDHQZ-UHFFFAOYSA-N 2 1 383.540 3.455 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)CC1 ZINC000056786976 1407432450 /nfs/dbraw/zinc/43/24/50/1407432450.db2.gz KWRDQYPZYRSKFI-AZUAARDMSA-N 2 1 386.584 3.379 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCC[N@H+]2CCCC[C@@H]2C)cn1 ZINC000057127252 1407530519 /nfs/dbraw/zinc/53/05/19/1407530519.db2.gz GWGMBOGGXQQLAB-KRWDZBQOSA-N 2 1 384.528 3.030 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)cn1 ZINC000057127252 1407530525 /nfs/dbraw/zinc/53/05/25/1407530525.db2.gz GWGMBOGGXQQLAB-KRWDZBQOSA-N 2 1 384.528 3.030 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000057138946 1407534202 /nfs/dbraw/zinc/53/42/02/1407534202.db2.gz STYWVELYGBGJEE-HSZRJFAPSA-N 2 1 377.532 3.432 20 0 GGADMP C[N@@H+]1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)[C@H](c2ccccc2)C1 ZINC000057140593 1407534584 /nfs/dbraw/zinc/53/45/84/1407534584.db2.gz NFRJCIIWLWDNLR-QHCPKHFHSA-N 2 1 377.532 3.414 20 0 GGADMP C[N@H+]1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)[C@H](c2ccccc2)C1 ZINC000057140593 1407534591 /nfs/dbraw/zinc/53/45/91/1407534591.db2.gz NFRJCIIWLWDNLR-QHCPKHFHSA-N 2 1 377.532 3.414 20 0 GGADMP CC[N@@H+]1CCc2nc(NC(=O)[C@@H]3CCC[NH+](Cc4ccccc4)C3)sc2C1 ZINC000057154267 1407537776 /nfs/dbraw/zinc/53/77/76/1407537776.db2.gz XNROVICZXHSSKM-QGZVFWFLSA-N 2 1 384.549 3.372 20 0 GGADMP CC[N@H+]1CCc2nc(NC(=O)[C@@H]3CCC[NH+](Cc4ccccc4)C3)sc2C1 ZINC000057154267 1407537783 /nfs/dbraw/zinc/53/77/83/1407537783.db2.gz XNROVICZXHSSKM-QGZVFWFLSA-N 2 1 384.549 3.372 20 0 GGADMP CC[NH+]1CCc2nc(NC(=O)[C@@H]3CCC[N@H+](Cc4ccccc4)C3)sc2C1 ZINC000057154267 1407537790 /nfs/dbraw/zinc/53/77/90/1407537790.db2.gz XNROVICZXHSSKM-QGZVFWFLSA-N 2 1 384.549 3.372 20 0 GGADMP CC[NH+]1CCc2nc(NC(=O)[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)sc2C1 ZINC000057154267 1407537795 /nfs/dbraw/zinc/53/77/95/1407537795.db2.gz XNROVICZXHSSKM-QGZVFWFLSA-N 2 1 384.549 3.372 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000057619271 1407669057 /nfs/dbraw/zinc/66/90/57/1407669057.db2.gz SDKIAGJZWUJSSW-UHFFFAOYSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@H](CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)[NH+](C)C1CC1 ZINC000057705827 1407694217 /nfs/dbraw/zinc/69/42/17/1407694217.db2.gz BYLCPESWLKLWGG-DNVCBOLYSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@H](CNC(=O)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)[N@H+](C)C1CC1 ZINC000057705827 1407694231 /nfs/dbraw/zinc/69/42/31/1407694231.db2.gz BYLCPESWLKLWGG-DNVCBOLYSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@H](CNC(=O)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)[N@@H+](C)C1CC1 ZINC000057705827 1407694247 /nfs/dbraw/zinc/69/42/47/1407694247.db2.gz BYLCPESWLKLWGG-DNVCBOLYSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@@H](CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)[NH+](C)C1CC1 ZINC000057705822 1407694987 /nfs/dbraw/zinc/69/49/87/1407694987.db2.gz BYLCPESWLKLWGG-HNAYVOBHSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@@H](CNC(=O)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)[N@H+](C)C1CC1 ZINC000057705822 1407695007 /nfs/dbraw/zinc/69/50/07/1407695007.db2.gz BYLCPESWLKLWGG-HNAYVOBHSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@@H](CNC(=O)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)[N@@H+](C)C1CC1 ZINC000057705822 1407695021 /nfs/dbraw/zinc/69/50/21/1407695021.db2.gz BYLCPESWLKLWGG-HNAYVOBHSA-N 2 1 383.458 3.040 20 0 GGADMP COc1cccc(NC(=O)C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000057843730 1407735808 /nfs/dbraw/zinc/73/58/08/1407735808.db2.gz QHQPFIIQKGFXBK-UHFFFAOYSA-N 2 1 381.520 3.478 20 0 GGADMP COc1cccc(NC(=O)C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000057843730 1407735813 /nfs/dbraw/zinc/73/58/13/1407735813.db2.gz QHQPFIIQKGFXBK-UHFFFAOYSA-N 2 1 381.520 3.478 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)NC(=O)Nc2ccccc2)CC1 ZINC000057843883 1407736010 /nfs/dbraw/zinc/73/60/10/1407736010.db2.gz VDWYATJGTKPSIP-UHFFFAOYSA-N 2 1 394.519 3.179 20 0 GGADMP Cc1ccc(CNC(=O)C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1F ZINC000057888721 1407746342 /nfs/dbraw/zinc/74/63/42/1407746342.db2.gz IXAZIBKREARHDH-UHFFFAOYSA-N 2 1 375.532 3.338 20 0 GGADMP Cc1cccc(OCCNC(=O)C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000057889786 1407747966 /nfs/dbraw/zinc/74/79/66/1407747966.db2.gz QHACWNYPSNQKIL-UHFFFAOYSA-N 2 1 387.568 3.078 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000176367615 1428275396 /nfs/dbraw/zinc/27/53/96/1428275396.db2.gz XVTRVGGPXBLXGD-YADHBBJMSA-N 2 1 384.568 3.441 20 0 GGADMP Cc1ccc(-c2nnc(C[NH+]3CCC(C[NH+]4C[C@H](C)O[C@@H](C)C4)CC3)o2)cc1 ZINC000060368529 1407962597 /nfs/dbraw/zinc/96/25/97/1407962597.db2.gz CGUCZUMNOGDLTI-ROUUACIJSA-N 2 1 384.524 3.366 20 0 GGADMP Cc1cccc(C)c1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000060368446 1407962910 /nfs/dbraw/zinc/96/29/10/1407962910.db2.gz XJFHUCCAIONZNF-AQNXPRMDSA-N 2 1 387.568 3.452 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000060978619 1408059415 /nfs/dbraw/zinc/05/94/15/1408059415.db2.gz XDCWKAAAZRCOLQ-BGYRXZFFSA-N 2 1 387.568 3.145 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000060978619 1408059425 /nfs/dbraw/zinc/05/94/25/1408059425.db2.gz XDCWKAAAZRCOLQ-BGYRXZFFSA-N 2 1 387.568 3.145 20 0 GGADMP C[N@@H+](CCCNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)C1CCCCC1 ZINC000061142105 1408082352 /nfs/dbraw/zinc/08/23/52/1408082352.db2.gz FMNHZIZHLMGCMX-IBGZPJMESA-N 2 1 376.545 3.370 20 0 GGADMP C[N@@H+](CCCNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)Cc1ccccc1 ZINC000061142092 1408082633 /nfs/dbraw/zinc/08/26/33/1408082633.db2.gz NNKVLXDVANLWEC-HXUWFJFHSA-N 2 1 384.524 3.238 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H](c1cccc(F)c1)[NH+](C)C)[N@H+]1CCc2ccccc2C1 ZINC000061221095 1408092162 /nfs/dbraw/zinc/09/21/62/1408092162.db2.gz NXPXSBYTWIQZES-JTSKRJEESA-N 2 1 398.526 3.174 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000061220862 1408092285 /nfs/dbraw/zinc/09/22/85/1408092285.db2.gz IIDVXTRRHUEORV-YADHBBJMSA-N 2 1 398.526 3.392 20 0 GGADMP C[N@@H+](CCCNC(=O)NCCC[NH+]1CCc2ccccc2C1)Cc1ccccc1 ZINC000061501191 1408137893 /nfs/dbraw/zinc/13/78/93/1408137893.db2.gz IVTLXEZXILTKPN-UHFFFAOYSA-N 2 1 394.563 3.256 20 0 GGADMP C[NH+](CCCNC(=O)NCCC[N@@H+]1CCc2ccccc2C1)Cc1ccccc1 ZINC000061501191 1408137901 /nfs/dbraw/zinc/13/79/01/1408137901.db2.gz IVTLXEZXILTKPN-UHFFFAOYSA-N 2 1 394.563 3.256 20 0 GGADMP C[NH+](CCCNC(=O)NCCC[N@H+]1CCc2ccccc2C1)Cc1ccccc1 ZINC000061501191 1408137908 /nfs/dbraw/zinc/13/79/08/1408137908.db2.gz IVTLXEZXILTKPN-UHFFFAOYSA-N 2 1 394.563 3.256 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)NCC1(c2ccccc2)CC1 ZINC000061735403 1408167025 /nfs/dbraw/zinc/16/70/25/1408167025.db2.gz FECJAZNUNBHATN-UHFFFAOYSA-N 2 1 383.580 3.422 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000061789484 1408176747 /nfs/dbraw/zinc/17/67/47/1408176747.db2.gz ZDPCQTOPTJMPTK-UHFFFAOYSA-N 2 1 390.597 3.477 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000061957201 1408193279 /nfs/dbraw/zinc/19/32/79/1408193279.db2.gz BNPIVIZKLLFCHV-UXHICEINSA-N 2 1 386.565 3.315 20 0 GGADMP Cn1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000062426487 1408256503 /nfs/dbraw/zinc/25/65/03/1408256503.db2.gz QRSNRCIVOSWGTO-HXUWFJFHSA-N 2 1 375.520 3.484 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000062426977 1408257160 /nfs/dbraw/zinc/25/71/60/1408257160.db2.gz XXAGOLKDRYJPPN-KRWDZBQOSA-N 2 1 384.524 3.068 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(CC[NH+](C)C)Cc2cccs2)[nH+]c1 ZINC000176406855 1428306165 /nfs/dbraw/zinc/30/61/65/1428306165.db2.gz OTJNLLTYTLJPKT-UHFFFAOYSA-N 2 1 375.542 3.027 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=S)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000063150849 1408310181 /nfs/dbraw/zinc/31/01/81/1408310181.db2.gz IWALCJUMRMAURU-OALUTQOASA-N 2 1 388.625 3.236 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NC2CC[NH+](CC3CCCC3)CC2)C1 ZINC000063407937 1408349994 /nfs/dbraw/zinc/34/99/94/1408349994.db2.gz JMVMGIRSDHNPJU-KDURUIRLSA-N 2 1 378.605 3.308 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=S)NC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000063566943 1408372930 /nfs/dbraw/zinc/37/29/30/1408372930.db2.gz YHOPSFGGADBRNH-UHFFFAOYSA-N 2 1 388.625 3.332 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N(CC[NH+](C)C)C2CCCC2)cc1)[NH+]1CCOCC1 ZINC000176419772 1428313436 /nfs/dbraw/zinc/31/34/36/1428313436.db2.gz XIFIFASUVFOCJE-SFHVURJKSA-N 2 1 388.556 3.418 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)cc1 ZINC000063728058 1408397952 /nfs/dbraw/zinc/39/79/52/1408397952.db2.gz QLJKGNDLTJIKTI-UHFFFAOYSA-N 2 1 375.557 3.354 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](C)C[C@H]2c2ccccc2)c1 ZINC000064229747 1408515459 /nfs/dbraw/zinc/51/54/59/1408515459.db2.gz SQYROTMAFURCFT-QFIPXVFZSA-N 2 1 380.536 3.337 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](C)C[C@H]2c2ccccc2)c1 ZINC000064229747 1408515467 /nfs/dbraw/zinc/51/54/67/1408515467.db2.gz SQYROTMAFURCFT-QFIPXVFZSA-N 2 1 380.536 3.337 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)c1 ZINC000064229747 1408515473 /nfs/dbraw/zinc/51/54/73/1408515473.db2.gz SQYROTMAFURCFT-QFIPXVFZSA-N 2 1 380.536 3.337 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)c1 ZINC000064229747 1408515488 /nfs/dbraw/zinc/51/54/88/1408515488.db2.gz SQYROTMAFURCFT-QFIPXVFZSA-N 2 1 380.536 3.337 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000064237828 1408519592 /nfs/dbraw/zinc/51/95/92/1408519592.db2.gz QAFJQYUXKHTZOO-UHFFFAOYSA-N 2 1 383.540 3.457 20 0 GGADMP Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000064344389 1408537824 /nfs/dbraw/zinc/53/78/24/1408537824.db2.gz ZSRGTKLIZLKEIE-QGZVFWFLSA-N 2 1 393.959 3.410 20 0 GGADMP CC1CC[NH+](CCCNC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000064644511 1408590219 /nfs/dbraw/zinc/59/02/19/1408590219.db2.gz BTBVVVOEVUJKQB-LJQANCHMSA-N 2 1 392.613 3.381 20 0 GGADMP CN1CC[NH+](Cc2ccc(C(=O)Nc3cccc(C[NH+]4CCCC4)c3)cc2)CC1 ZINC000065055129 1408640318 /nfs/dbraw/zinc/64/03/18/1408640318.db2.gz GYUBPNCXFQYVLQ-UHFFFAOYSA-N 2 1 392.547 3.282 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000065441686 1408670035 /nfs/dbraw/zinc/67/00/35/1408670035.db2.gz RLGFJZKHPMTPRZ-JOCHJYFZSA-N 2 1 386.584 3.448 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)[NH+]1CCC(C)CC1 ZINC000065477281 1408675426 /nfs/dbraw/zinc/67/54/26/1408675426.db2.gz DARUUSPNEPPRMF-LJQANCHMSA-N 2 1 390.547 3.163 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)[NH+]1CCC(C)CC1 ZINC000065477281 1408675429 /nfs/dbraw/zinc/67/54/29/1408675429.db2.gz DARUUSPNEPPRMF-LJQANCHMSA-N 2 1 390.547 3.163 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000065519132 1408682989 /nfs/dbraw/zinc/68/29/89/1408682989.db2.gz FSUQGNHMQBSCDJ-YADHBBJMSA-N 2 1 384.568 3.168 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000065518613 1408683193 /nfs/dbraw/zinc/68/31/93/1408683193.db2.gz NBMMWFMAZFQCGL-VQTJNVASSA-N 2 1 384.524 3.094 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000065518613 1408683199 /nfs/dbraw/zinc/68/31/99/1408683199.db2.gz NBMMWFMAZFQCGL-VQTJNVASSA-N 2 1 384.524 3.094 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)C1 ZINC000065526984 1408684620 /nfs/dbraw/zinc/68/46/20/1408684620.db2.gz GNUNZSFCMCEYLS-JZXOWHBKSA-N 2 1 380.602 3.407 20 0 GGADMP Cc1ccc(C[NH+]2CCCN(C(=O)NCC[N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000065541814 1408686630 /nfs/dbraw/zinc/68/66/30/1408686630.db2.gz JNDVPGKSNUUBCO-UHFFFAOYSA-N 2 1 394.563 3.344 20 0 GGADMP Cc1ccc(C[N@H+]2CCCN(C(=O)NCC[NH+](C)Cc3ccccc3)CC2)cc1 ZINC000065541814 1408686633 /nfs/dbraw/zinc/68/66/33/1408686633.db2.gz JNDVPGKSNUUBCO-UHFFFAOYSA-N 2 1 394.563 3.344 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)NCC[NH+](C)Cc3ccccc3)CC2)cc1 ZINC000065541814 1408686637 /nfs/dbraw/zinc/68/66/37/1408686637.db2.gz JNDVPGKSNUUBCO-UHFFFAOYSA-N 2 1 394.563 3.344 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)c1 ZINC000065866310 1408744453 /nfs/dbraw/zinc/74/44/53/1408744453.db2.gz AZKNNCCYLWGVQH-OAQYLSRUSA-N 2 1 383.511 3.416 20 0 GGADMP C[NH+](C)[C@H](C(=O)Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1ccccc1 ZINC000066051810 1408779207 /nfs/dbraw/zinc/77/92/07/1408779207.db2.gz HIDSUPOAYDMBKA-QHCPKHFHSA-N 2 1 392.547 3.460 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000066243808 1408795149 /nfs/dbraw/zinc/79/51/49/1408795149.db2.gz JBSITVVZKKMFFY-NRFANRHFSA-N 2 1 380.536 3.264 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000066395425 1408830212 /nfs/dbraw/zinc/83/02/12/1408830212.db2.gz VUSGQSGITOZEGF-OALUTQOASA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000066395423 1408830288 /nfs/dbraw/zinc/83/02/88/1408830288.db2.gz VUSGQSGITOZEGF-KDURUIRLSA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000066395423 1408830289 /nfs/dbraw/zinc/83/02/89/1408830289.db2.gz VUSGQSGITOZEGF-KDURUIRLSA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccccc3C(F)(F)F)CC2)CC1 ZINC000066568269 1408858464 /nfs/dbraw/zinc/85/84/64/1408858464.db2.gz ADIHKINPGIDSTO-UHFFFAOYSA-N 2 1 397.485 3.472 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(OC(F)F)cc3)CC2)CC1 ZINC000066568146 1408858544 /nfs/dbraw/zinc/85/85/44/1408858544.db2.gz HRQKLHVYMOHIAX-UHFFFAOYSA-N 2 1 395.494 3.054 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](CCCOc3ccccc3C)CC2)CC1 ZINC000066568203 1408858650 /nfs/dbraw/zinc/85/86/50/1408858650.db2.gz ZCXJQVVNIGMYLN-UHFFFAOYSA-N 2 1 387.568 3.030 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccccc3OC(C)C)CC2)CC1 ZINC000066568371 1408859110 /nfs/dbraw/zinc/85/91/10/1408859110.db2.gz JLUBKAFCYOGYKX-UHFFFAOYSA-N 2 1 387.568 3.240 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cccc4cccnc43)CC2)CC1 ZINC000066568390 1408859205 /nfs/dbraw/zinc/85/92/05/1408859205.db2.gz GAHRTCRCMFDZQD-UHFFFAOYSA-N 2 1 380.536 3.001 20 0 GGADMP C[NH+](CC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1)Cc1ccccc1 ZINC000066675651 1408882143 /nfs/dbraw/zinc/88/21/43/1408882143.db2.gz PTCKKTASOGMGTG-UHFFFAOYSA-N 2 1 379.548 3.489 20 0 GGADMP C[NH+](CC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1)Cc1ccccc1 ZINC000066675651 1408882144 /nfs/dbraw/zinc/88/21/44/1408882144.db2.gz PTCKKTASOGMGTG-UHFFFAOYSA-N 2 1 379.548 3.489 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)C[N@H+](C)Cc2ccccc2)CC1 ZINC000066675651 1408882148 /nfs/dbraw/zinc/88/21/48/1408882148.db2.gz PTCKKTASOGMGTG-UHFFFAOYSA-N 2 1 379.548 3.489 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000066675651 1408882151 /nfs/dbraw/zinc/88/21/51/1408882151.db2.gz PTCKKTASOGMGTG-UHFFFAOYSA-N 2 1 379.548 3.489 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CN2C(=O)CC3(CCCC3)C2=O)CC1 ZINC000066793828 1408915904 /nfs/dbraw/zinc/91/59/04/1408915904.db2.gz UQCFRDRXBKRLSO-UHFFFAOYSA-N 2 1 383.536 3.107 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CN2C(=O)CC3(CCCC3)C2=O)CC1 ZINC000066793828 1408915909 /nfs/dbraw/zinc/91/59/09/1408915909.db2.gz UQCFRDRXBKRLSO-UHFFFAOYSA-N 2 1 383.536 3.107 20 0 GGADMP CC[N@H+]1CCCC[C@H]1C(=O)Nc1cccc(NC(=O)CC[NH+]2CCCCC2)c1 ZINC000066840413 1408926078 /nfs/dbraw/zinc/92/60/78/1408926078.db2.gz VNRKAUPKZALRRH-FQEVSTJZSA-N 2 1 386.540 3.314 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc(OC)cc2OC)CC1 ZINC000066960722 1408963860 /nfs/dbraw/zinc/96/38/60/1408963860.db2.gz FVWNKTBAEQQIFX-QGZVFWFLSA-N 2 1 391.556 3.475 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc(OC)cc2OC)CC1 ZINC000066960722 1408963864 /nfs/dbraw/zinc/96/38/64/1408963864.db2.gz FVWNKTBAEQQIFX-QGZVFWFLSA-N 2 1 391.556 3.475 20 0 GGADMP Cn1c2ccccc2nc1C[NH2+]CCCCN1CC[NH+](Cc2ccccc2)CC1 ZINC000066973421 1408969480 /nfs/dbraw/zinc/96/94/80/1408969480.db2.gz DPIJYZZSYBDHLF-UHFFFAOYSA-N 2 1 391.563 3.261 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@@H](C[NH+]3CCCC3)C2)cc1)[NH+]1CCOCC1 ZINC000176561801 1428364208 /nfs/dbraw/zinc/36/42/08/1428364208.db2.gz IWQHEUHTBQEAAA-MOPGFXCFSA-N 2 1 386.540 3.029 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000067064931 1408997759 /nfs/dbraw/zinc/99/77/59/1408997759.db2.gz NJMRGYXLOLMUQT-UHFFFAOYSA-N 2 1 382.552 3.412 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)N[C@@H]2CC[NH+]3CCCC[C@H]23)CC1 ZINC000067391756 1409099055 /nfs/dbraw/zinc/09/90/55/1409099055.db2.gz NXDAKQCSBNQPOI-FGZHOGPDSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)N[C@@H]2CC[N@@H+]3CCCC[C@H]23)CC1 ZINC000067391756 1409099063 /nfs/dbraw/zinc/09/90/63/1409099063.db2.gz NXDAKQCSBNQPOI-FGZHOGPDSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)CC1 ZINC000067391756 1409099068 /nfs/dbraw/zinc/09/90/68/1409099068.db2.gz NXDAKQCSBNQPOI-FGZHOGPDSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](C)[C@H]1CCC[C@H](NC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1 ZINC000176604363 1428377627 /nfs/dbraw/zinc/37/76/27/1428377627.db2.gz KCEMIARGGBNCRE-VXKWHMMOSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCc2cccc(C[NH+](C)C)c2)cc1F ZINC000067646624 1409196931 /nfs/dbraw/zinc/19/69/31/1409196931.db2.gz XRGBJJOAPJEKSD-UHFFFAOYSA-N 2 1 395.482 3.381 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000067658388 1409199551 /nfs/dbraw/zinc/19/95/51/1409199551.db2.gz ZRPOMNSQALIKGD-HSZRJFAPSA-N 2 1 392.547 3.350 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000067686507 1409207110 /nfs/dbraw/zinc/20/71/10/1409207110.db2.gz WSDHHDABRSGFPJ-SFHVURJKSA-N 2 1 392.975 3.334 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000067735113 1409217018 /nfs/dbraw/zinc/21/70/18/1409217018.db2.gz NBMMWFMAZFQCGL-PMACEKPBSA-N 2 1 384.524 3.094 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000067735113 1409217023 /nfs/dbraw/zinc/21/70/23/1409217023.db2.gz NBMMWFMAZFQCGL-PMACEKPBSA-N 2 1 384.524 3.094 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](C2CCCC2)CC1 ZINC000067734554 1409217064 /nfs/dbraw/zinc/21/70/64/1409217064.db2.gz RGBBJRIICMHQPQ-OAQYLSRUSA-N 2 1 384.568 3.168 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CCCC[NH+]1CC ZINC000176628506 1428384004 /nfs/dbraw/zinc/38/40/04/1428384004.db2.gz BGAHIBQDHQARIK-YADHBBJMSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CCCC[N@@H+]1CC ZINC000176628506 1428384010 /nfs/dbraw/zinc/38/40/10/1428384010.db2.gz BGAHIBQDHQARIK-YADHBBJMSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CCCC[N@H+]1CC ZINC000176628506 1428384015 /nfs/dbraw/zinc/38/40/15/1428384015.db2.gz BGAHIBQDHQARIK-YADHBBJMSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3cnn(-c4ccccc4)c3)c2)CCO1 ZINC000067976580 1409267682 /nfs/dbraw/zinc/26/76/82/1409267682.db2.gz SEMWEWBCDZDHPO-LJQANCHMSA-N 2 1 376.504 3.383 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3cnn(-c4ccccc4)c3)c2)CCO1 ZINC000067976580 1409267691 /nfs/dbraw/zinc/26/76/91/1409267691.db2.gz SEMWEWBCDZDHPO-LJQANCHMSA-N 2 1 376.504 3.383 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCCC[NH+]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC000068007622 1409275094 /nfs/dbraw/zinc/27/50/94/1409275094.db2.gz XCQBPNANXJZVIR-AQNXPRMDSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCCC[NH+]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC000068007622 1409275098 /nfs/dbraw/zinc/27/50/98/1409275098.db2.gz XCQBPNANXJZVIR-AQNXPRMDSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCCC[N@@H+]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC000068007622 1409275101 /nfs/dbraw/zinc/27/51/01/1409275101.db2.gz XCQBPNANXJZVIR-AQNXPRMDSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCCC[N@H+]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC000068007622 1409275103 /nfs/dbraw/zinc/27/51/03/1409275103.db2.gz XCQBPNANXJZVIR-AQNXPRMDSA-N 2 1 387.568 3.290 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000068256467 1409342264 /nfs/dbraw/zinc/34/22/64/1409342264.db2.gz FBNQSYLEYRTEGV-LJQANCHMSA-N 2 1 375.532 3.274 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@@H](C)C[N@H+]3C[C@H](C)C[C@H](C)C3)CC2)cs1 ZINC000068306211 1409358889 /nfs/dbraw/zinc/35/88/89/1409358889.db2.gz NFVXDYHZIAYQQR-BBWFWOEESA-N 2 1 392.613 3.146 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@@H](C)C[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)cs1 ZINC000068306211 1409358892 /nfs/dbraw/zinc/35/88/92/1409358892.db2.gz NFVXDYHZIAYQQR-BBWFWOEESA-N 2 1 392.613 3.146 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NCC[NH+]2Cc3ccccc3C2)CC1 ZINC000068408380 1409394070 /nfs/dbraw/zinc/39/40/70/1409394070.db2.gz OEBCEHYMCLDFFF-UHFFFAOYSA-N 2 1 392.547 3.274 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000068442985 1409404688 /nfs/dbraw/zinc/40/46/88/1409404688.db2.gz JCFQJBBGBMXXMA-KDURUIRLSA-N 2 1 387.568 3.290 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000068442985 1409404692 /nfs/dbraw/zinc/40/46/92/1409404692.db2.gz JCFQJBBGBMXXMA-KDURUIRLSA-N 2 1 387.568 3.290 20 0 GGADMP C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000068565325 1409440025 /nfs/dbraw/zinc/44/00/25/1409440025.db2.gz NHGSURWXZCLWSF-GOSISDBHSA-N 2 1 392.931 3.309 20 0 GGADMP C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000068584954 1409445683 /nfs/dbraw/zinc/44/56/83/1409445683.db2.gz ZSLYOZZIYCUYAE-RBUKOAKNSA-N 2 1 378.948 3.040 20 0 GGADMP O=C(NCC[NH+]1Cc2ccccc2C1)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000068636510 1409452884 /nfs/dbraw/zinc/45/28/84/1409452884.db2.gz IZRGXKVQIPIAPK-UHFFFAOYSA-N 2 1 378.520 3.097 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)CC1 ZINC000068777512 1409490502 /nfs/dbraw/zinc/49/05/02/1409490502.db2.gz ROFYLXWJZUZLSZ-HXUWFJFHSA-N 2 1 397.485 3.384 20 0 GGADMP CC(C)[NH+]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000068777512 1409490506 /nfs/dbraw/zinc/49/05/06/1409490506.db2.gz ROFYLXWJZUZLSZ-HXUWFJFHSA-N 2 1 397.485 3.384 20 0 GGADMP CC(C)[NH+]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000068777512 1409490508 /nfs/dbraw/zinc/49/05/08/1409490508.db2.gz ROFYLXWJZUZLSZ-HXUWFJFHSA-N 2 1 397.485 3.384 20 0 GGADMP CSc1ccc(NC(=O)C[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000069017044 1409544468 /nfs/dbraw/zinc/54/44/68/1409544468.db2.gz SLKGMRWCFPYEKY-IRXDYDNUSA-N 2 1 391.581 3.168 20 0 GGADMP Fc1ccc(-n2nc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)c3c2CCC3)cc1 ZINC000069027862 1409546748 /nfs/dbraw/zinc/54/67/48/1409546748.db2.gz UAUHGQBPXLEIJU-UHFFFAOYSA-N 2 1 398.526 3.044 20 0 GGADMP C[C@H](C(=O)N[C@@H](C)c1cc2ccccc2o1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069028970 1409546859 /nfs/dbraw/zinc/54/68/59/1409546859.db2.gz NCQWAGCNSOGEFK-ZWKOTPCHSA-N 2 1 399.535 3.043 20 0 GGADMP C[C@@H](C(=O)Nc1ccc2ccccc2c1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069030305 1409547464 /nfs/dbraw/zinc/54/74/64/1409547464.db2.gz SBRXFQPYLVVEND-SFHVURJKSA-N 2 1 381.520 3.211 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCOCC2)CC1)Nc1ccccc1-c1ccccc1 ZINC000069029673 1409547674 /nfs/dbraw/zinc/54/76/74/1409547674.db2.gz RHFLDGKGHGOSGB-UHFFFAOYSA-N 2 1 393.531 3.336 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000069045511 1409552589 /nfs/dbraw/zinc/55/25/89/1409552589.db2.gz XKMVKCYGBWNWNX-VQTJNVASSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)C1 ZINC000069045511 1409552591 /nfs/dbraw/zinc/55/25/91/1409552591.db2.gz XKMVKCYGBWNWNX-VQTJNVASSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000069045511 1409552593 /nfs/dbraw/zinc/55/25/93/1409552593.db2.gz XKMVKCYGBWNWNX-VQTJNVASSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC1 ZINC000069047619 1409553526 /nfs/dbraw/zinc/55/35/26/1409553526.db2.gz DEKAPLITTMRABB-IBGZPJMESA-N 2 1 375.532 3.371 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)[C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)CC1 ZINC000069047619 1409553530 /nfs/dbraw/zinc/55/35/30/1409553530.db2.gz DEKAPLITTMRABB-IBGZPJMESA-N 2 1 375.532 3.371 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000069047619 1409553538 /nfs/dbraw/zinc/55/35/38/1409553538.db2.gz DEKAPLITTMRABB-IBGZPJMESA-N 2 1 375.532 3.371 20 0 GGADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000069160324 1409577366 /nfs/dbraw/zinc/57/73/66/1409577366.db2.gz TXGIONQAEIIAKE-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000069160324 1409577374 /nfs/dbraw/zinc/57/73/74/1409577374.db2.gz TXGIONQAEIIAKE-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000069160368 1409577451 /nfs/dbraw/zinc/57/74/51/1409577451.db2.gz GEWJLUSXUQVZNH-KRWDZBQOSA-N 2 1 384.524 3.070 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000069732906 1409686162 /nfs/dbraw/zinc/68/61/62/1409686162.db2.gz ZLYGFTCSNVHUFF-UHFFFAOYSA-N 2 1 392.975 3.430 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)NCC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000069821960 1409707887 /nfs/dbraw/zinc/70/78/87/1409707887.db2.gz XUZLMSPQFZUUOD-UHFFFAOYSA-N 2 1 378.586 3.086 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000072036124 1409839614 /nfs/dbraw/zinc/83/96/14/1409839614.db2.gz YALKYBVVHIAENC-HXUWFJFHSA-N 2 1 386.584 3.462 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)[NH+](C)C)cc1 ZINC000072044330 1409840667 /nfs/dbraw/zinc/84/06/67/1409840667.db2.gz YCVHFEZESHIABU-FGZHOGPDSA-N 2 1 380.536 3.296 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)[NH+](C)C)cc1 ZINC000072044330 1409840668 /nfs/dbraw/zinc/84/06/68/1409840668.db2.gz YCVHFEZESHIABU-FGZHOGPDSA-N 2 1 380.536 3.296 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[NH+](CCc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000072044293 1409840855 /nfs/dbraw/zinc/84/08/55/1409840855.db2.gz HQQSWGCWRUSSRI-QHCPKHFHSA-N 2 1 394.563 3.168 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(Cl)cc2)CC1 ZINC000072694680 1409852433 /nfs/dbraw/zinc/85/24/33/1409852433.db2.gz NLDQWHMPQVGXBO-INIZCTEOSA-N 2 1 381.948 3.490 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000072731600 1409852991 /nfs/dbraw/zinc/85/29/91/1409852991.db2.gz VQMGFALCVRFATA-NRFANRHFSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCCC[NH+]1CCCCC1 ZINC000073536471 1409862003 /nfs/dbraw/zinc/86/20/03/1409862003.db2.gz JXGZGGIVGYVPPI-QFIPXVFZSA-N 2 1 386.584 3.416 20 0 GGADMP CC(C)[N@H+](C)Cc1cccc(CNC(=O)[C@H]2CCC[NH+]2Cc2ccccn2)c1 ZINC000073549367 1409862550 /nfs/dbraw/zinc/86/25/50/1409862550.db2.gz IENOZOPOIJUOIP-JOCHJYFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(CNC(=O)[C@H]2CCC[NH+]2Cc2ccccn2)c1 ZINC000073549367 1409862554 /nfs/dbraw/zinc/86/25/54/1409862554.db2.gz IENOZOPOIJUOIP-JOCHJYFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[NH+](C)Cc1cccc(CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccccn2)c1 ZINC000073549367 1409862557 /nfs/dbraw/zinc/86/25/57/1409862557.db2.gz IENOZOPOIJUOIP-JOCHJYFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[NH+](C)Cc1cccc(CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccn2)c1 ZINC000073549367 1409862558 /nfs/dbraw/zinc/86/25/58/1409862558.db2.gz IENOZOPOIJUOIP-JOCHJYFZSA-N 2 1 380.536 3.203 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)CC1 ZINC000073620017 1409863191 /nfs/dbraw/zinc/86/31/91/1409863191.db2.gz YSAZSLMUYBRURE-JOCHJYFZSA-N 2 1 386.584 3.475 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)CC1 ZINC000073675814 1409864315 /nfs/dbraw/zinc/86/43/15/1409864315.db2.gz SKXZJLCIQQMONE-JOCHJYFZSA-N 2 1 386.584 3.414 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCC(C)(C)[NH+]2CCc3ccccc3C2)C1 ZINC000073722102 1409864625 /nfs/dbraw/zinc/86/46/25/1409864625.db2.gz IFLDEXKAFDSPLK-LJQANCHMSA-N 2 1 386.584 3.197 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NCC(C)(C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000073722102 1409864626 /nfs/dbraw/zinc/86/46/26/1409864626.db2.gz IFLDEXKAFDSPLK-LJQANCHMSA-N 2 1 386.584 3.197 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)C1 ZINC000073722102 1409864628 /nfs/dbraw/zinc/86/46/28/1409864628.db2.gz IFLDEXKAFDSPLK-LJQANCHMSA-N 2 1 386.584 3.197 20 0 GGADMP C[C@H](CNC(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C)[NH+]1CCc2sccc2C1 ZINC000073725379 1409864790 /nfs/dbraw/zinc/86/47/90/1409864790.db2.gz HTYHSMWMOCQRKM-AEFFLSMTSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@H](CNC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C)[NH+]1CCc2sccc2C1 ZINC000073725379 1409864791 /nfs/dbraw/zinc/86/47/91/1409864791.db2.gz HTYHSMWMOCQRKM-AEFFLSMTSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@H](CNC(=O)N(C)CC[C@@H]1CCCC[NH+]1C)[N@@H+]1CCc2sccc2C1 ZINC000073725379 1409864793 /nfs/dbraw/zinc/86/47/93/1409864793.db2.gz HTYHSMWMOCQRKM-AEFFLSMTSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@H](CNC(=O)N(C)CC[C@@H]1CCCC[NH+]1C)[N@H+]1CCc2sccc2C1 ZINC000073725379 1409864796 /nfs/dbraw/zinc/86/47/96/1409864796.db2.gz HTYHSMWMOCQRKM-AEFFLSMTSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C[NH+]1CCCCC1 ZINC000073788444 1409865680 /nfs/dbraw/zinc/86/56/80/1409865680.db2.gz PCKODLNPXHAYAN-IFMALSPDSA-N 2 1 386.584 3.272 20 0 GGADMP C/C=C/c1ccc(OC[C@@H](O)C[N@H+](C)C2CC[NH+](C(C)C)CC2)c(OC)c1 ZINC000073895206 1409866891 /nfs/dbraw/zinc/86/68/91/1409866891.db2.gz VSIREMJOPCXSJD-YJJPMGAVSA-N 2 1 376.541 3.273 20 0 GGADMP C/C=C/c1ccc(OC[C@@H](O)C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c(OC)c1 ZINC000073895206 1409866894 /nfs/dbraw/zinc/86/68/94/1409866894.db2.gz VSIREMJOPCXSJD-YJJPMGAVSA-N 2 1 376.541 3.273 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000073903372 1409867230 /nfs/dbraw/zinc/86/72/30/1409867230.db2.gz VVFBAXRLRFNGEK-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000073903372 1409867231 /nfs/dbraw/zinc/86/72/31/1409867231.db2.gz VVFBAXRLRFNGEK-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000073903372 1409867232 /nfs/dbraw/zinc/86/72/32/1409867232.db2.gz VVFBAXRLRFNGEK-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)[NH+]2CCCC2)o1 ZINC000073981036 1409868123 /nfs/dbraw/zinc/86/81/23/1409868123.db2.gz DVPYZLUPUNHYJL-MOPGFXCFSA-N 2 1 376.545 3.241 20 0 GGADMP CC(C)C[C@H](CNC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)[NH+](C)C ZINC000074137051 1409869511 /nfs/dbraw/zinc/86/95/11/1409869511.db2.gz AHFUYKSITHKVIJ-DBXWQHBBSA-N 2 1 375.557 3.002 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000074533683 1409873498 /nfs/dbraw/zinc/87/34/98/1409873498.db2.gz KEVGMETXLRVZNQ-ICSRJNTNSA-N 2 1 375.561 3.268 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000074533683 1409873501 /nfs/dbraw/zinc/87/35/01/1409873501.db2.gz KEVGMETXLRVZNQ-ICSRJNTNSA-N 2 1 375.561 3.268 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000074847147 1409877024 /nfs/dbraw/zinc/87/70/24/1409877024.db2.gz DAAQYQYPDPWZJE-JOCHJYFZSA-N 2 1 386.584 3.413 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000074845294 1409877206 /nfs/dbraw/zinc/87/72/06/1409877206.db2.gz DTWWRGRQYJXMHG-FQEVSTJZSA-N 2 1 384.568 3.156 20 0 GGADMP CCc1ccc([C@@H](CNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)[NH+](C)C)cc1 ZINC000074833173 1409877282 /nfs/dbraw/zinc/87/72/82/1409877282.db2.gz GMTJJQWYKGQYOL-IFMALSPDSA-N 2 1 386.584 3.225 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000074849378 1409877495 /nfs/dbraw/zinc/87/74/95/1409877495.db2.gz CAVYMQKNQDFQLQ-JOCHJYFZSA-N 2 1 384.568 3.156 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)N[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000074854475 1409877530 /nfs/dbraw/zinc/87/75/30/1409877530.db2.gz UELBUIZLSVYVSI-FCHUYYIVSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CCN(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000074854475 1409877532 /nfs/dbraw/zinc/87/75/32/1409877532.db2.gz UELBUIZLSVYVSI-FCHUYYIVSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000074854475 1409877533 /nfs/dbraw/zinc/87/75/33/1409877533.db2.gz UELBUIZLSVYVSI-FCHUYYIVSA-N 2 1 384.568 3.024 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)N[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000074854478 1409877605 /nfs/dbraw/zinc/87/76/05/1409877605.db2.gz UELBUIZLSVYVSI-FGZHOGPDSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CCN(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000074854478 1409877606 /nfs/dbraw/zinc/87/76/06/1409877606.db2.gz UELBUIZLSVYVSI-FGZHOGPDSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000074854478 1409877609 /nfs/dbraw/zinc/87/76/09/1409877609.db2.gz UELBUIZLSVYVSI-FGZHOGPDSA-N 2 1 384.568 3.024 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2ccc(C)c(F)c2)CC1 ZINC000075007556 1409879958 /nfs/dbraw/zinc/87/99/58/1409879958.db2.gz VDIFPYUPEMHXBP-QGZVFWFLSA-N 2 1 379.520 3.284 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(C)c2C)CC1 ZINC000075007732 1409880089 /nfs/dbraw/zinc/88/00/89/1409880089.db2.gz FSMKUBUEIBCNGP-IBGZPJMESA-N 2 1 375.557 3.453 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)N2CCC[NH+]3CCC[C@@H]3C2)cc1 ZINC000077763970 1409899764 /nfs/dbraw/zinc/89/97/64/1409899764.db2.gz ORKBTUQTXDBAPG-DENIHFKCSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N2CCC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000077763970 1409899768 /nfs/dbraw/zinc/89/97/68/1409899768.db2.gz ORKBTUQTXDBAPG-DENIHFKCSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000077763970 1409899769 /nfs/dbraw/zinc/89/97/69/1409899769.db2.gz ORKBTUQTXDBAPG-DENIHFKCSA-N 2 1 384.568 3.441 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000077811148 1409901909 /nfs/dbraw/zinc/90/19/09/1409901909.db2.gz UNAPDHMOCNOJBK-IRLDBZIGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000077811148 1409901916 /nfs/dbraw/zinc/90/19/16/1409901916.db2.gz UNAPDHMOCNOJBK-IRLDBZIGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000077811148 1409901923 /nfs/dbraw/zinc/90/19/23/1409901923.db2.gz UNAPDHMOCNOJBK-IRLDBZIGSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc(C)cc2OCC[NH+](C)C)C1 ZINC000078611478 1409929993 /nfs/dbraw/zinc/92/99/93/1409929993.db2.gz FCODQFQJESUMSZ-SFHVURJKSA-N 2 1 376.545 3.131 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)NCc2ccc(C[NH+](C)C)cc2)CC1 ZINC000079135999 1409961296 /nfs/dbraw/zinc/96/12/96/1409961296.db2.gz YPPREPIPKSOROT-UHFFFAOYSA-N 2 1 380.536 3.084 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)N2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC000079394072 1409973561 /nfs/dbraw/zinc/97/35/61/1409973561.db2.gz WHJWSXIDGVBIHE-NRFANRHFSA-N 2 1 386.584 3.416 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)N2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC000079394072 1409973577 /nfs/dbraw/zinc/97/35/77/1409973577.db2.gz WHJWSXIDGVBIHE-NRFANRHFSA-N 2 1 386.584 3.416 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC000079394072 1409973587 /nfs/dbraw/zinc/97/35/87/1409973587.db2.gz WHJWSXIDGVBIHE-NRFANRHFSA-N 2 1 386.584 3.416 20 0 GGADMP CC(C)(CNC(=O)N1CCC([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079493580 1409978590 /nfs/dbraw/zinc/97/85/90/1409978590.db2.gz OWFUPBYGVDQHNG-UHFFFAOYSA-N 2 1 384.568 3.093 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@H](c2cccc(F)c2)[NH+](C)C)CC1 ZINC000079572645 1409982969 /nfs/dbraw/zinc/98/29/69/1409982969.db2.gz BFCGYZOPVQRYEK-HXUWFJFHSA-N 2 1 378.536 3.190 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)CC1 ZINC000079652125 1409986087 /nfs/dbraw/zinc/98/60/87/1409986087.db2.gz QLUDQKWJUTWEIF-HXUWFJFHSA-N 2 1 378.536 3.190 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000079953425 1409993239 /nfs/dbraw/zinc/99/32/39/1409993239.db2.gz SGDAADNDZOWLFD-QUCCMNQESA-N 2 1 377.598 3.231 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000079953424 1409993931 /nfs/dbraw/zinc/99/39/31/1409993931.db2.gz SGDAADNDZOWLFD-UYAOXDASSA-N 2 1 377.598 3.231 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC([NH+](CC)CC)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079982771 1409996994 /nfs/dbraw/zinc/99/69/94/1409996994.db2.gz VYHACJIZMCNCIT-NRFANRHFSA-N 2 1 386.584 3.339 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000080064782 1409999584 /nfs/dbraw/zinc/99/95/84/1409999584.db2.gz JLEHVGQXXOWNEX-DENIHFKCSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CC[NH+](C3CCCC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000080165719 1410001897 /nfs/dbraw/zinc/00/18/97/1410001897.db2.gz SZOUCCJXDPNBQM-CTNGQTDRSA-N 2 1 384.568 3.309 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[NH+](C3CCCC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000080165710 1410002222 /nfs/dbraw/zinc/00/22/22/1410002222.db2.gz SZOUCCJXDPNBQM-TZIWHRDSSA-N 2 1 384.568 3.309 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2cc(C)cc(C)c2)CC1 ZINC000080650690 1410008926 /nfs/dbraw/zinc/00/89/26/1410008926.db2.gz ICFSZONCWAWNGI-LJQANCHMSA-N 2 1 375.557 3.453 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2c(C)cccc2C)CC1 ZINC000080650476 1410009354 /nfs/dbraw/zinc/00/93/54/1410009354.db2.gz XEQVEUFAEMBSTH-LJQANCHMSA-N 2 1 375.557 3.453 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@H]3CCC[N@@H+]3Cc3ccccn3)C2)CC1 ZINC000081023364 1410014341 /nfs/dbraw/zinc/01/43/41/1410014341.db2.gz HEPWJVBWANQNEU-RBBKRZOGSA-N 2 1 384.568 3.017 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@H]3CCC[N@H+]3Cc3ccccn3)C2)CC1 ZINC000081023364 1410014349 /nfs/dbraw/zinc/01/43/49/1410014349.db2.gz HEPWJVBWANQNEU-RBBKRZOGSA-N 2 1 384.568 3.017 20 0 GGADMP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000081615131 1410023055 /nfs/dbraw/zinc/02/30/55/1410023055.db2.gz WLQGCTSCMLOBJE-FPOVZHCZSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000081615131 1410023068 /nfs/dbraw/zinc/02/30/68/1410023068.db2.gz WLQGCTSCMLOBJE-FPOVZHCZSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000081615131 1410023076 /nfs/dbraw/zinc/02/30/76/1410023076.db2.gz WLQGCTSCMLOBJE-FPOVZHCZSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000081615131 1410023084 /nfs/dbraw/zinc/02/30/84/1410023084.db2.gz WLQGCTSCMLOBJE-FPOVZHCZSA-N 2 1 375.532 3.417 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)CC[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000081631913 1410023211 /nfs/dbraw/zinc/02/32/11/1410023211.db2.gz FOVYGMDFBHKPDO-INIZCTEOSA-N 2 1 379.932 3.341 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)CC[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000081631913 1410023216 /nfs/dbraw/zinc/02/32/16/1410023216.db2.gz FOVYGMDFBHKPDO-INIZCTEOSA-N 2 1 379.932 3.341 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)CC[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000081631913 1410023221 /nfs/dbraw/zinc/02/32/21/1410023221.db2.gz FOVYGMDFBHKPDO-INIZCTEOSA-N 2 1 379.932 3.341 20 0 GGADMP CC[NH+](CC)C[C@H]1CCN(C(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000081957154 1410025246 /nfs/dbraw/zinc/02/52/46/1410025246.db2.gz AOLALLJXCCIKOM-TZIWHRDSSA-N 2 1 375.532 3.371 20 0 GGADMP CC[NH+](CC)C[C@H]1CCN(C(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000081957154 1410025252 /nfs/dbraw/zinc/02/52/52/1410025252.db2.gz AOLALLJXCCIKOM-TZIWHRDSSA-N 2 1 375.532 3.371 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000081957151 1410025478 /nfs/dbraw/zinc/02/54/78/1410025478.db2.gz AOLALLJXCCIKOM-PZJWPPBQSA-N 2 1 375.532 3.371 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000081957151 1410025487 /nfs/dbraw/zinc/02/54/87/1410025487.db2.gz AOLALLJXCCIKOM-PZJWPPBQSA-N 2 1 375.532 3.371 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2cc(N)ccc2F)C1 ZINC000083173091 1410027773 /nfs/dbraw/zinc/02/77/73/1410027773.db2.gz CEXYCZMOYNVWOR-DLBZAZTESA-N 2 1 376.520 3.323 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCC(=O)Nc2cc(N)ccc2F)C1 ZINC000083173091 1410027781 /nfs/dbraw/zinc/02/77/81/1410027781.db2.gz CEXYCZMOYNVWOR-DLBZAZTESA-N 2 1 376.520 3.323 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc(N)ccc2F)C1 ZINC000083173091 1410027790 /nfs/dbraw/zinc/02/77/90/1410027790.db2.gz CEXYCZMOYNVWOR-DLBZAZTESA-N 2 1 376.520 3.323 20 0 GGADMP COC(=O)c1sccc1C[NH+]1CCC(CC[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000088546716 1410050187 /nfs/dbraw/zinc/05/01/87/1410050187.db2.gz AEZZABMURJXFDI-HOTGVXAUSA-N 2 1 380.554 3.246 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CCN([C@@H](C)c4ccccc4)C3)CC2)nc(C)[nH+]1 ZINC000088740726 1410051224 /nfs/dbraw/zinc/05/12/24/1410051224.db2.gz HJXJLJGZLBBGGC-PGRDOPGGSA-N 2 1 379.552 3.487 20 0 GGADMP C[C@@H](CC(=O)Nc1cccc(F)c1)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000089594633 1410055453 /nfs/dbraw/zinc/05/54/53/1410055453.db2.gz XYOKTKOZGWJAMK-KRWDZBQOSA-N 2 1 377.504 3.168 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)C[NH+](C)[C@@H]2CCSC2)cc1 ZINC000089935802 1410059355 /nfs/dbraw/zinc/05/93/55/1410059355.db2.gz ZUJFTXKNYDBQEN-FXAWDEMLSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)C[N@H+](C)[C@@H]2CCSC2)cc1 ZINC000089935802 1410059362 /nfs/dbraw/zinc/05/93/62/1410059362.db2.gz ZUJFTXKNYDBQEN-FXAWDEMLSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)C[N@@H+](C)[C@@H]2CCSC2)cc1 ZINC000089935802 1410059373 /nfs/dbraw/zinc/05/93/73/1410059373.db2.gz ZUJFTXKNYDBQEN-FXAWDEMLSA-N 2 1 375.582 3.115 20 0 GGADMP CN(C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)[C@@H]1CCCc2ccccc21 ZINC000090004012 1410060247 /nfs/dbraw/zinc/06/02/47/1410060247.db2.gz KQUHVZMWHXLDOA-GHTZIAJQSA-N 2 1 380.536 3.211 20 0 GGADMP CN(C(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)[C@@H]1CCCc2ccccc21 ZINC000090004012 1410060252 /nfs/dbraw/zinc/06/02/52/1410060252.db2.gz KQUHVZMWHXLDOA-GHTZIAJQSA-N 2 1 380.536 3.211 20 0 GGADMP CCCN(Cc1ccc(C)cc1)C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000090004542 1410060568 /nfs/dbraw/zinc/06/05/68/1410060568.db2.gz AXCHSHCKYBMVAL-OAQYLSRUSA-N 2 1 382.552 3.422 20 0 GGADMP CCCN(Cc1ccc(C)cc1)C(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000090004542 1410060573 /nfs/dbraw/zinc/06/05/73/1410060573.db2.gz AXCHSHCKYBMVAL-OAQYLSRUSA-N 2 1 382.552 3.422 20 0 GGADMP Cc1ccc(CN(C(=O)C[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)C2CC2)cc1 ZINC000090004298 1410060644 /nfs/dbraw/zinc/06/06/44/1410060644.db2.gz UMVRPBGIVNKZJY-FQEVSTJZSA-N 2 1 380.536 3.174 20 0 GGADMP Cc1ccc(CN(C(=O)C[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)C2CC2)cc1 ZINC000090004298 1410060650 /nfs/dbraw/zinc/06/06/50/1410060650.db2.gz UMVRPBGIVNKZJY-FQEVSTJZSA-N 2 1 380.536 3.174 20 0 GGADMP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000090585709 1410064839 /nfs/dbraw/zinc/06/48/39/1410064839.db2.gz GDFANFXKHNAJDX-ZWKOTPCHSA-N 2 1 381.586 3.467 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@H]3CCO[C@@]4(CCSC4)C3)CC2)cc1 ZINC000090540151 1410064883 /nfs/dbraw/zinc/06/48/83/1410064883.db2.gz WZFGVMGUYQCCBY-SFTDATJTSA-N 2 1 378.557 3.477 20 0 GGADMP C[C@@H]1C[C@H](NCc2ccnc(OCC[NH+](C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000090937359 1410067917 /nfs/dbraw/zinc/06/79/17/1410067917.db2.gz GNIZOYZVMUNLIP-DENIHFKCSA-N 2 1 382.552 3.165 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CCN1Cc1ccccc1 ZINC000090937359 1410067919 /nfs/dbraw/zinc/06/79/19/1410067919.db2.gz GNIZOYZVMUNLIP-DENIHFKCSA-N 2 1 382.552 3.165 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000090937359 1410067924 /nfs/dbraw/zinc/06/79/24/1410067924.db2.gz GNIZOYZVMUNLIP-DENIHFKCSA-N 3 1 382.552 3.165 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000090937359 1410067929 /nfs/dbraw/zinc/06/79/29/1410067929.db2.gz GNIZOYZVMUNLIP-DENIHFKCSA-N 3 1 382.552 3.165 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2nc3ccc(Cl)cc3n2C)CC1 ZINC000091285175 1410072775 /nfs/dbraw/zinc/07/27/75/1410072775.db2.gz LOMGFZITQJMRKG-INIZCTEOSA-N 2 1 377.964 3.295 20 0 GGADMP C[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1nc2ccc(Cl)cc2n1C ZINC000091333141 1410072839 /nfs/dbraw/zinc/07/28/39/1410072839.db2.gz BYPPAJJGSKAMFB-OAHLLOKOSA-N 2 1 377.964 3.151 20 0 GGADMP COC(=O)CC[N@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)CC(C)C ZINC000091922861 1410092185 /nfs/dbraw/zinc/09/21/85/1410092185.db2.gz IJANZGVFFBXSTH-UHFFFAOYSA-N 2 1 375.557 3.238 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+]3C[C@H]4CCCC[C@@]43c3ccccc3)cn2)CC1 ZINC000091963555 1410095181 /nfs/dbraw/zinc/09/51/81/1410095181.db2.gz ZOFJEPUSTYSVHD-FYYLOGMGSA-N 2 1 377.536 3.130 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+]3C[C@H]4CCCC[C@@]43c3ccccc3)cn2)CC1 ZINC000091963555 1410095184 /nfs/dbraw/zinc/09/51/84/1410095184.db2.gz ZOFJEPUSTYSVHD-FYYLOGMGSA-N 2 1 377.536 3.130 20 0 GGADMP CC[C@@H](c1ccncc1)[N@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000092225241 1410124928 /nfs/dbraw/zinc/12/49/28/1410124928.db2.gz KQXJKHLFVCJBHB-QFIPXVFZSA-N 2 1 380.536 3.377 20 0 GGADMP CC[C@@H](c1ccncc1)[N@@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000092225241 1410124937 /nfs/dbraw/zinc/12/49/37/1410124937.db2.gz KQXJKHLFVCJBHB-QFIPXVFZSA-N 2 1 380.536 3.377 20 0 GGADMP Cn1cc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000092253360 1410129948 /nfs/dbraw/zinc/12/99/48/1410129948.db2.gz HIXRILKYLPJOQJ-KRWDZBQOSA-N 2 1 384.524 3.022 20 0 GGADMP Cn1cc(C[N@@H+](C)C[C@H]2CCC[NH+](C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000092253360 1410129962 /nfs/dbraw/zinc/12/99/62/1410129962.db2.gz HIXRILKYLPJOQJ-KRWDZBQOSA-N 2 1 384.524 3.022 20 0 GGADMP Cn1cc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000092253360 1410129969 /nfs/dbraw/zinc/12/99/69/1410129969.db2.gz HIXRILKYLPJOQJ-KRWDZBQOSA-N 2 1 384.524 3.022 20 0 GGADMP Cn1cc(C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000092253360 1410129978 /nfs/dbraw/zinc/12/99/78/1410129978.db2.gz HIXRILKYLPJOQJ-KRWDZBQOSA-N 2 1 384.524 3.022 20 0 GGADMP CCOC(=O)c1nn(-c2ccccc2)cc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000092381064 1410148345 /nfs/dbraw/zinc/14/83/45/1410148345.db2.gz DUSLBDATMFDJAY-UHFFFAOYSA-N 2 1 384.524 3.213 20 0 GGADMP CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000092400064 1410150430 /nfs/dbraw/zinc/15/04/30/1410150430.db2.gz QHSSCPYOIXFYIG-QUCCMNQESA-N 2 1 375.557 3.144 20 0 GGADMP c1csc(N2CCC[N@H+](Cc3ccc(OCC[NH+]4CCCC4)cc3)CC2)n1 ZINC000092483141 1410161387 /nfs/dbraw/zinc/16/13/87/1410161387.db2.gz VNXIVNKKCPPCSI-UHFFFAOYSA-N 2 1 386.565 3.330 20 0 GGADMP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)C[N@H+](C)Cc1ccccc1 ZINC000092503918 1410162716 /nfs/dbraw/zinc/16/27/16/1410162716.db2.gz IFMSLMAISSMCPL-UHFFFAOYSA-N 2 1 380.536 3.279 20 0 GGADMP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)C[N@@H+](C)Cc1ccccc1 ZINC000092503918 1410162729 /nfs/dbraw/zinc/16/27/29/1410162729.db2.gz IFMSLMAISSMCPL-UHFFFAOYSA-N 2 1 380.536 3.279 20 0 GGADMP C[NH+](C)CCNC(=O)C1CC[NH+](Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000092615821 1410179983 /nfs/dbraw/zinc/17/99/83/1410179983.db2.gz KHFIXCIXVRZRTI-UHFFFAOYSA-N 2 1 391.865 3.249 20 0 GGADMP CC[C@@H](c1ccccc1)[C@H]1CCC[N@@H+]1Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092644322 1410181494 /nfs/dbraw/zinc/18/14/94/1410181494.db2.gz FDFNHZXGCIWLTM-FCHUYYIVSA-N 2 1 379.552 3.387 20 0 GGADMP CC[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092644322 1410181501 /nfs/dbraw/zinc/18/15/01/1410181501.db2.gz FDFNHZXGCIWLTM-FCHUYYIVSA-N 2 1 379.552 3.387 20 0 GGADMP C[N@H+](CCc1cccc2ccccc21)Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092663969 1410183695 /nfs/dbraw/zinc/18/36/95/1410183695.db2.gz KRVHJIPPMMURGJ-UHFFFAOYSA-N 2 1 375.520 3.056 20 0 GGADMP C[N@@H+](CCc1cccc2ccccc21)Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092663969 1410183699 /nfs/dbraw/zinc/18/36/99/1410183699.db2.gz KRVHJIPPMMURGJ-UHFFFAOYSA-N 2 1 375.520 3.056 20 0 GGADMP C[C@@H]1CC[C@@H](C)[NH+]1CCN1CC[NH+](Cc2ccc(OCC(F)F)cc2)CC1 ZINC000092664811 1410185451 /nfs/dbraw/zinc/18/54/51/1410185451.db2.gz QVLYLOLCRLUIGH-QZTJIDSGSA-N 2 1 381.511 3.321 20 0 GGADMP COCCCOc1cccc(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000092666339 1410185969 /nfs/dbraw/zinc/18/59/69/1410185969.db2.gz CSEVFIMYCINWAJ-OYRHEFFESA-N 2 1 389.584 3.092 20 0 GGADMP COCCCOc1cccc(C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000092666339 1410185975 /nfs/dbraw/zinc/18/59/75/1410185975.db2.gz CSEVFIMYCINWAJ-OYRHEFFESA-N 2 1 389.584 3.092 20 0 GGADMP CC[NH+]1CCN(c2ccccc2C[N@H+]2CC[C@H](CNc3ccccn3)C2)CC1 ZINC000092812798 1410203352 /nfs/dbraw/zinc/20/33/52/1410203352.db2.gz QCNWLBZKYRSXMQ-HXUWFJFHSA-N 2 1 379.552 3.158 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(-n2ccnc2)nc1 ZINC000092821307 1410204479 /nfs/dbraw/zinc/20/44/79/1410204479.db2.gz RLGGLJHOBSOCSJ-UHFFFAOYSA-N 2 1 376.508 3.401 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000093064455 1410220110 /nfs/dbraw/zinc/22/01/10/1410220110.db2.gz JKIDBCLJXAPBHE-JOCHJYFZSA-N 2 1 378.520 3.079 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(OC)c(OCCC(C)C)c3)C2)CC1 ZINC000093133100 1410223891 /nfs/dbraw/zinc/22/38/91/1410223891.db2.gz DQCNUHFRKMLVLG-OAQYLSRUSA-N 2 1 389.584 3.332 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccccc3OCc3ccccc3)C2)CC1 ZINC000093133036 1410224230 /nfs/dbraw/zinc/22/42/30/1410224230.db2.gz MFMDNRJPDUJZBW-HSZRJFAPSA-N 2 1 379.548 3.477 20 0 GGADMP CCCOc1c(C[N@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)cccc1OCC ZINC000093133022 1410224375 /nfs/dbraw/zinc/22/43/75/1410224375.db2.gz MKPIZNSCXMFTDV-FQEVSTJZSA-N 2 1 375.557 3.086 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cc4cc(F)ccc4o3)CC2)CC1 ZINC000093141494 1410225015 /nfs/dbraw/zinc/22/50/15/1410225015.db2.gz BRXZVEMEMBEVSX-UHFFFAOYSA-N 2 1 387.499 3.338 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)(C)C)C2)cc1 ZINC000093281037 1410229412 /nfs/dbraw/zinc/22/94/12/1410229412.db2.gz UXORWSCXYIHZOH-IBGZPJMESA-N 2 1 375.557 3.001 20 0 GGADMP Cn1cc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000093336983 1410236010 /nfs/dbraw/zinc/23/60/10/1410236010.db2.gz LNUXQQCPQQVFLR-HXUWFJFHSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000093336983 1410236020 /nfs/dbraw/zinc/23/60/20/1410236020.db2.gz LNUXQQCPQQVFLR-HXUWFJFHSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000093336983 1410236023 /nfs/dbraw/zinc/23/60/23/1410236023.db2.gz LNUXQQCPQQVFLR-HXUWFJFHSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000093336983 1410236030 /nfs/dbraw/zinc/23/60/30/1410236030.db2.gz LNUXQQCPQQVFLR-HXUWFJFHSA-N 2 1 375.520 3.436 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1nccs1 ZINC000093404877 1410243465 /nfs/dbraw/zinc/24/34/65/1410243465.db2.gz BXEDTNQRYRZMDG-MRXNPFEDSA-N 2 1 375.538 3.484 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1nccs1 ZINC000093404877 1410243468 /nfs/dbraw/zinc/24/34/68/1410243468.db2.gz BXEDTNQRYRZMDG-MRXNPFEDSA-N 2 1 375.538 3.484 20 0 GGADMP COc1ccc([C@@H](CO)[N@@H+](C)Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000093415833 1410244484 /nfs/dbraw/zinc/24/44/84/1410244484.db2.gz HRASEYAEPWAVRX-HSZRJFAPSA-N 2 1 384.520 3.335 20 0 GGADMP CN(c1ccccc1C[NH+]1CCN(c2ncccc2F)CC1)C1CC[NH+](C)CC1 ZINC000093687535 1410259912 /nfs/dbraw/zinc/25/99/12/1410259912.db2.gz IFPVNGILNVKKHM-UHFFFAOYSA-N 2 1 397.542 3.073 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+]3CCC[C@@H]3CCCc3ccccc3)cn2)CC1 ZINC000093761784 1410264298 /nfs/dbraw/zinc/26/42/98/1410264298.db2.gz KUPAGILDHVEWRV-QFIPXVFZSA-N 2 1 379.552 3.216 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+]3CCC[C@@H]3CCCc3ccccc3)cn2)CC1 ZINC000093761784 1410264301 /nfs/dbraw/zinc/26/43/01/1410264301.db2.gz KUPAGILDHVEWRV-QFIPXVFZSA-N 2 1 379.552 3.216 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3ccc(N4CCCC4)nc3)CC2)C[C@H](C)O1 ZINC000093844295 1410275182 /nfs/dbraw/zinc/27/51/82/1410275182.db2.gz VJCSDPNNTUFWAT-BGYRXZFFSA-N 2 1 386.584 3.393 20 0 GGADMP CC[C@H]1C[N@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)CC[C@@H]1c1ccccc1 ZINC000093882512 1410277858 /nfs/dbraw/zinc/27/78/58/1410277858.db2.gz CRWUUVYUFZLMBL-UNMCSNQZSA-N 2 1 379.552 3.244 20 0 GGADMP CC[C@H]1C[N@@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)CC[C@@H]1c1ccccc1 ZINC000093882512 1410277868 /nfs/dbraw/zinc/27/78/68/1410277868.db2.gz CRWUUVYUFZLMBL-UNMCSNQZSA-N 2 1 379.552 3.244 20 0 GGADMP C[NH+]1CCN(c2ccc(NC(=O)[C@H]3CCC[N@@H+](Cc4ccccc4)C3)cc2)CC1 ZINC000096627910 1410335219 /nfs/dbraw/zinc/33/52/19/1410335219.db2.gz KPLQFZSDJZBFLF-NRFANRHFSA-N 2 1 392.547 3.289 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)NC[C@@H](Cc2ccccc2)[NH+](C)C)C1 ZINC000097395151 1410368751 /nfs/dbraw/zinc/36/87/51/1410368751.db2.gz AQZSZWMHTZMWCK-RZUBCFFCSA-N 2 1 388.600 3.217 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000097600610 1410383644 /nfs/dbraw/zinc/38/36/44/1410383644.db2.gz HYHRRKZJWKKHEH-UHFFFAOYSA-N 2 1 383.939 3.395 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)/C=C/c1ccc2ccccc2n1 ZINC000101518565 1410443846 /nfs/dbraw/zinc/44/38/46/1410443846.db2.gz CZIBRQLSMCMPKE-ARKBFRDHSA-N 2 1 380.536 3.123 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)/C=C/c1nc2ccccc2s1 ZINC000101518562 1410443857 /nfs/dbraw/zinc/44/38/57/1410443857.db2.gz HKXFJHMECMVVMJ-FMQWLBJXSA-N 2 1 386.565 3.184 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)/C=C/c1ccc2ccccc2n1 ZINC000101518564 1410444137 /nfs/dbraw/zinc/44/41/37/1410444137.db2.gz CZIBRQLSMCMPKE-QZMUEMGWSA-N 2 1 380.536 3.123 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1nc2ccccc2s1 ZINC000101602691 1410475438 /nfs/dbraw/zinc/47/54/38/1410475438.db2.gz KANFOZJYJSDSNE-HNNXBMFYSA-N 2 1 375.542 3.176 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1ccc(-c2ccco2)nc1C ZINC000101868558 1410511366 /nfs/dbraw/zinc/51/13/66/1410511366.db2.gz XPNSHVPRFMEEGC-SFHVURJKSA-N 2 1 384.524 3.138 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C)[NH+]2CCC(C)CC2)cc1F ZINC000101999382 1410540553 /nfs/dbraw/zinc/54/05/53/1410540553.db2.gz OSEKGULIECJLNX-MRXNPFEDSA-N 2 1 387.503 3.239 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCC(C)CC1 ZINC000102005831 1410541652 /nfs/dbraw/zinc/54/16/52/1410541652.db2.gz PEYXQLQRBTWMKX-RBUKOAKNSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCC(C)CC1 ZINC000102005827 1410541780 /nfs/dbraw/zinc/54/17/80/1410541780.db2.gz PEYXQLQRBTWMKX-MOPGFXCFSA-N 2 1 392.613 3.380 20 0 GGADMP CC[NH+](CC)CCC[C@H](C)NC(=O)[C@H](c1ccccc1)[NH+]1CCSCC1 ZINC000102636790 1410680984 /nfs/dbraw/zinc/68/09/84/1410680984.db2.gz RXHZEKFEPSCUEP-ICSRJNTNSA-N 2 1 377.598 3.403 20 0 GGADMP CC[NH+](CC)CCC[C@H](C)NC(=O)[C@@H](c1ccccc1)[NH+]1CCSCC1 ZINC000102636788 1410681726 /nfs/dbraw/zinc/68/17/26/1410681726.db2.gz RXHZEKFEPSCUEP-AZUAARDMSA-N 2 1 377.598 3.403 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000102795357 1410760491 /nfs/dbraw/zinc/76/04/91/1410760491.db2.gz VPEBKZFENYZTRY-JOCHJYFZSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(C[N@H+]1CC[C@@H](Nc2ccccc2)C1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000102846093 1410800065 /nfs/dbraw/zinc/80/00/65/1410800065.db2.gz CVFSFFGNZYQLNV-HSZRJFAPSA-N 2 1 392.547 3.085 20 0 GGADMP COc1ccc(CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(OC)c1OC ZINC000103173942 1410834227 /nfs/dbraw/zinc/83/42/27/1410834227.db2.gz KSEQIUZWDRGAKR-IBGZPJMESA-N 2 1 384.520 3.367 20 0 GGADMP COc1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(OC)c1OC ZINC000103173942 1410834228 /nfs/dbraw/zinc/83/42/28/1410834228.db2.gz KSEQIUZWDRGAKR-IBGZPJMESA-N 2 1 384.520 3.367 20 0 GGADMP COc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(OC)c1OC ZINC000103173942 1410834229 /nfs/dbraw/zinc/83/42/29/1410834229.db2.gz KSEQIUZWDRGAKR-IBGZPJMESA-N 2 1 384.520 3.367 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1)c1ccccc1 ZINC000103205129 1410837317 /nfs/dbraw/zinc/83/73/17/1410837317.db2.gz DKSMWZIZTGSMAE-GMAHTHKFSA-N 2 1 379.548 3.360 20 0 GGADMP CC[NH+](C)[C@H](C(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000103205129 1410837321 /nfs/dbraw/zinc/83/73/21/1410837321.db2.gz DKSMWZIZTGSMAE-GMAHTHKFSA-N 2 1 379.548 3.360 20 0 GGADMP CC[NH+](C)[C@H](C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000103205129 1410837324 /nfs/dbraw/zinc/83/73/24/1410837324.db2.gz DKSMWZIZTGSMAE-GMAHTHKFSA-N 2 1 379.548 3.360 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000103268350 1410841956 /nfs/dbraw/zinc/84/19/56/1410841956.db2.gz INLPQEWKXLUOTP-HSZRJFAPSA-N 2 1 394.563 3.112 20 0 GGADMP CCC[N@@H+]1CC[C@H](CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000103291035 1410842933 /nfs/dbraw/zinc/84/29/33/1410842933.db2.gz FXIYTMDDYSKUOL-QGZVFWFLSA-N 2 1 376.570 3.089 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000103291035 1410842935 /nfs/dbraw/zinc/84/29/35/1410842935.db2.gz FXIYTMDDYSKUOL-QGZVFWFLSA-N 2 1 376.570 3.089 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)Nc2ccc(CC[NH+]3CCSCC3)cc2)C1 ZINC000103291051 1410842953 /nfs/dbraw/zinc/84/29/53/1410842953.db2.gz DVXKLQSLDRZQDD-IBGZPJMESA-N 2 1 390.597 3.131 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccco1 ZINC000103297797 1410843957 /nfs/dbraw/zinc/84/39/57/1410843957.db2.gz WUCRANQOLJKBKT-RBUKOAKNSA-N 2 1 376.545 3.180 20 0 GGADMP CC(C)(CNC(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCCCC1 ZINC000103298452 1410843982 /nfs/dbraw/zinc/84/39/82/1410843982.db2.gz GAUAQTMSXURMML-NRFANRHFSA-N 2 1 386.584 3.115 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000103319449 1410846857 /nfs/dbraw/zinc/84/68/57/1410846857.db2.gz NFPUEYOEIKSDDZ-NRFANRHFSA-N 2 1 386.584 3.067 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)NCCC2CC[NH+](C)CC2)CC1 ZINC000103320917 1410846897 /nfs/dbraw/zinc/84/68/97/1410846897.db2.gz KTISVKVPBKCXTK-UHFFFAOYSA-N 2 1 386.584 3.272 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N(C)CC3CC[NH+](C)CC3)cc2)C1 ZINC000103511608 1410865212 /nfs/dbraw/zinc/86/52/12/1410865212.db2.gz NYJVCFDORLMMKE-LJQANCHMSA-N 2 1 386.584 3.402 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000104213896 1410887372 /nfs/dbraw/zinc/88/73/72/1410887372.db2.gz FSHFLJYJPIYKSK-IBGZPJMESA-N 2 1 385.474 3.145 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[N@@H+](C)C1CC1 ZINC000105093674 1411027488 /nfs/dbraw/zinc/02/74/88/1411027488.db2.gz IMLOVXFULHAINH-OAHLLOKOSA-N 2 1 378.948 3.086 20 0 GGADMP CC[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C(C)C)C1)[NH+]1CCc2ccccc2C1 ZINC000105126186 1411031788 /nfs/dbraw/zinc/03/17/88/1411031788.db2.gz WBARUAPVIRULDL-SIKLNZKXSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@H](CNC(=O)NC[C@@H]1CCC[NH+](C(C)C)C1)[N@@H+]1CCc2ccccc2C1 ZINC000105126186 1411031797 /nfs/dbraw/zinc/03/17/97/1411031797.db2.gz WBARUAPVIRULDL-SIKLNZKXSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@H](CNC(=O)NC[C@@H]1CCC[NH+](C(C)C)C1)[N@H+]1CCc2ccccc2C1 ZINC000105126186 1411031806 /nfs/dbraw/zinc/03/18/06/1411031806.db2.gz WBARUAPVIRULDL-SIKLNZKXSA-N 2 1 386.584 3.243 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1)[N@@H+]1CCc2sccc2C1 ZINC000105150394 1411035132 /nfs/dbraw/zinc/03/51/32/1411035132.db2.gz UYXCDRFBKQZAKG-IEBWSBKVSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1)[N@H+]1CCc2sccc2C1 ZINC000105150394 1411035140 /nfs/dbraw/zinc/03/51/40/1411035140.db2.gz UYXCDRFBKQZAKG-IEBWSBKVSA-N 2 1 390.597 3.155 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)NC[C@H](C)[N@@H+](C)C1CC1)[NH+]1CCCCC1 ZINC000105165740 1411037945 /nfs/dbraw/zinc/03/79/45/1411037945.db2.gz PGPDXNQSVYDVJJ-FXAWDEMLSA-N 2 1 388.556 3.004 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H]2CCC[N@@H+](C(C)C)C2)cc1F ZINC000105190136 1411039683 /nfs/dbraw/zinc/03/96/83/1411039683.db2.gz UNGSTUOLDZYBDR-GOSISDBHSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1F ZINC000105190136 1411039690 /nfs/dbraw/zinc/03/96/90/1411039690.db2.gz UNGSTUOLDZYBDR-GOSISDBHSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[C@H]2C[NH+]2CCCCC2)cc1F ZINC000105190189 1411039805 /nfs/dbraw/zinc/03/98/05/1411039805.db2.gz PJFFEQXSMZMXHX-IBGZPJMESA-N 2 1 399.514 3.480 20 0 GGADMP CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000105250403 1411046473 /nfs/dbraw/zinc/04/64/73/1411046473.db2.gz MKUVWMIQFHRSPB-NRFANRHFSA-N 2 1 390.547 3.334 20 0 GGADMP CN(CCN(C)C1CC[NH+](C)CC1)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000105250403 1411046484 /nfs/dbraw/zinc/04/64/84/1411046484.db2.gz MKUVWMIQFHRSPB-NRFANRHFSA-N 2 1 390.547 3.334 20 0 GGADMP CC[N@H+]1CCC[C@@H](CNC(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000105241562 1411046712 /nfs/dbraw/zinc/04/67/12/1411046712.db2.gz QPWRJDBPRBGVSE-QFIPXVFZSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000105244883 1411046746 /nfs/dbraw/zinc/04/67/46/1411046746.db2.gz HBFIYVRBGDEPPN-XZOQPEGZSA-N 2 1 398.595 3.211 20 0 GGADMP CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000105250399 1411046881 /nfs/dbraw/zinc/04/68/81/1411046881.db2.gz MKUVWMIQFHRSPB-OAQYLSRUSA-N 2 1 390.547 3.334 20 0 GGADMP CN(CCN(C)C1CC[NH+](C)CC1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000105250399 1411046890 /nfs/dbraw/zinc/04/68/90/1411046890.db2.gz MKUVWMIQFHRSPB-OAQYLSRUSA-N 2 1 390.547 3.334 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2csc(-c3ccc(F)cc3)n2)CC1 ZINC000105451312 1411067525 /nfs/dbraw/zinc/06/75/25/1411067525.db2.gz PELFIWRSNDQDGN-UHFFFAOYSA-N 2 1 376.545 3.312 20 0 GGADMP CC(C)c1nn(C)c(Cl)c1C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000105495463 1411071867 /nfs/dbraw/zinc/07/18/67/1411071867.db2.gz SFVCRBZHSFRJLC-UHFFFAOYSA-N 2 1 390.959 3.443 20 0 GGADMP CCN(C(=O)C[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1)c1cccc2ccccc21 ZINC000106126302 1411172773 /nfs/dbraw/zinc/17/27/73/1411172773.db2.gz YSQSMXVWFFZWFB-LJQANCHMSA-N 2 1 397.563 3.217 20 0 GGADMP O=C(COc1ccccc1C[NH2+]C1CC[NH+](C2CCCC2)CC1)N1CCCC1 ZINC000176993031 1428544479 /nfs/dbraw/zinc/54/44/79/1428544479.db2.gz KWAWXISNFDCORW-UHFFFAOYSA-N 2 1 385.552 3.184 20 0 GGADMP C[C@H](CN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000106485196 1411224185 /nfs/dbraw/zinc/22/41/85/1411224185.db2.gz OLGXOEXYUMKKDU-CQSZACIVSA-N 2 1 392.887 3.234 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCCC1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106522665 1411230407 /nfs/dbraw/zinc/23/04/07/1411230407.db2.gz QXLLWVWUELMYOD-OAQYLSRUSA-N 2 1 384.568 3.489 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)cc1F ZINC000106545476 1411241720 /nfs/dbraw/zinc/24/17/20/1411241720.db2.gz CFOYIBXJUDTUHO-QGZVFWFLSA-N 2 1 385.487 3.136 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1F ZINC000106545476 1411241734 /nfs/dbraw/zinc/24/17/34/1411241734.db2.gz CFOYIBXJUDTUHO-QGZVFWFLSA-N 2 1 385.487 3.136 20 0 GGADMP CC(C)[C@H](C(=O)NC1CC[NH+](Cc2coc(-c3ccccc3)n2)CC1)[NH+](C)C ZINC000106914637 1411319867 /nfs/dbraw/zinc/31/98/67/1411319867.db2.gz WRRXPXRRGARNOS-HXUWFJFHSA-N 2 1 384.524 3.008 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](CCCOc3cccc(C(F)(F)F)c3)C2)CC1 ZINC000107368276 1411365921 /nfs/dbraw/zinc/36/59/21/1411365921.db2.gz PXQMLXSLSZRTSV-GOSISDBHSA-N 2 1 385.474 3.186 20 0 GGADMP CC[C@H](CNC(=O)N1CC[NH+](C2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000107966748 1411430101 /nfs/dbraw/zinc/43/01/01/1411430101.db2.gz WAGZKJJGCMYGFT-OAQYLSRUSA-N 2 1 384.568 3.093 20 0 GGADMP CC[C@@H](CNC(=O)N1CC[NH+](C2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000107966745 1411430118 /nfs/dbraw/zinc/43/01/18/1411430118.db2.gz WAGZKJJGCMYGFT-NRFANRHFSA-N 2 1 384.568 3.093 20 0 GGADMP COc1cc(C[NH+](C)C/C=C/C[N@H+](C)Cc2ccc(O)c(OC)c2)ccc1O ZINC000177052228 1428569996 /nfs/dbraw/zinc/56/99/96/1428569996.db2.gz AEBSVTFQLVMXNN-AATRIKPKSA-N 2 1 386.492 3.235 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(F)c(F)c(F)c3)c2)C1 ZINC000108420925 1411495119 /nfs/dbraw/zinc/49/51/19/1411495119.db2.gz OAQBDENIXYTDAM-KRWDZBQOSA-N 2 1 391.437 3.091 20 0 GGADMP CCOc1ccccc1C[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000108420630 1411495760 /nfs/dbraw/zinc/49/57/60/1411495760.db2.gz FMQAFOJRQWBLPQ-NRFANRHFSA-N 2 1 381.520 3.072 20 0 GGADMP CC(C)Oc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000108420590 1411496275 /nfs/dbraw/zinc/49/62/75/1411496275.db2.gz ZPGLAGMPLJTUIB-JOCHJYFZSA-N 2 1 395.547 3.461 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc4ncccc4c3)c2)C1 ZINC000108420843 1411496407 /nfs/dbraw/zinc/49/64/07/1411496407.db2.gz MIBYQGOJBOCFRC-QFIPXVFZSA-N 2 1 388.515 3.222 20 0 GGADMP CC(C)Oc1ccccc1C[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000108420655 1411496804 /nfs/dbraw/zinc/49/68/04/1411496804.db2.gz ZZWAAVSUTHYKDZ-JOCHJYFZSA-N 2 1 395.547 3.461 20 0 GGADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)o1 ZINC000108421039 1411497592 /nfs/dbraw/zinc/49/75/92/1411497592.db2.gz PLKFTQKYSKPCIQ-PBEJRMEISA-N 2 1 381.520 3.390 20 0 GGADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)o1 ZINC000108421039 1411497603 /nfs/dbraw/zinc/49/76/03/1411497603.db2.gz PLKFTQKYSKPCIQ-PBEJRMEISA-N 2 1 381.520 3.390 20 0 GGADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc(Br)c1OC(F)F ZINC000108428150 1411497939 /nfs/dbraw/zinc/49/79/39/1411497939.db2.gz LTZMDKQABKVCAA-NSHDSACASA-N 2 1 393.272 3.491 20 0 GGADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc(Br)c1OC(F)F ZINC000108428150 1411497949 /nfs/dbraw/zinc/49/79/49/1411497949.db2.gz LTZMDKQABKVCAA-NSHDSACASA-N 2 1 393.272 3.491 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](C)C1)c1ccccc1Cl ZINC000108541069 1411533239 /nfs/dbraw/zinc/53/32/39/1411533239.db2.gz FOTUHLZTWYQUPG-APWZRJJASA-N 2 1 380.964 3.364 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)NC[C@H]2CCC[N@@H+](C)C2)c2cccs2)CC1 ZINC000108541059 1411533647 /nfs/dbraw/zinc/53/36/47/1411533647.db2.gz UYVUXMLQNIJLIP-QZTJIDSGSA-N 2 1 378.586 3.162 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1Cl ZINC000108541065 1411533780 /nfs/dbraw/zinc/53/37/80/1411533780.db2.gz FOTUHLZTWYQUPG-QFBILLFUSA-N 2 1 380.964 3.364 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000108544944 1411535095 /nfs/dbraw/zinc/53/50/95/1411535095.db2.gz CYXMHMDFNBDLDE-FQEVSTJZSA-N 2 1 390.959 3.088 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1 ZINC000108588761 1411545019 /nfs/dbraw/zinc/54/50/19/1411545019.db2.gz LOUBICYSCTYMIE-IBGZPJMESA-N 2 1 380.536 3.009 20 0 GGADMP CCC(CC)[C@@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)[NH+]1CCOCC1 ZINC000108710243 1411580495 /nfs/dbraw/zinc/58/04/95/1411580495.db2.gz DMIBDIWUVUIHQH-JOCHJYFZSA-N 2 1 387.568 3.149 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccccc1)[NH+](C)C ZINC000108711712 1411582465 /nfs/dbraw/zinc/58/24/65/1411582465.db2.gz CMQYHKBQQUMLHL-NHCUHLMSSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)[C@H]1CCC[N@H+]1Cc1ccccc1)[NH+](C)C ZINC000108711712 1411582466 /nfs/dbraw/zinc/58/24/66/1411582466.db2.gz CMQYHKBQQUMLHL-NHCUHLMSSA-N 2 1 381.520 3.079 20 0 GGADMP C[N@H+](CCC(=O)Nc1cc(N)ccc1F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000177074280 1428578438 /nfs/dbraw/zinc/57/84/38/1428578438.db2.gz ONFYTRYZPPIVKW-UHFFFAOYSA-N 2 1 384.499 3.333 20 0 GGADMP C[N@@H+](CCC(=O)Nc1cc(N)ccc1F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000177074280 1428578446 /nfs/dbraw/zinc/57/84/46/1428578446.db2.gz ONFYTRYZPPIVKW-UHFFFAOYSA-N 2 1 384.499 3.333 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](CCc3c(F)cccc3Cl)CC2)CC1 ZINC000108873273 1411628070 /nfs/dbraw/zinc/62/80/70/1411628070.db2.gz AOMBWFMZBHZWBQ-UHFFFAOYSA-N 2 1 395.950 3.288 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](CCSc3ccc(F)cc3)CC2)CC1 ZINC000108919345 1411639761 /nfs/dbraw/zinc/63/97/61/1411639761.db2.gz SWSKNBWKSQJEEU-UHFFFAOYSA-N 2 1 393.572 3.184 20 0 GGADMP COc1cccc([C@H](CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)[NH+](C)C)c1 ZINC000108930325 1411641881 /nfs/dbraw/zinc/64/18/81/1411641881.db2.gz JZIAUWWPMDYUFU-YADHBBJMSA-N 2 1 381.520 3.079 20 0 GGADMP COc1cccc([C@H](CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)[NH+](C)C)c1 ZINC000108930322 1411641898 /nfs/dbraw/zinc/64/18/98/1411641898.db2.gz JZIAUWWPMDYUFU-VXKWHMMOSA-N 2 1 381.520 3.079 20 0 GGADMP O=C([C@@H]1CCC[N@H+](Cc2ccccc2)C1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000108930774 1411641946 /nfs/dbraw/zinc/64/19/46/1411641946.db2.gz MDXYDNVAOMYNED-XMMPIXPASA-N 2 1 391.559 3.286 20 0 GGADMP O=C([C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000108930774 1411641951 /nfs/dbraw/zinc/64/19/51/1411641951.db2.gz MDXYDNVAOMYNED-XMMPIXPASA-N 2 1 391.559 3.286 20 0 GGADMP Clc1cc(C[NH2+]CCC[NH+]2CCCCC2)ccc1OCCN1CCOCC1 ZINC000177089971 1428584299 /nfs/dbraw/zinc/58/42/99/1428584299.db2.gz GAMAJHZCRUZMCD-UHFFFAOYSA-N 2 1 395.975 3.017 20 0 GGADMP O=C(N[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000109014904 1411661500 /nfs/dbraw/zinc/66/15/00/1411661500.db2.gz XJUXHTDWBKZYLH-FYYLOGMGSA-N 2 1 395.522 3.428 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)c1ccccc1 ZINC000109339903 1411744485 /nfs/dbraw/zinc/74/44/85/1411744485.db2.gz MUOVOAQYHMHEFD-IFMALSPDSA-N 2 1 383.511 3.457 20 0 GGADMP C[C@H](c1cccc(O)c1)[N@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000109828597 1411812632 /nfs/dbraw/zinc/81/26/32/1411812632.db2.gz APHSANASESQFHL-GOSISDBHSA-N 2 1 381.520 3.297 20 0 GGADMP C[C@H](c1cccc(O)c1)[N@@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000109828597 1411812635 /nfs/dbraw/zinc/81/26/35/1411812635.db2.gz APHSANASESQFHL-GOSISDBHSA-N 2 1 381.520 3.297 20 0 GGADMP C[C@@H](c1cccc(O)c1)[N@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000109828593 1411812698 /nfs/dbraw/zinc/81/26/98/1411812698.db2.gz APHSANASESQFHL-SFHVURJKSA-N 2 1 381.520 3.297 20 0 GGADMP C[C@@H](c1cccc(O)c1)[N@@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000109828593 1411812699 /nfs/dbraw/zinc/81/26/99/1411812699.db2.gz APHSANASESQFHL-SFHVURJKSA-N 2 1 381.520 3.297 20 0 GGADMP CC(C)C[NH+]1CCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000110164281 1411835123 /nfs/dbraw/zinc/83/51/23/1411835123.db2.gz UDXFSLSCPXVVNU-HXUWFJFHSA-N 2 1 397.485 3.241 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000110745715 1411867746 /nfs/dbraw/zinc/86/77/46/1411867746.db2.gz HJNBLCQDLWLDOO-HSZRJFAPSA-N 2 1 394.563 3.008 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3cnn(-c4ccccc4)c3)CC2)oc1C ZINC000111412390 1411946428 /nfs/dbraw/zinc/94/64/28/1411946428.db2.gz ZVBYYKPXLOMCQQ-UHFFFAOYSA-N 2 1 379.508 3.479 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)Cc1ccccc1 ZINC000111418874 1411948490 /nfs/dbraw/zinc/94/84/90/1411948490.db2.gz SUROXHHWLWZHEF-FQEVSTJZSA-N 2 1 394.563 3.471 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[N@@H+](C)Cc1ccccc1 ZINC000111433733 1411952958 /nfs/dbraw/zinc/95/29/58/1411952958.db2.gz TUJRDFNYEQWINL-AZUAARDMSA-N 2 1 384.524 3.236 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)[N@@H+](C)Cc1ccccc1 ZINC000111433731 1411953503 /nfs/dbraw/zinc/95/35/03/1411953503.db2.gz TUJRDFNYEQWINL-QUCCMNQESA-N 2 1 384.524 3.236 20 0 GGADMP CC[N@H+]1CCCC[C@H]1CNC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000111482377 1411977661 /nfs/dbraw/zinc/97/76/61/1411977661.db2.gz DWOVWULKAOEVFL-ROUUACIJSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCCC[C@H]1CNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000111482377 1411977668 /nfs/dbraw/zinc/97/76/68/1411977668.db2.gz DWOVWULKAOEVFL-ROUUACIJSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCCC[C@H]1CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000111482377 1411977680 /nfs/dbraw/zinc/97/76/80/1411977680.db2.gz DWOVWULKAOEVFL-ROUUACIJSA-N 2 1 378.586 3.134 20 0 GGADMP C[C@@H](C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000111607632 1412000532 /nfs/dbraw/zinc/00/05/32/1412000532.db2.gz LEGVUUFWYRBUDI-UNMCSNQZSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@@H](C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000111607632 1412000538 /nfs/dbraw/zinc/00/05/38/1412000538.db2.gz LEGVUUFWYRBUDI-UNMCSNQZSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@@H](C(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000111607632 1412000544 /nfs/dbraw/zinc/00/05/44/1412000544.db2.gz LEGVUUFWYRBUDI-UNMCSNQZSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@@H](C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000111607632 1412000553 /nfs/dbraw/zinc/00/05/53/1412000553.db2.gz LEGVUUFWYRBUDI-UNMCSNQZSA-N 2 1 391.559 3.114 20 0 GGADMP CC(C)[NH2+]C1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000111846018 1412037285 /nfs/dbraw/zinc/03/72/85/1412037285.db2.gz QTSXGNRGFPVAQG-QGZVFWFLSA-N 2 1 378.586 3.132 20 0 GGADMP C[C@H](CCc1ccccc1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000112532802 1412164150 /nfs/dbraw/zinc/16/41/50/1412164150.db2.gz KVBHZRFMVVJSIK-HXUWFJFHSA-N 2 1 395.547 3.458 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)CC1 ZINC000112631530 1412182224 /nfs/dbraw/zinc/18/22/24/1412182224.db2.gz UAYCQOJZJLDKTG-INIZCTEOSA-N 2 1 375.513 3.186 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1cccc(Oc2ccncc2)c1 ZINC000112633153 1412182756 /nfs/dbraw/zinc/18/27/56/1412182756.db2.gz JJMATECTZFRWGB-FQEVSTJZSA-N 2 1 396.535 3.362 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc3c(c2)OCO3)CC1 ZINC000112631532 1412182764 /nfs/dbraw/zinc/18/27/64/1412182764.db2.gz UAYCQOJZJLDKTG-MRXNPFEDSA-N 2 1 375.513 3.186 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1C(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CCOCC1 ZINC000113234735 1412279351 /nfs/dbraw/zinc/27/93/51/1412279351.db2.gz CJWLPPUXFXYUNM-PZJWPPBQSA-N 2 1 387.568 3.267 20 0 GGADMP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2csc(COc3ccccc3)n2)CC1 ZINC000113335735 1412293831 /nfs/dbraw/zinc/29/38/31/1412293831.db2.gz MDWXRWPTQABFKG-GOSISDBHSA-N 2 1 388.581 3.085 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]C[C@@H](C)CN3CC[NH+](C)CC3)cs2)cc1 ZINC000113335718 1412294273 /nfs/dbraw/zinc/29/42/73/1412294273.db2.gz XKUXEZYESGJNGQ-GOSISDBHSA-N 2 1 388.581 3.004 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2cc(C)nn2C(C)(C)C)CC1 ZINC000113500605 1412310317 /nfs/dbraw/zinc/31/03/17/1412310317.db2.gz OPZQQIUXLUUGOU-UHFFFAOYSA-N 2 1 377.577 3.329 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2cc(C)nn2C(C)(C)C)CC1 ZINC000113500605 1412310321 /nfs/dbraw/zinc/31/03/21/1412310321.db2.gz OPZQQIUXLUUGOU-UHFFFAOYSA-N 2 1 377.577 3.329 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000113934126 1412354458 /nfs/dbraw/zinc/35/44/58/1412354458.db2.gz HPQYKVVMDPSWCF-RBUKOAKNSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000113934126 1412354460 /nfs/dbraw/zinc/35/44/60/1412354460.db2.gz HPQYKVVMDPSWCF-RBUKOAKNSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000113934126 1412354464 /nfs/dbraw/zinc/35/44/64/1412354464.db2.gz HPQYKVVMDPSWCF-RBUKOAKNSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000113934593 1412355377 /nfs/dbraw/zinc/35/53/77/1412355377.db2.gz GLRWYKGFNZIYHT-ZWKOTPCHSA-N 2 1 387.524 3.330 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000113934593 1412355381 /nfs/dbraw/zinc/35/53/81/1412355381.db2.gz GLRWYKGFNZIYHT-ZWKOTPCHSA-N 2 1 387.524 3.330 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000113934593 1412355384 /nfs/dbraw/zinc/35/53/84/1412355384.db2.gz GLRWYKGFNZIYHT-ZWKOTPCHSA-N 2 1 387.524 3.330 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000114024698 1412370323 /nfs/dbraw/zinc/37/03/23/1412370323.db2.gz STIVACJWAFIEDN-HBFSDRIKSA-N 2 1 375.561 3.124 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000114024698 1412370329 /nfs/dbraw/zinc/37/03/29/1412370329.db2.gz STIVACJWAFIEDN-HBFSDRIKSA-N 2 1 375.561 3.124 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)N3[C@@H]4CC[C@H]3C[N@@H+](CC)CC4)c(C)c2)CC1 ZINC000177248491 1428650055 /nfs/dbraw/zinc/65/00/55/1428650055.db2.gz OWEIXQMXRYNZOE-CTNGQTDRSA-N 2 1 399.583 3.227 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)N3[C@@H]4CC[C@H]3CC[N@H+](CC)C4)c(C)c2)CC1 ZINC000177248477 1428650685 /nfs/dbraw/zinc/65/06/85/1428650685.db2.gz OWEIXQMXRYNZOE-PZJWPPBQSA-N 2 1 399.583 3.227 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccc3c(c2)CCO3)C2CCCC2)CC1 ZINC000114456418 1412436892 /nfs/dbraw/zinc/43/68/92/1412436892.db2.gz NXVPFFUNQFHUNI-UHFFFAOYSA-N 2 1 399.579 3.355 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)CC1 ZINC000114475720 1412440767 /nfs/dbraw/zinc/44/07/67/1412440767.db2.gz UFLUCEBGYXVMIN-KRWDZBQOSA-N 2 1 388.556 3.416 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)NC(=O)Nc2ccccc2F)CC1 ZINC000114475571 1412440904 /nfs/dbraw/zinc/44/09/04/1412440904.db2.gz DZCXSPCVEPFPAC-MRXNPFEDSA-N 2 1 392.519 3.306 20 0 GGADMP C[C@H](CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)[NH+](C)C1CC1 ZINC000114595834 1412471155 /nfs/dbraw/zinc/47/11/55/1412471155.db2.gz RORHDVDAQQQLHH-RHSMWYFYSA-N 2 1 398.473 3.062 20 0 GGADMP C[C@H](CNC(=O)N[C@@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1)[N@H+](C)C1CC1 ZINC000114595834 1412471160 /nfs/dbraw/zinc/47/11/60/1412471160.db2.gz RORHDVDAQQQLHH-RHSMWYFYSA-N 2 1 398.473 3.062 20 0 GGADMP C[C@H](CNC(=O)N[C@@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1)[N@@H+](C)C1CC1 ZINC000114595834 1412471165 /nfs/dbraw/zinc/47/11/65/1412471165.db2.gz RORHDVDAQQQLHH-RHSMWYFYSA-N 2 1 398.473 3.062 20 0 GGADMP CCOc1cc2[nH+]ccc(N3CCC([N@@H+](C)CCCO)CC3)c2cc1OCC ZINC000115519855 1412700635 /nfs/dbraw/zinc/70/06/35/1412700635.db2.gz PHNKIIZMGGGMCY-UHFFFAOYSA-N 2 1 387.524 3.315 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NC(=O)Nc2cccc(C[NH+](C)C)c2)[C@H](C)C1 ZINC000115640097 1412741411 /nfs/dbraw/zinc/74/14/11/1412741411.db2.gz RGZAAEOFNNGMJX-YLJYHZDGSA-N 2 1 376.545 3.007 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](CCc2ccc(OC)cc2)CC(C)(C)C)CC1 ZINC000115739358 1412777129 /nfs/dbraw/zinc/77/71/29/1412777129.db2.gz BEGGOOVZTJTEQX-UHFFFAOYSA-N 2 1 389.584 3.186 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)N(C)C[C@H]3CCC[N@@H+](C)C3)c2)CC1 ZINC000115819930 1412798207 /nfs/dbraw/zinc/79/82/07/1412798207.db2.gz NKAQROOPDOQBLW-QFIPXVFZSA-N 2 1 386.584 3.402 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc2)C[C@@H](C)O1 ZINC000116129641 1412834764 /nfs/dbraw/zinc/83/47/64/1412834764.db2.gz XZEHIQCVIJCZNF-OPYAIIAOSA-N 2 1 389.584 3.392 20 0 GGADMP C[NH+](C)CC[C@H](NC(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)C(C)(C)C ZINC000116489951 1412867552 /nfs/dbraw/zinc/86/75/52/1412867552.db2.gz FPBLYDIFFGXZLI-FQEVSTJZSA-N 2 1 390.572 3.049 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC1 ZINC000116521051 1412871540 /nfs/dbraw/zinc/87/15/40/1412871540.db2.gz IQNZBWIIQVJCFW-XLIONFOSSA-N 2 1 384.524 3.407 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000116540953 1412874617 /nfs/dbraw/zinc/87/46/17/1412874617.db2.gz SHJWLEYXBKTLNV-QZTJIDSGSA-N 2 1 383.540 3.352 20 0 GGADMP C[C@H](c1ccc(NC(=O)NC[C@H](C)[NH+]2CCC(C)CC2)cc1)[NH+]1CCOCC1 ZINC000118029494 1413098553 /nfs/dbraw/zinc/09/85/53/1413098553.db2.gz GYSDQKNHVGYRFI-RBUKOAKNSA-N 2 1 388.556 3.322 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)CCn1cc[nH+]c1C(C)C)[NH+]1CCCC1 ZINC000118756290 1413215555 /nfs/dbraw/zinc/21/55/55/1413215555.db2.gz VVGUPTNWDWPHIK-IBGZPJMESA-N 2 1 384.524 3.359 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)CCn1cc[nH+]c1C(C)C)[NH+]1CCCC1 ZINC000118756293 1413215644 /nfs/dbraw/zinc/21/56/44/1413215644.db2.gz VVGUPTNWDWPHIK-LJQANCHMSA-N 2 1 384.524 3.359 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)CC1([NH+]2CCOCC2)CCCC1 ZINC000118772036 1413218159 /nfs/dbraw/zinc/21/81/59/1413218159.db2.gz JYJAQFJBCVBMPW-UHFFFAOYSA-N 2 1 387.568 3.178 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cc(=O)oc4cc(C)c(C(C)C)cc34)C2)CC1 ZINC000118834567 1413237770 /nfs/dbraw/zinc/23/77/70/1413237770.db2.gz JDBRTCRSAZSWJL-HXUWFJFHSA-N 2 1 397.563 3.437 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)Nc2ccc3[nH]c(C(F)(F)F)nc3c2)CC1 ZINC000118868235 1413254887 /nfs/dbraw/zinc/25/48/87/1413254887.db2.gz ZLVDXMPWBBSCBX-UHFFFAOYSA-N 2 1 397.445 3.184 20 0 GGADMP CCc1ccc([C@@H](CNC(=O)c2cnn(-c3cc[nH+]cc3)c2C)[NH+](C)C)cc1 ZINC000119000126 1413299779 /nfs/dbraw/zinc/29/97/79/1413299779.db2.gz VYJLCFWBGCVAPX-OAQYLSRUSA-N 2 1 377.492 3.171 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177397459 1428717860 /nfs/dbraw/zinc/71/78/60/1428717860.db2.gz XGLQEMJIGBEUCE-KRWDZBQOSA-N 2 1 393.597 3.385 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)[NH+]2CCCC2)o1 ZINC000119185027 1413369507 /nfs/dbraw/zinc/36/95/07/1413369507.db2.gz GXVLABOWKLPVCU-MOPGFXCFSA-N 2 1 376.545 3.002 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC3CC[NH+](C4CCCC4)CC3)CC2)cs1 ZINC000177407147 1428722608 /nfs/dbraw/zinc/72/26/08/1428722608.db2.gz RNYKVYUMUWCVIL-UHFFFAOYSA-N 2 1 390.597 3.187 20 0 GGADMP CCCn1c(C[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)nc2ccccc21 ZINC000119334012 1413415019 /nfs/dbraw/zinc/41/50/19/1413415019.db2.gz XEGCXMBJMXIDJQ-UHFFFAOYSA-N 2 1 393.535 3.028 20 0 GGADMP CCOc1cc(C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc(Br)c1OC ZINC000119412447 1413438654 /nfs/dbraw/zinc/43/86/54/1413438654.db2.gz SCMRVJMLUWFWOZ-ZDUSSCGKSA-N 2 1 383.330 3.430 20 0 GGADMP C[NH+](C)C1(C(=O)NC[C@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CCC1 ZINC000119609560 1413503073 /nfs/dbraw/zinc/50/30/73/1413503073.db2.gz DLAHSQVGOHXHIS-LJQANCHMSA-N 2 1 383.561 3.448 20 0 GGADMP C[NH+](C)C1(C(=O)NC[C@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CCC1 ZINC000119609560 1413503077 /nfs/dbraw/zinc/50/30/77/1413503077.db2.gz DLAHSQVGOHXHIS-LJQANCHMSA-N 2 1 383.561 3.448 20 0 GGADMP Cc1nn(-c2ccc(F)cc2)c(Cl)c1C[NH2+]CCCCN1CC[NH+](C)CC1 ZINC000119630251 1413509320 /nfs/dbraw/zinc/50/93/20/1413509320.db2.gz GUIIFYJRMXBOCZ-UHFFFAOYSA-N 2 1 393.938 3.090 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)N[C@@H]2CC[NH+](CC3CC3)C2)CC1 ZINC000119880508 1413603282 /nfs/dbraw/zinc/60/32/82/1413603282.db2.gz VZQUAUKAXAFJCB-GHTZIAJQSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@H]1CCCC[NH+]1CCC1CCN(C(=O)N[C@@H]2CC[N@H+](CC3CC3)C2)CC1 ZINC000119880508 1413603284 /nfs/dbraw/zinc/60/32/84/1413603284.db2.gz VZQUAUKAXAFJCB-GHTZIAJQSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@H]1CCCC[NH+]1CCC1CCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000119880508 1413603288 /nfs/dbraw/zinc/60/32/88/1413603288.db2.gz VZQUAUKAXAFJCB-GHTZIAJQSA-N 2 1 376.589 3.157 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000120069234 1413674696 /nfs/dbraw/zinc/67/46/96/1413674696.db2.gz XDHFARNSHJWOSR-UHFFFAOYSA-N 2 1 383.540 3.196 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CC[N@@H+](C)C[C@@H]1C)c1cccc(OC)c1 ZINC000120171620 1413716846 /nfs/dbraw/zinc/71/68/46/1413716846.db2.gz QGWSNBMTUZPNMS-DZFGPLHGSA-N 2 1 390.572 3.060 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)CC1 ZINC000120240231 1413746882 /nfs/dbraw/zinc/74/68/82/1413746882.db2.gz MMHWELLBUMCRHV-WIYYLYMNSA-N 2 1 387.568 3.459 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)C(=O)NCC(F)(F)F ZINC000120317804 1413783249 /nfs/dbraw/zinc/78/32/49/1413783249.db2.gz OHYGJWHRKISWQB-XHSDSOJGSA-N 2 1 385.474 3.321 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)N(C)[C@H]3CC[N@@H+](C)C[C@@H]3C)c2)CC1 ZINC000120498734 1413831025 /nfs/dbraw/zinc/83/10/25/1413831025.db2.gz QYBGMWGKQHTLRN-UGKGYDQZSA-N 2 1 386.584 3.400 20 0 GGADMP Cc1c(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000120674044 1413871894 /nfs/dbraw/zinc/87/18/94/1413871894.db2.gz QGXYSNARDMCMDV-OAQYLSRUSA-N 2 1 375.476 3.143 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)C1 ZINC000120761154 1413895061 /nfs/dbraw/zinc/89/50/61/1413895061.db2.gz OZHAPFGOMKXHHG-QGZVFWFLSA-N 2 1 384.524 3.306 20 0 GGADMP COC(=O)c1cc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)oc1C ZINC000177494005 1428768065 /nfs/dbraw/zinc/76/80/65/1428768065.db2.gz NTOOXRJXZXXNJH-IYBDPMFKSA-N 2 1 378.513 3.086 20 0 GGADMP CC(=O)c1ccccc1OCC[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000177497912 1428770138 /nfs/dbraw/zinc/77/01/38/1428770138.db2.gz AKRZHCFVLVWNIY-KDURUIRLSA-N 2 1 388.552 3.479 20 0 GGADMP CCc1ccccc1NC(=O)C[NH+]1CCC(CC[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000177502886 1428771825 /nfs/dbraw/zinc/77/18/25/1428771825.db2.gz LPMSHAREXFRAGS-OALUTQOASA-N 2 1 387.568 3.399 20 0 GGADMP CCc1ccccc1NC(=O)C[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000177502860 1428772129 /nfs/dbraw/zinc/77/21/29/1428772129.db2.gz LPMSHAREXFRAGS-KDURUIRLSA-N 2 1 387.568 3.399 20 0 GGADMP CCc1ccccc1NC(=O)C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000177502860 1428772131 /nfs/dbraw/zinc/77/21/31/1428772131.db2.gz LPMSHAREXFRAGS-KDURUIRLSA-N 2 1 387.568 3.399 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000177503820 1428772976 /nfs/dbraw/zinc/77/29/76/1428772976.db2.gz SDLBTVBRLIURFW-ZCNNSNEGSA-N 2 1 387.568 3.075 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@@H]1CCC[N@@H+]1CC1CCCCC1 ZINC000121093037 1414004881 /nfs/dbraw/zinc/00/48/81/1414004881.db2.gz DEQVDUBUQGUOOS-FQEVSTJZSA-N 2 1 375.561 3.268 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC000121093037 1414004883 /nfs/dbraw/zinc/00/48/83/1414004883.db2.gz DEQVDUBUQGUOOS-FQEVSTJZSA-N 2 1 375.561 3.268 20 0 GGADMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000121112636 1414011782 /nfs/dbraw/zinc/01/17/82/1414011782.db2.gz MFQQYVBBYPNSCB-OAHLLOKOSA-N 2 1 376.932 3.255 20 0 GGADMP C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000177509071 1428775157 /nfs/dbraw/zinc/77/51/57/1428775157.db2.gz KCCGNOJMNUCANL-KURKYZTESA-N 2 1 399.539 3.404 20 0 GGADMP O=C(NC[C@H]1CC[N@H+](C2CC2)C1)N1CC[NH+](Cc2cccc3ccccc32)CC1 ZINC000121158333 1414028099 /nfs/dbraw/zinc/02/80/99/1414028099.db2.gz MOPAMQIRZMODQL-LJQANCHMSA-N 2 1 392.547 3.151 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1 ZINC000121185758 1414037786 /nfs/dbraw/zinc/03/77/86/1414037786.db2.gz IRWTYEPRXPOKAC-UHFFFAOYSA-N 2 1 389.547 3.422 20 0 GGADMP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)C[C@@H](C)O1 ZINC000177509867 1428776157 /nfs/dbraw/zinc/77/61/57/1428776157.db2.gz KWXHGTOEMOTGJU-QZTJIDSGSA-N 2 1 384.524 3.448 20 0 GGADMP CC[C@@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)[N@@H+]1CCc2ccccc2C1 ZINC000121251413 1414059571 /nfs/dbraw/zinc/05/95/71/1414059571.db2.gz MQNWJXUXTFNUIA-FQEVSTJZSA-N 2 1 389.503 3.142 20 0 GGADMP CC[C@@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)[N@H+]1CCc2ccccc2C1 ZINC000121251413 1414059573 /nfs/dbraw/zinc/05/95/73/1414059573.db2.gz MQNWJXUXTFNUIA-FQEVSTJZSA-N 2 1 389.503 3.142 20 0 GGADMP C[C@@H](C(=O)NC1CCCCC1)[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000177505997 1428773738 /nfs/dbraw/zinc/77/37/38/1428773738.db2.gz IPVBLJQOWQKTQS-OTWHNJEPSA-N 2 1 379.589 3.035 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[C@@H](C[N@H+](C)CC)C1 ZINC000177519086 1428780079 /nfs/dbraw/zinc/78/00/79/1428780079.db2.gz VYCWRRGVHBOPPD-SFHVURJKSA-N 2 1 376.545 3.213 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000121415623 1414114559 /nfs/dbraw/zinc/11/45/59/1414114559.db2.gz PJYIWEXKMVCZRC-KRWDZBQOSA-N 2 1 390.959 3.088 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)Cc1ccccc1 ZINC000121465937 1414137230 /nfs/dbraw/zinc/13/72/30/1414137230.db2.gz BTZNAYWTGFCVOH-OAQYLSRUSA-N 2 1 391.519 3.259 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000121490581 1414147386 /nfs/dbraw/zinc/14/73/86/1414147386.db2.gz UNXWURKLKFXLSZ-UONOGXRCSA-N 2 1 378.904 3.497 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc(CC[NH+]3CCSCC3)cc2)C1 ZINC000177542536 1428787004 /nfs/dbraw/zinc/78/70/04/1428787004.db2.gz YSMIHXAOMAGOOH-LJQANCHMSA-N 2 1 390.597 3.083 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc(CC[NH+]3CCSCC3)cc2)C1 ZINC000177542524 1428787203 /nfs/dbraw/zinc/78/72/03/1428787203.db2.gz YSMIHXAOMAGOOH-IBGZPJMESA-N 2 1 390.597 3.083 20 0 GGADMP C[C@H](C(=O)Nc1nc2ccc(F)cc2s1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000121631630 1414206879 /nfs/dbraw/zinc/20/68/79/1414206879.db2.gz VPWWYYKPFHCTGQ-CYBMUJFWSA-N 2 1 378.517 3.426 20 0 GGADMP Cc1ccccc1O[C@H]1CCCC[C@@H]1[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000121684848 1414223030 /nfs/dbraw/zinc/22/30/30/1414223030.db2.gz GVSROCJABGQJCN-UNMCSNQZSA-N 2 1 395.551 3.017 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)N2C[C@@H](C)[NH+](CCOC)[C@@H](C)C2)cc1)C(C)C ZINC000121702226 1414229283 /nfs/dbraw/zinc/22/92/83/1414229283.db2.gz ZFLXPXPZKFDJHF-KDURUIRLSA-N 2 1 375.557 3.098 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2C[C@@H](C)[NH+](CCOC)[C@@H](C)C2)cc1)C(C)C ZINC000121702226 1414229287 /nfs/dbraw/zinc/22/92/87/1414229287.db2.gz ZFLXPXPZKFDJHF-KDURUIRLSA-N 2 1 375.557 3.098 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N2C[C@@H](C)[N@@H+](CCOC)[C@@H](C)C2)cc1)C(C)C ZINC000121702226 1414229293 /nfs/dbraw/zinc/22/92/93/1414229293.db2.gz ZFLXPXPZKFDJHF-KDURUIRLSA-N 2 1 375.557 3.098 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N2C[C@@H](C)[N@H+](CCOC)[C@@H](C)C2)cc1)C(C)C ZINC000121702226 1414229297 /nfs/dbraw/zinc/22/92/97/1414229297.db2.gz ZFLXPXPZKFDJHF-KDURUIRLSA-N 2 1 375.557 3.098 20 0 GGADMP Cn1nc(C(C)(C)C)cc1NC(=O)C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000121791639 1414258829 /nfs/dbraw/zinc/25/88/29/1414258829.db2.gz BBKJGHIYNDBRHL-UHFFFAOYSA-N 2 1 389.588 3.244 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]CC(C)(C)[NH+]2CCCCC2)c1 ZINC000121942778 1414316313 /nfs/dbraw/zinc/31/63/13/1414316313.db2.gz ISBGSLPCGWYNEK-INIZCTEOSA-N 2 1 377.529 3.275 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(F)cc2F)CC1 ZINC000122095563 1414361445 /nfs/dbraw/zinc/36/14/45/1414361445.db2.gz TWJZJOJFXIVZFC-INIZCTEOSA-N 2 1 397.510 3.362 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(F)cc2F)CC1 ZINC000122095563 1414361452 /nfs/dbraw/zinc/36/14/52/1414361452.db2.gz TWJZJOJFXIVZFC-INIZCTEOSA-N 2 1 397.510 3.362 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2ccc(F)cc2F)CC1 ZINC000122095835 1414361867 /nfs/dbraw/zinc/36/18/67/1414361867.db2.gz TWJZJOJFXIVZFC-MRXNPFEDSA-N 2 1 397.510 3.362 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2ccc(F)cc2F)CC1 ZINC000122095835 1414361877 /nfs/dbraw/zinc/36/18/77/1414361877.db2.gz TWJZJOJFXIVZFC-MRXNPFEDSA-N 2 1 397.510 3.362 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000122179806 1414381288 /nfs/dbraw/zinc/38/12/88/1414381288.db2.gz ROAZHTQGKQFEKC-LJQANCHMSA-N 2 1 385.556 3.399 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000122179806 1414381297 /nfs/dbraw/zinc/38/12/97/1414381297.db2.gz ROAZHTQGKQFEKC-LJQANCHMSA-N 2 1 385.556 3.399 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](CC(=O)Nc2cccc(C)c2C)CC1 ZINC000122215394 1414391553 /nfs/dbraw/zinc/39/15/53/1414391553.db2.gz LMBBMXNWOZLMBF-UHFFFAOYSA-N 2 1 375.557 3.312 20 0 GGADMP CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCOCC1 ZINC000122800928 1414567954 /nfs/dbraw/zinc/56/79/54/1414567954.db2.gz WFZXHLNFDAWSTK-WOJBJXKFSA-N 2 1 389.540 3.054 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccc3c(c2)OCCO3)[C@H](C)C1 ZINC000122876904 1414587221 /nfs/dbraw/zinc/58/72/21/1414587221.db2.gz CFWSCTJTOYKLOX-UYAOXDASSA-N 2 1 390.568 3.462 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)c1ccccc1 ZINC000123043445 1414626166 /nfs/dbraw/zinc/62/61/66/1414626166.db2.gz XIPBKAWMFOZGLC-OAQYLSRUSA-N 2 1 397.567 3.467 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H]2CCc3[nH]c4ccc(OC)cc4c3C2)CC1 ZINC000123093455 1414639829 /nfs/dbraw/zinc/63/98/29/1414639829.db2.gz ZPONAZYKAPNBNY-SFHVURJKSA-N 2 1 384.568 3.041 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCC[N@@H+](C)C2CCCCC2)cn1 ZINC000123181049 1414662003 /nfs/dbraw/zinc/66/20/03/1414662003.db2.gz CFQVYJKMAPBUMK-UHFFFAOYSA-N 2 1 384.528 3.030 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCC[N@H+](C)C2CCCCC2)cn1 ZINC000123181049 1414662009 /nfs/dbraw/zinc/66/20/09/1414662009.db2.gz CFQVYJKMAPBUMK-UHFFFAOYSA-N 2 1 384.528 3.030 20 0 GGADMP C[C@@H](CNC(=O)NCc1cccc(C[NH+](C)C)c1)[N@@H+]1CCc2sccc2C1 ZINC000123191017 1414664386 /nfs/dbraw/zinc/66/43/86/1414664386.db2.gz HVVSRUJQTLDFPY-INIZCTEOSA-N 2 1 386.565 3.056 20 0 GGADMP C[C@@H](CNC(=O)NCc1cccc(C[NH+](C)C)c1)[N@H+]1CCc2sccc2C1 ZINC000123191017 1414664389 /nfs/dbraw/zinc/66/43/89/1414664389.db2.gz HVVSRUJQTLDFPY-INIZCTEOSA-N 2 1 386.565 3.056 20 0 GGADMP Cc1c(C(=O)NC2CC[NH+](Cc3ccccc3C)CC2)cnn1-c1cc[nH+]cc1 ZINC000123231612 1414673950 /nfs/dbraw/zinc/67/39/50/1414673950.db2.gz DKHVIZGDBADZSK-UHFFFAOYSA-N 2 1 389.503 3.279 20 0 GGADMP CCOC(=O)c1[nH]c(C)c(C(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)c1C ZINC000123242785 1414676621 /nfs/dbraw/zinc/67/66/21/1414676621.db2.gz KPRJCTSTBOKDDZ-UHFFFAOYSA-N 2 1 377.529 3.045 20 0 GGADMP CC[N@H+]1CC[C@@H](CNCc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000123411792 1414721572 /nfs/dbraw/zinc/72/15/72/1414721572.db2.gz LBRQIZRQMFXGCE-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000123411792 1414721575 /nfs/dbraw/zinc/72/15/75/1414721575.db2.gz LBRQIZRQMFXGCE-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000123411792 1414721583 /nfs/dbraw/zinc/72/15/83/1414721583.db2.gz LBRQIZRQMFXGCE-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CCC[C@H]3NC(=O)OC(C)(C)C)CC2)nc(C)[nH+]1 ZINC000123413077 1414722805 /nfs/dbraw/zinc/72/28/05/1414722805.db2.gz IEFCEWWKOGNEPY-QZTJIDSGSA-N 2 1 389.544 3.098 20 0 GGADMP COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)[NH+]2CCC(CCC[NH+](C)C)CC2)c1C ZINC000123440224 1414732684 /nfs/dbraw/zinc/73/26/84/1414732684.db2.gz VYMXNHVGBJXITC-MRXNPFEDSA-N 2 1 377.529 3.043 20 0 GGADMP COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)[NH+]2CCC(CCC[NH+](C)C)CC2)c1C ZINC000123440441 1414732921 /nfs/dbraw/zinc/73/29/21/1414732921.db2.gz VYMXNHVGBJXITC-INIZCTEOSA-N 2 1 377.529 3.043 20 0 GGADMP CC[NH+](CC)Cc1cccc(CNC(=O)c2cnn(-c3cc[nH+]cc3)c2C)c1 ZINC000123485036 1414748460 /nfs/dbraw/zinc/74/84/60/1414748460.db2.gz WORZMJDWAQZYSG-UHFFFAOYSA-N 2 1 377.492 3.348 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000123532985 1414765754 /nfs/dbraw/zinc/76/57/54/1414765754.db2.gz RNPIBOJEKKRZER-RTBURBONSA-N 2 1 388.556 3.179 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000123532985 1414765760 /nfs/dbraw/zinc/76/57/60/1414765760.db2.gz RNPIBOJEKKRZER-RTBURBONSA-N 2 1 388.556 3.179 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000123805199 1414827360 /nfs/dbraw/zinc/82/73/60/1414827360.db2.gz IZMHACVNQXUBQS-OALUTQOASA-N 2 1 397.567 3.380 20 0 GGADMP C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123848153 1414834158 /nfs/dbraw/zinc/83/41/58/1414834158.db2.gz YCVLCTJVDZRKEO-DXMDBGQQSA-N 2 1 384.568 3.148 20 0 GGADMP C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123848153 1414834161 /nfs/dbraw/zinc/83/41/61/1414834161.db2.gz YCVLCTJVDZRKEO-DXMDBGQQSA-N 2 1 384.568 3.148 20 0 GGADMP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2c(F)cccc2N2CCCC2)cc1 ZINC000123869012 1414839081 /nfs/dbraw/zinc/83/90/81/1414839081.db2.gz FZXVMVFAHXRKOW-UHFFFAOYSA-N 2 1 398.526 3.007 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000123956583 1414857181 /nfs/dbraw/zinc/85/71/81/1414857181.db2.gz DQGAJWQGQXLJDJ-ZDUSSCGKSA-N 2 1 380.330 3.383 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)N2N=C(c3ccco3)C[C@H]2c2ccco2)CC1 ZINC000124154792 1414896738 /nfs/dbraw/zinc/89/67/38/1414896738.db2.gz BCFPCTGXNLUXRR-IBGZPJMESA-N 2 1 398.507 3.214 20 0 GGADMP COc1cc([C@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)ccc1OC(F)F ZINC000124373020 1414951725 /nfs/dbraw/zinc/95/17/25/1414951725.db2.gz XVUPYPGJMXKWQH-HNNXBMFYSA-N 2 1 385.499 3.221 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000124502093 1414982743 /nfs/dbraw/zinc/98/27/43/1414982743.db2.gz GPVHNDOTBKGLPF-CTNGQTDRSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000124502093 1414982748 /nfs/dbraw/zinc/98/27/48/1414982748.db2.gz GPVHNDOTBKGLPF-CTNGQTDRSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000124502093 1414982751 /nfs/dbraw/zinc/98/27/51/1414982751.db2.gz GPVHNDOTBKGLPF-CTNGQTDRSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000124502093 1414982755 /nfs/dbraw/zinc/98/27/55/1414982755.db2.gz GPVHNDOTBKGLPF-CTNGQTDRSA-N 2 1 375.532 3.274 20 0 GGADMP COc1cc(OC)c([C@@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)cc1Cl ZINC000124510133 1414984304 /nfs/dbraw/zinc/98/43/04/1414984304.db2.gz QOEZVXPBIVEBND-OAHLLOKOSA-N 2 1 383.964 3.281 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCc2cccc(C[NH+](C)C)c2)C[N@H+]1Cc1ccccc1 ZINC000124883506 1415066530 /nfs/dbraw/zinc/06/65/30/1415066530.db2.gz IBKCHXUCGBZINS-PGRDOPGGSA-N 2 1 380.536 3.210 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@H]2CCc3cc(F)ccc32)c1 ZINC000124989850 1415087651 /nfs/dbraw/zinc/08/76/51/1415087651.db2.gz GYHTVSQUCIKWDY-QFIPXVFZSA-N 2 1 397.494 3.264 20 0 GGADMP C[C@@H](Cc1ccsc1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000124991002 1415087794 /nfs/dbraw/zinc/08/77/94/1415087794.db2.gz KJZCEWFFGSRXAZ-KRWDZBQOSA-N 2 1 387.549 3.130 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@H]2CCc3ccccc32)c1 ZINC000125005183 1415090202 /nfs/dbraw/zinc/09/02/02/1415090202.db2.gz FCISKJDYPMRLTG-QFIPXVFZSA-N 2 1 379.504 3.125 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)c1 ZINC000125042687 1415098029 /nfs/dbraw/zinc/09/80/29/1415098029.db2.gz SEJGGQXWTQVBSB-RTWAWAEBSA-N 2 1 385.552 3.406 20 0 GGADMP OC[C@H]1c2ccccc2CC[NH+]1CCCCC[N@H+]1CCc2ccccc2[C@H]1CO ZINC000177827347 1428866058 /nfs/dbraw/zinc/86/60/58/1428866058.db2.gz JRWCHDQKZBQBPI-PLQXJYEYSA-N 2 1 394.559 3.340 20 0 GGADMP OC[C@H]1c2ccccc2CC[N@H+]1CCCCC[NH+]1CCc2ccccc2[C@H]1CO ZINC000177827347 1428866060 /nfs/dbraw/zinc/86/60/60/1428866060.db2.gz JRWCHDQKZBQBPI-PLQXJYEYSA-N 2 1 394.559 3.340 20 0 GGADMP OC[C@H]1c2ccccc2CC[N@@H+]1CCCCC[NH+]1CCc2ccccc2[C@H]1CO ZINC000177827347 1428866063 /nfs/dbraw/zinc/86/60/63/1428866063.db2.gz JRWCHDQKZBQBPI-PLQXJYEYSA-N 2 1 394.559 3.340 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)N2CCC(Cc3[nH+]ccn3C)CC2)C1 ZINC000125277926 1415150094 /nfs/dbraw/zinc/15/00/94/1415150094.db2.gz FMOWBTRJGJWCPB-QZTJIDSGSA-N 2 1 389.588 3.141 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000125294028 1415155578 /nfs/dbraw/zinc/15/55/78/1415155578.db2.gz IGKFRACJKLMUDI-QWFCFKBJSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000125294028 1415155591 /nfs/dbraw/zinc/15/55/91/1415155591.db2.gz IGKFRACJKLMUDI-QWFCFKBJSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000125294028 1415155598 /nfs/dbraw/zinc/15/55/98/1415155598.db2.gz IGKFRACJKLMUDI-QWFCFKBJSA-N 2 1 376.589 3.155 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(C(=O)N3CCCC3)cc2)[C@H](C)C1 ZINC000177845682 1428871351 /nfs/dbraw/zinc/87/13/51/1428871351.db2.gz MXERPCXYIDBDHF-KNQAVFIVSA-N 2 1 387.568 3.149 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)C1 ZINC000177849302 1428872106 /nfs/dbraw/zinc/87/21/06/1428872106.db2.gz ZFDURNYTEARICR-SIKLNZKXSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000177849302 1428872108 /nfs/dbraw/zinc/87/21/08/1428872108.db2.gz ZFDURNYTEARICR-SIKLNZKXSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000177849302 1428872110 /nfs/dbraw/zinc/87/21/10/1428872110.db2.gz ZFDURNYTEARICR-SIKLNZKXSA-N 2 1 386.584 3.402 20 0 GGADMP O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000125498676 1415214387 /nfs/dbraw/zinc/21/43/87/1415214387.db2.gz XEVCYNKJLMCWJR-GHTZIAJQSA-N 2 1 379.508 3.031 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1nc(-c2ccco2)sc1C ZINC000125580915 1415230667 /nfs/dbraw/zinc/23/06/67/1415230667.db2.gz KZLATUWWKXGILK-MRXNPFEDSA-N 2 1 390.553 3.200 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1nc(-c2ccco2)sc1C ZINC000125581155 1415230814 /nfs/dbraw/zinc/23/08/14/1415230814.db2.gz KZLATUWWKXGILK-INIZCTEOSA-N 2 1 390.553 3.200 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(OC)c1 ZINC000125749135 1415269576 /nfs/dbraw/zinc/26/95/76/1415269576.db2.gz BVZLFBFJNZHIIP-IRXDYDNUSA-N 2 1 377.529 3.131 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)NC[C@@H]3CC[NH+](C4CC4)C3)cc2)C1 ZINC000125782206 1415279316 /nfs/dbraw/zinc/27/93/16/1415279316.db2.gz QRIPAIRCOJBWFG-JQVVWYNYSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CC[N@@H+](C4CC4)C3)cc2)C1 ZINC000125782206 1415279318 /nfs/dbraw/zinc/27/93/18/1415279318.db2.gz QRIPAIRCOJBWFG-JQVVWYNYSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)cc2)C1 ZINC000125782206 1415279323 /nfs/dbraw/zinc/27/93/23/1415279323.db2.gz QRIPAIRCOJBWFG-JQVVWYNYSA-N 2 1 398.595 3.448 20 0 GGADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1OCC(=O)N(C)C ZINC000125913139 1415311277 /nfs/dbraw/zinc/31/12/77/1415311277.db2.gz DBTFUSOPYOOOEZ-QUCCMNQESA-N 2 1 375.557 3.315 20 0 GGADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1OCC(=O)N(C)C ZINC000125913139 1415311284 /nfs/dbraw/zinc/31/12/84/1415311284.db2.gz DBTFUSOPYOOOEZ-QUCCMNQESA-N 2 1 375.557 3.315 20 0 GGADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1OCC(=O)N(C)C ZINC000125912670 1415311330 /nfs/dbraw/zinc/31/13/30/1415311330.db2.gz DBTFUSOPYOOOEZ-ICSRJNTNSA-N 2 1 375.557 3.315 20 0 GGADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1OCC(=O)N(C)C ZINC000125912670 1415311337 /nfs/dbraw/zinc/31/13/37/1415311337.db2.gz DBTFUSOPYOOOEZ-ICSRJNTNSA-N 2 1 375.557 3.315 20 0 GGADMP CCC[N@@H+]1CCC[C@@H]1C(=O)Nc1ccc(C)c(NC(=O)C[NH+]2CCCCC2)c1 ZINC000125949671 1415320393 /nfs/dbraw/zinc/32/03/93/1415320393.db2.gz HEGWAARKSVDEIA-HXUWFJFHSA-N 2 1 386.540 3.232 20 0 GGADMP CCC[N@H+]1CCC[C@@H]1C(=O)Nc1ccc(C)c(NC(=O)C[NH+]2CCCCC2)c1 ZINC000125949671 1415320402 /nfs/dbraw/zinc/32/04/02/1415320402.db2.gz HEGWAARKSVDEIA-HXUWFJFHSA-N 2 1 386.540 3.232 20 0 GGADMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1 ZINC000177980103 1428913830 /nfs/dbraw/zinc/91/38/30/1428913830.db2.gz ONNBGRKQYLQZTC-KRWDZBQOSA-N 2 1 389.565 3.286 20 0 GGADMP CSCC[C@H](C)[N@@H+](C)CC(=O)N1CCC[NH+](Cc2ccccc2C)CC1 ZINC000126370329 1415428686 /nfs/dbraw/zinc/42/86/86/1415428686.db2.gz AGUDGUHUPOCGCP-IBGZPJMESA-N 2 1 377.598 3.103 20 0 GGADMP CSCC[C@H](C)[NH+](C)CC(=O)N1CCC[N@H+](Cc2ccccc2C)CC1 ZINC000126370329 1415428691 /nfs/dbraw/zinc/42/86/91/1415428691.db2.gz AGUDGUHUPOCGCP-IBGZPJMESA-N 2 1 377.598 3.103 20 0 GGADMP CSCC[C@H](C)[NH+](C)CC(=O)N1CCC[N@@H+](Cc2ccccc2C)CC1 ZINC000126370329 1415428696 /nfs/dbraw/zinc/42/86/96/1415428696.db2.gz AGUDGUHUPOCGCP-IBGZPJMESA-N 2 1 377.598 3.103 20 0 GGADMP Cc1nc(C)c([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)s1 ZINC000178006536 1428929524 /nfs/dbraw/zinc/92/95/24/1428929524.db2.gz RTLXVNSDDXTEEC-KUHUBIRLSA-N 2 1 386.565 3.308 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000126480949 1415466458 /nfs/dbraw/zinc/46/64/58/1415466458.db2.gz LEYICUMXOBBWQZ-FCEUIQTBSA-N 2 1 399.604 3.252 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126480949 1415466464 /nfs/dbraw/zinc/46/64/64/1415466464.db2.gz LEYICUMXOBBWQZ-FCEUIQTBSA-N 2 1 399.604 3.252 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000126481408 1415466652 /nfs/dbraw/zinc/46/66/52/1415466652.db2.gz LEYICUMXOBBWQZ-HJNYFJLDSA-N 2 1 399.604 3.252 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126481408 1415466655 /nfs/dbraw/zinc/46/66/55/1415466655.db2.gz LEYICUMXOBBWQZ-HJNYFJLDSA-N 2 1 399.604 3.252 20 0 GGADMP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc2c(c1)OCCO2 ZINC000126679637 1415524667 /nfs/dbraw/zinc/52/46/67/1415524667.db2.gz KCBSBUSRYJRTBA-JOCHJYFZSA-N 2 1 395.547 3.446 20 0 GGADMP COCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1 ZINC000126679137 1415524804 /nfs/dbraw/zinc/52/48/04/1415524804.db2.gz OWHNETZZGJJUFK-HXUWFJFHSA-N 2 1 397.563 3.310 20 0 GGADMP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)c1 ZINC000178036330 1428948636 /nfs/dbraw/zinc/94/86/36/1428948636.db2.gz ZHCFGTWBLAMLJG-AQNXPRMDSA-N 2 1 375.557 3.500 20 0 GGADMP O=C(NCCCCC[NH+]1CCCCC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126739145 1415544201 /nfs/dbraw/zinc/54/42/01/1415544201.db2.gz BRALGLYOBSQAJM-PZJWPPBQSA-N 2 1 376.589 3.301 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c2cccs2)CC1 ZINC000126775386 1415555297 /nfs/dbraw/zinc/55/52/97/1415555297.db2.gz QSHGJCBEVXYOGH-HKUYNNGSSA-N 2 1 390.597 3.305 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=O)N2CC[C@H](C[N@H+](C)CC)C2)cc1 ZINC000178034343 1428948115 /nfs/dbraw/zinc/94/81/15/1428948115.db2.gz WKYDLPHMLVSBAZ-GOSISDBHSA-N 2 1 376.545 3.213 20 0 GGADMP C[C@H]1C[NH+](CCCC[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000178036895 1428949673 /nfs/dbraw/zinc/94/96/73/1428949673.db2.gz QSWMBUKASPVDLH-PMACEKPBSA-N 3 1 391.575 3.312 20 0 GGADMP O=C([C@@H]1CCCN1Cc1ccc(F)cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126844195 1415582681 /nfs/dbraw/zinc/58/26/81/1415582681.db2.gz HDTMSIQQUGJIIS-QIJUGHKUSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[N@H+]1Cc1ccc(F)cc1)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000126844195 1415582683 /nfs/dbraw/zinc/58/26/83/1415582683.db2.gz HDTMSIQQUGJIIS-QIJUGHKUSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000126844195 1415582686 /nfs/dbraw/zinc/58/26/86/1415582686.db2.gz HDTMSIQQUGJIIS-QIJUGHKUSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccc(F)cc1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000126844195 1415582687 /nfs/dbraw/zinc/58/26/87/1415582687.db2.gz HDTMSIQQUGJIIS-QIJUGHKUSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccc(F)cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126844195 1415582689 /nfs/dbraw/zinc/58/26/89/1415582689.db2.gz HDTMSIQQUGJIIS-QIJUGHKUSA-N 2 1 385.527 3.265 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H](c1cccc(F)c1)[NH+](C)C ZINC000126847175 1415583083 /nfs/dbraw/zinc/58/30/83/1415583083.db2.gz ZLMOZHRCCBKGSG-PXNSSMCTSA-N 2 1 378.536 3.382 20 0 GGADMP Cc1c(C(=O)Nc2ccc(CC[NH+]3CCCC3)cc2)cnn1-c1cc[nH+]cc1 ZINC000126884934 1415594548 /nfs/dbraw/zinc/59/45/48/1415594548.db2.gz YIBWQUFWRSITJV-UHFFFAOYSA-N 2 1 375.476 3.466 20 0 GGADMP O=C(C1CCCC1)N1CC[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000126905512 1415600745 /nfs/dbraw/zinc/60/07/45/1415600745.db2.gz YHXKGKBRLPKIEI-QFIPXVFZSA-N 2 1 387.543 3.213 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000127507241 1415802371 /nfs/dbraw/zinc/80/23/71/1415802371.db2.gz DEKYXLAMOJLDOH-ZRBLBEILSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(N[C@@H]1CC[NH+](CC2CC2)C1)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000127507241 1415802373 /nfs/dbraw/zinc/80/23/73/1415802373.db2.gz DEKYXLAMOJLDOH-ZRBLBEILSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(N[C@@H]1CC[NH+](CC2CC2)C1)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000127507241 1415802374 /nfs/dbraw/zinc/80/23/74/1415802374.db2.gz DEKYXLAMOJLDOH-ZRBLBEILSA-N 2 1 396.579 3.167 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]C3CC(c4ccccc4)C3)c2)C1 ZINC000127512973 1415803120 /nfs/dbraw/zinc/80/31/20/1415803120.db2.gz KGIUUWRZROBXPM-DDRJZQQSSA-N 2 1 377.532 3.420 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000127669451 1415829721 /nfs/dbraw/zinc/82/97/21/1415829721.db2.gz HMIUKQKHZJSVJE-XLIONFOSSA-N 2 1 378.536 3.096 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3cc(O)ccc3Br)CC2)nc(C)[nH+]1 ZINC000127751887 1415844246 /nfs/dbraw/zinc/84/42/46/1415844246.db2.gz QIZDNPYDIWBTPG-UHFFFAOYSA-N 2 1 391.313 3.320 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCc2ccn(-c3ccc(F)cc3)n2)[C@H](C)C1 ZINC000127755649 1415844753 /nfs/dbraw/zinc/84/47/53/1415844753.db2.gz ZWFNNCCHNFOGRI-XMSQKQJNSA-N 2 1 388.531 3.281 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]C/C=C/c3ccc(F)cc3)c2)C1 ZINC000127821578 1415857176 /nfs/dbraw/zinc/85/71/76/1415857176.db2.gz NZDXSAIOMSXZMQ-HTXHHYGKSA-N 2 1 381.495 3.326 20 0 GGADMP CC[NH+](CC)[C@@H](C(=O)NC1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccccc1 ZINC000178186443 1429012386 /nfs/dbraw/zinc/01/23/86/1429012386.db2.gz UANGYTMHRXPASD-JOCHJYFZSA-N 2 1 395.551 3.262 20 0 GGADMP Cc1c([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@H](C(N)=O)C2)cnn1-c1cc(C)ccc1C ZINC000127954599 1415882455 /nfs/dbraw/zinc/88/24/55/1415882455.db2.gz AVKDSXJSDCKAME-QUCCMNQESA-N 2 1 397.567 3.036 20 0 GGADMP Cc1c([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)cnn1-c1cc(C)ccc1C ZINC000127954599 1415882457 /nfs/dbraw/zinc/88/24/57/1415882457.db2.gz AVKDSXJSDCKAME-QUCCMNQESA-N 2 1 397.567 3.036 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc(SCC(F)F)cc1 ZINC000127955346 1415882989 /nfs/dbraw/zinc/88/29/89/1415882989.db2.gz MORXDNXYXNGAAI-ZBFHGGJFSA-N 2 1 385.524 3.282 20 0 GGADMP CCC(CC)[C@H](CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)[NH+]1CCCC1 ZINC000128178864 1415932207 /nfs/dbraw/zinc/93/22/07/1415932207.db2.gz HQKZEDPKVNSUPS-FQEVSTJZSA-N 2 1 389.588 3.285 20 0 GGADMP Cc1c([C@H](C)[NH2+]CCCN2CCC[N@@H+](C)CC2)cnn1-c1cc(C)ccc1C ZINC000128248759 1415947907 /nfs/dbraw/zinc/94/79/07/1415947907.db2.gz XUAFHTVVADXSQJ-FQEVSTJZSA-N 2 1 383.584 3.476 20 0 GGADMP Cc1c([C@@H](C)[NH2+]CCCN2CCC[N@@H+](C)CC2)cnn1-c1cc(C)ccc1C ZINC000128248547 1415947983 /nfs/dbraw/zinc/94/79/83/1415947983.db2.gz XUAFHTVVADXSQJ-HXUWFJFHSA-N 2 1 383.584 3.476 20 0 GGADMP Cc1c(C(=O)N(CCCc2ccccc2)CC[NH+](C)C)cnn1-c1cc[nH+]cc1 ZINC000128519173 1416004463 /nfs/dbraw/zinc/00/44/63/1416004463.db2.gz YIGIPSCKIGDIRG-UHFFFAOYSA-N 2 1 391.519 3.212 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)[C@H]3C[N@H+](Cc4ccccc4)CCO3)CC2)CC1 ZINC000128715618 1416049596 /nfs/dbraw/zinc/04/95/96/1416049596.db2.gz VJBUFRPFIRMUKO-XPPIMPSXSA-N 2 1 399.579 3.047 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)[C@H]3C[N@@H+](Cc4ccccc4)CCO3)CC2)CC1 ZINC000128715618 1416049601 /nfs/dbraw/zinc/04/96/01/1416049601.db2.gz VJBUFRPFIRMUKO-XPPIMPSXSA-N 2 1 399.579 3.047 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccco1 ZINC000128727942 1416052288 /nfs/dbraw/zinc/05/22/88/1416052288.db2.gz PXTVGGZUWTZLGG-RBUKOAKNSA-N 2 1 378.561 3.330 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccco1 ZINC000128728417 1416052423 /nfs/dbraw/zinc/05/24/23/1416052423.db2.gz PXTVGGZUWTZLGG-RTBURBONSA-N 2 1 378.561 3.330 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccco1 ZINC000128727480 1416052733 /nfs/dbraw/zinc/05/27/33/1416052733.db2.gz IDNSRIBHGJZCQB-YZGWKJHDSA-N 2 1 388.556 3.321 20 0 GGADMP C[C@H](CCNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)[N@H+](C)Cc1ccccc1 ZINC000128733760 1416054168 /nfs/dbraw/zinc/05/41/68/1416054168.db2.gz ALSOVPQWTOEGRX-LJQANCHMSA-N 2 1 397.567 3.295 20 0 GGADMP C[C@H](CCNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)[N@@H+](C)Cc1ccccc1 ZINC000128733760 1416054180 /nfs/dbraw/zinc/05/41/80/1416054180.db2.gz ALSOVPQWTOEGRX-LJQANCHMSA-N 2 1 397.567 3.295 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCc2ccccc2-n2ccnc2)C[N@H+]1Cc1ccccc1 ZINC000128900955 1416096689 /nfs/dbraw/zinc/09/66/89/1416096689.db2.gz IFKBJJZSSSUYSF-GHTZIAJQSA-N 2 1 389.503 3.335 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)CC(C)C ZINC000129019153 1416126640 /nfs/dbraw/zinc/12/66/40/1416126640.db2.gz IKZLXPVXCYLBGF-IBGZPJMESA-N 2 1 377.577 3.141 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)CC(C)C ZINC000129019355 1416127209 /nfs/dbraw/zinc/12/72/09/1416127209.db2.gz IKZLXPVXCYLBGF-LJQANCHMSA-N 2 1 377.577 3.141 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@H+](C[C@H](O)COc3cccc4[nH]ccc43)C2)CC1 ZINC000129062424 1416136657 /nfs/dbraw/zinc/13/66/57/1416136657.db2.gz WOIKOUMDDYMDGP-UXHICEINSA-N 2 1 385.552 3.352 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](C[C@H](O)COc3cccc4[nH]ccc43)C2)CC1 ZINC000129062424 1416136662 /nfs/dbraw/zinc/13/66/62/1416136662.db2.gz WOIKOUMDDYMDGP-UXHICEINSA-N 2 1 385.552 3.352 20 0 GGADMP Cc1c(C(=O)N2c3ccc(C)cc3[C@H]3C[N@H+](C)CC[C@@H]32)cnn1-c1cc[nH+]cc1 ZINC000129128563 1416152082 /nfs/dbraw/zinc/15/20/82/1416152082.db2.gz CZLCQXJOBLXRCF-IRLDBZIGSA-N 2 1 387.487 3.332 20 0 GGADMP Cc1c(C(=O)N2c3ccc(C)cc3[C@H]3C[N@@H+](C)CC[C@@H]32)cnn1-c1cc[nH+]cc1 ZINC000129128563 1416152090 /nfs/dbraw/zinc/15/20/90/1416152090.db2.gz CZLCQXJOBLXRCF-IRLDBZIGSA-N 2 1 387.487 3.332 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2ccc(OCc3ccccc3)c(OC)c2)CC1 ZINC000129468713 1416214753 /nfs/dbraw/zinc/21/47/53/1416214753.db2.gz VBNRCGQABHFXSG-UHFFFAOYSA-N 2 1 384.520 3.475 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)N2CC[C@H](C[NH+](C)C)C2)C1 ZINC000129493039 1416218533 /nfs/dbraw/zinc/21/85/33/1416218533.db2.gz FUBOSAUTCZGNFI-HSALFYBXSA-N 2 1 386.584 3.258 20 0 GGADMP FC(F)(F)CN1CCC[N@H+](Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000129504780 1416219764 /nfs/dbraw/zinc/21/97/64/1416219764.db2.gz XPAHGXWKAPWRLX-UHFFFAOYSA-N 2 1 385.474 3.231 20 0 GGADMP FC(F)(F)CN1CCC[N@@H+](Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000129504780 1416219772 /nfs/dbraw/zinc/21/97/72/1416219772.db2.gz XPAHGXWKAPWRLX-UHFFFAOYSA-N 2 1 385.474 3.231 20 0 GGADMP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000129860242 1416275388 /nfs/dbraw/zinc/27/53/88/1416275388.db2.gz QUAUEIJITOEKBL-GCJKJVERSA-N 2 1 388.600 3.442 20 0 GGADMP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000129860654 1416275973 /nfs/dbraw/zinc/27/59/73/1416275973.db2.gz QUAUEIJITOEKBL-AVRDEDQJSA-N 2 1 388.600 3.442 20 0 GGADMP C[C@H](NC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000129956978 1416291039 /nfs/dbraw/zinc/29/10/39/1416291039.db2.gz KZNYZCCDXMKZKU-MHORFTMASA-N 2 1 390.547 3.016 20 0 GGADMP C[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000130131951 1416324320 /nfs/dbraw/zinc/32/43/20/1416324320.db2.gz NIWCNIJKSBFZFB-SFHVURJKSA-N 2 1 384.524 3.005 20 0 GGADMP C[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000130131951 1416324325 /nfs/dbraw/zinc/32/43/25/1416324325.db2.gz NIWCNIJKSBFZFB-SFHVURJKSA-N 2 1 384.524 3.005 20 0 GGADMP Cc1cc(C[NH+](C)C)cc(NC(=O)[C@H](c2ccccc2)[NH+]2CCC(O)CC2)c1 ZINC000130281272 1416350888 /nfs/dbraw/zinc/35/08/88/1416350888.db2.gz SSOGXKGNGVRAPK-QFIPXVFZSA-N 2 1 381.520 3.193 20 0 GGADMP c1ccc(COc2ccccc2C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)nc1 ZINC000130352332 1416363402 /nfs/dbraw/zinc/36/34/02/1416363402.db2.gz IPOVYHQZLCDFRA-IBGZPJMESA-N 2 1 381.520 3.251 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2CNC(=O)c2ccc(C[NH+](C)C)cc2)C[C@H](C)O1 ZINC000130369282 1416366081 /nfs/dbraw/zinc/36/60/81/1416366081.db2.gz UFENHYXAMBINEG-OALUTQOASA-N 2 1 395.547 3.287 20 0 GGADMP CC[C@@H](C)Oc1cc(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)ccc1OC ZINC000130405202 1416372648 /nfs/dbraw/zinc/37/26/48/1416372648.db2.gz SLPMHHYEVLMMKQ-MJGOQNOKSA-N 2 1 376.541 3.463 20 0 GGADMP CCOc1ccc([C@H]2CCCN2C(=O)C[N@@H+](C)CCCn2ccnc2C)cc1 ZINC000130582024 1416403772 /nfs/dbraw/zinc/40/37/72/1416403772.db2.gz XCZFJCSNGXDHLZ-OAQYLSRUSA-N 2 1 384.524 3.276 20 0 GGADMP CCOc1ccc([C@H]2CCCN2C(=O)C[N@@H+](C)CCCn2cc[nH+]c2C)cc1 ZINC000130582024 1416403783 /nfs/dbraw/zinc/40/37/83/1416403783.db2.gz XCZFJCSNGXDHLZ-OAQYLSRUSA-N 2 1 384.524 3.276 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)C[NH+]1CCCC1 ZINC000130666975 1416421630 /nfs/dbraw/zinc/42/16/30/1416421630.db2.gz VHJGFIALCRFPHB-KRWDZBQOSA-N 2 1 376.570 3.089 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3cc(F)cc4cccnc43)cc2)CC1 ZINC000130871758 1416472115 /nfs/dbraw/zinc/47/21/15/1416472115.db2.gz XUUXPYVGKHCNLH-UHFFFAOYSA-N 2 1 378.495 3.411 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000130873102 1416472831 /nfs/dbraw/zinc/47/28/31/1416472831.db2.gz QXTLEWFZWGIHKI-SFHVURJKSA-N 2 1 392.450 3.310 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000130873102 1416472838 /nfs/dbraw/zinc/47/28/38/1416472838.db2.gz QXTLEWFZWGIHKI-SFHVURJKSA-N 2 1 392.450 3.310 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)o1 ZINC000130918198 1416481036 /nfs/dbraw/zinc/48/10/36/1416481036.db2.gz QGIIDHPVGUPEFU-LJQANCHMSA-N 2 1 378.561 3.029 20 0 GGADMP CCOC(=O)c1cc(C)sc1NC(=O)[C@H](C)[N@H+](C)CCCn1cc[nH+]c1C ZINC000130939345 1416484363 /nfs/dbraw/zinc/48/43/63/1416484363.db2.gz UIBVIBFYAIRURV-AWEZNQCLSA-N 2 1 392.525 3.087 20 0 GGADMP CCOC(=O)c1cc(C)sc1NC(=O)[C@H](C)[N@@H+](C)CCCn1cc[nH+]c1C ZINC000130939345 1416484371 /nfs/dbraw/zinc/48/43/71/1416484371.db2.gz UIBVIBFYAIRURV-AWEZNQCLSA-N 2 1 392.525 3.087 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)c1 ZINC000130946885 1416486051 /nfs/dbraw/zinc/48/60/51/1416486051.db2.gz LIYZMNLWDIQAFA-OAQYLSRUSA-N 2 1 386.515 3.380 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)NCC[NH+]2CCc3sccc3C2)c1 ZINC000130967891 1416489258 /nfs/dbraw/zinc/48/92/58/1416489258.db2.gz BRAOGBIFBUWKSI-UHFFFAOYSA-N 2 1 386.565 3.057 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NCC[NH+]2CCc3sccc3C2)c1 ZINC000130967891 1416489260 /nfs/dbraw/zinc/48/92/60/1416489260.db2.gz BRAOGBIFBUWKSI-UHFFFAOYSA-N 2 1 386.565 3.057 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NCC[N@@H+]2CCc3sccc3C2)c1 ZINC000130967891 1416489262 /nfs/dbraw/zinc/48/92/62/1416489262.db2.gz BRAOGBIFBUWKSI-UHFFFAOYSA-N 2 1 386.565 3.057 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NCC[N@H+]2CCc3sccc3C2)c1 ZINC000130967891 1416489266 /nfs/dbraw/zinc/48/92/66/1416489266.db2.gz BRAOGBIFBUWKSI-UHFFFAOYSA-N 2 1 386.565 3.057 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)N3CC[C@@H]4[C@@H](CCC[N@H+]4C)C3)c(C)c2)CC1 ZINC000178539255 1429101586 /nfs/dbraw/zinc/10/15/86/1429101586.db2.gz KPPXXVCEEKANDV-SIKLNZKXSA-N 2 1 399.583 3.085 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)C1 ZINC000131093842 1416507588 /nfs/dbraw/zinc/50/75/88/1416507588.db2.gz YNZKVEHQNPAWNL-OALUTQOASA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)C1 ZINC000131093842 1416507593 /nfs/dbraw/zinc/50/75/93/1416507593.db2.gz YNZKVEHQNPAWNL-OALUTQOASA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)C1 ZINC000131093631 1416507848 /nfs/dbraw/zinc/50/78/48/1416507848.db2.gz YNZKVEHQNPAWNL-RBUKOAKNSA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)C1 ZINC000131093631 1416507851 /nfs/dbraw/zinc/50/78/51/1416507851.db2.gz YNZKVEHQNPAWNL-RBUKOAKNSA-N 2 1 375.561 3.160 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NC[C@H](c2ccco2)[NH+](C)C)[NH+]2CCCC2)cc1 ZINC000131119570 1416512048 /nfs/dbraw/zinc/51/20/48/1416512048.db2.gz XTALBLUHIQFJEE-VQTJNVASSA-N 2 1 384.524 3.327 20 0 GGADMP C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131261649 1416531328 /nfs/dbraw/zinc/53/13/28/1416531328.db2.gz CWWSIDVFPWZGII-JKSUJKDBSA-N 2 1 390.478 3.172 20 0 GGADMP C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131261649 1416531331 /nfs/dbraw/zinc/53/13/31/1416531331.db2.gz CWWSIDVFPWZGII-JKSUJKDBSA-N 2 1 390.478 3.172 20 0 GGADMP CCOc1ccccc1[C@@H](CC)NC(=O)C[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000131379167 1416548165 /nfs/dbraw/zinc/54/81/65/1416548165.db2.gz FYAAKHJJBQCTQA-UYAOXDASSA-N 2 1 398.551 3.341 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc(N4CCCC4)nc3)c2)CCO1 ZINC000131577076 1416578729 /nfs/dbraw/zinc/57/87/29/1416578729.db2.gz LFCLXYXBLKTEJE-IBGZPJMESA-N 2 1 380.536 3.192 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(N4CCCC4)nc3)c2)CCO1 ZINC000131577076 1416578735 /nfs/dbraw/zinc/57/87/35/1416578735.db2.gz LFCLXYXBLKTEJE-IBGZPJMESA-N 2 1 380.536 3.192 20 0 GGADMP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000131586328 1416580627 /nfs/dbraw/zinc/58/06/27/1416580627.db2.gz JHXVAJHHSDOXQT-QHCPKHFHSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000131586328 1416580628 /nfs/dbraw/zinc/58/06/28/1416580628.db2.gz JHXVAJHHSDOXQT-QHCPKHFHSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000131586328 1416580631 /nfs/dbraw/zinc/58/06/31/1416580631.db2.gz JHXVAJHHSDOXQT-QHCPKHFHSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000131586328 1416580633 /nfs/dbraw/zinc/58/06/33/1416580633.db2.gz JHXVAJHHSDOXQT-QHCPKHFHSA-N 2 1 395.547 3.044 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N(CC[NH+](C)C)Cc2ccco2)CC[N@H+]1Cc1ccccc1 ZINC000131698976 1416599224 /nfs/dbraw/zinc/59/92/24/1416599224.db2.gz RPWMWIPZXKTYNX-TZIWHRDSSA-N 2 1 398.551 3.406 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N(CC[NH+](C)C)Cc2ccco2)CC[N@H+]1Cc1ccccc1 ZINC000131699606 1416599523 /nfs/dbraw/zinc/59/95/23/1416599523.db2.gz RPWMWIPZXKTYNX-FPOVZHCZSA-N 2 1 398.551 3.406 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+][C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2)CCO1 ZINC000131786216 1416620609 /nfs/dbraw/zinc/62/06/09/1416620609.db2.gz LKZHTWPUPMKKDJ-FXAWDEMLSA-N 2 1 389.540 3.006 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2)CCO1 ZINC000131786216 1416620618 /nfs/dbraw/zinc/62/06/18/1416620618.db2.gz LKZHTWPUPMKKDJ-FXAWDEMLSA-N 2 1 389.540 3.006 20 0 GGADMP C[C@@H](C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1)[NH+]1CCSCC1 ZINC000131937417 1416655752 /nfs/dbraw/zinc/65/57/52/1416655752.db2.gz OEXLIWCPPMCUNI-INIZCTEOSA-N 2 1 396.000 3.106 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CNC(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000131996093 1416669543 /nfs/dbraw/zinc/66/95/43/1416669543.db2.gz ZVVQVQJJUPMXMU-FRQCXROJSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NC[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000131996093 1416669549 /nfs/dbraw/zinc/66/95/49/1416669549.db2.gz ZVVQVQJJUPMXMU-FRQCXROJSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000131996093 1416669554 /nfs/dbraw/zinc/66/95/54/1416669554.db2.gz ZVVQVQJJUPMXMU-FRQCXROJSA-N 2 1 396.938 3.255 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000132072065 1416688289 /nfs/dbraw/zinc/68/82/89/1416688289.db2.gz BTNQWYQFRLQXNP-LJQANCHMSA-N 2 1 395.551 3.038 20 0 GGADMP C[N@@H+](C[C@H](O)COc1cccc2[nH]ccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000132506063 1416774801 /nfs/dbraw/zinc/77/48/01/1416774801.db2.gz WAPPYKSCFQVZSH-SFTDATJTSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C[C@H](O)COc1cccc2[nH]ccc21)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000132506063 1416774808 /nfs/dbraw/zinc/77/48/08/1416774808.db2.gz WAPPYKSCFQVZSH-SFTDATJTSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C[C@H](O)COc1cccc2[nH]ccc21)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000132506063 1416774813 /nfs/dbraw/zinc/77/48/13/1416774813.db2.gz WAPPYKSCFQVZSH-SFTDATJTSA-N 2 1 393.531 3.362 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000132861138 1416824452 /nfs/dbraw/zinc/82/44/52/1416824452.db2.gz NVEFXRXRTFUFDA-QYZOEREBSA-N 2 1 387.572 3.027 20 0 GGADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cnn1-c1ccc(F)cc1 ZINC000132886892 1416827259 /nfs/dbraw/zinc/82/72/59/1416827259.db2.gz FEOSVKXVOAYJDU-FUHWJXTLSA-N 2 1 386.515 3.471 20 0 GGADMP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccccc1OCc1ccccc1 ZINC000178669264 1429134210 /nfs/dbraw/zinc/13/42/10/1429134210.db2.gz KUHLNRDXQLLXGJ-LJQANCHMSA-N 2 1 381.520 3.080 20 0 GGADMP Cc1cccc(N2CCC(NC(=O)NC[C@H]3CCCC[N@H+]3CC(C)C)CC2)[nH+]1 ZINC000132941625 1416833747 /nfs/dbraw/zinc/83/37/47/1416833747.db2.gz OIVWJRBMPLAFQR-HXUWFJFHSA-N 2 1 387.572 3.169 20 0 GGADMP Cc1cccc(N2CCC(NC(=O)NC[C@H]3CCCC[N@@H+]3CC(C)C)CC2)[nH+]1 ZINC000132941625 1416833748 /nfs/dbraw/zinc/83/37/48/1416833748.db2.gz OIVWJRBMPLAFQR-HXUWFJFHSA-N 2 1 387.572 3.169 20 0 GGADMP COC(=O)c1ccccc1-c1ccc(C[NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)o1 ZINC000132964901 1416836770 /nfs/dbraw/zinc/83/67/70/1416836770.db2.gz WJWRSIFNALQJOM-OAQYLSRUSA-N 2 1 399.535 3.095 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)CC[N@H+]1C ZINC000133077045 1416849506 /nfs/dbraw/zinc/84/95/06/1416849506.db2.gz KTPOXKYPUBTGRO-MNEFBYGVSA-N 2 1 385.474 3.151 20 0 GGADMP Cc1c(C(=O)Nc2ccc(OCCC[NH+](C)C)cc2)cnn1-c1cc[nH+]cc1 ZINC000133212801 1416865010 /nfs/dbraw/zinc/86/50/10/1416865010.db2.gz MWCGAXVOVFPAQW-UHFFFAOYSA-N 2 1 379.464 3.159 20 0 GGADMP CN(C(=O)c1ccncc1)c1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000133235169 1416868649 /nfs/dbraw/zinc/86/86/49/1416868649.db2.gz WCNBSCRQFDTMJY-UHFFFAOYSA-N 2 1 378.520 3.322 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cnc(C4CCC4)s3)c2)C1 ZINC000133314793 1416877594 /nfs/dbraw/zinc/87/75/94/1416877594.db2.gz VBRYFRXWZJIQTP-LJQANCHMSA-N 2 1 398.576 3.398 20 0 GGADMP CC(C)(C)OC(=O)N1CCC(C[NH2+]CC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC000133581498 1416910707 /nfs/dbraw/zinc/91/07/07/1416910707.db2.gz XYAADPZINCIUJO-UHFFFAOYSA-N 2 1 395.588 3.258 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[NH+](Cc3ccccc3)CCO2)C1 ZINC000133646822 1416930705 /nfs/dbraw/zinc/93/07/05/1416930705.db2.gz JMTKJXFGWQLRDU-PUHATCMVSA-N 2 1 399.579 3.000 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[NH+](Cc3ccccc3)CCO2)C1 ZINC000133646822 1416930711 /nfs/dbraw/zinc/93/07/11/1416930711.db2.gz JMTKJXFGWQLRDU-PUHATCMVSA-N 2 1 399.579 3.000 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)C1 ZINC000133646822 1416930723 /nfs/dbraw/zinc/93/07/23/1416930723.db2.gz JMTKJXFGWQLRDU-PUHATCMVSA-N 2 1 399.579 3.000 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)C1 ZINC000133646822 1416930733 /nfs/dbraw/zinc/93/07/33/1416930733.db2.gz JMTKJXFGWQLRDU-PUHATCMVSA-N 2 1 399.579 3.000 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000133735197 1416953272 /nfs/dbraw/zinc/95/32/72/1416953272.db2.gz GEUANPQUXQMSSR-FQEVSTJZSA-N 2 1 390.547 3.021 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000133735197 1416953274 /nfs/dbraw/zinc/95/32/74/1416953274.db2.gz GEUANPQUXQMSSR-FQEVSTJZSA-N 2 1 390.547 3.021 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)C1 ZINC000133735197 1416953275 /nfs/dbraw/zinc/95/32/75/1416953275.db2.gz GEUANPQUXQMSSR-FQEVSTJZSA-N 2 1 390.547 3.021 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)C1 ZINC000133735197 1416953280 /nfs/dbraw/zinc/95/32/80/1416953280.db2.gz GEUANPQUXQMSSR-FQEVSTJZSA-N 2 1 390.547 3.021 20 0 GGADMP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)C1 ZINC000133846266 1416976543 /nfs/dbraw/zinc/97/65/43/1416976543.db2.gz VWEVNNQDXIWBOM-FXAWDEMLSA-N 2 1 393.597 3.070 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000133848587 1416977535 /nfs/dbraw/zinc/97/75/35/1416977535.db2.gz IXFFWKJYALGJOS-MRXNPFEDSA-N 2 1 398.532 3.282 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000133908937 1416992319 /nfs/dbraw/zinc/99/23/19/1416992319.db2.gz ZKOIXJCUXXMRDI-YADHBBJMSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000133908937 1416992336 /nfs/dbraw/zinc/99/23/36/1416992336.db2.gz ZKOIXJCUXXMRDI-YADHBBJMSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000133908937 1416992342 /nfs/dbraw/zinc/99/23/42/1416992342.db2.gz ZKOIXJCUXXMRDI-YADHBBJMSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)C1 ZINC000134137043 1417027563 /nfs/dbraw/zinc/02/75/63/1417027563.db2.gz NXAANNGKERHJGN-LEWJYISDSA-N 2 1 378.605 3.118 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)C1 ZINC000134137290 1417027825 /nfs/dbraw/zinc/02/78/25/1417027825.db2.gz NXAANNGKERHJGN-RTWAWAEBSA-N 2 1 378.605 3.118 20 0 GGADMP C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000134264819 1417046353 /nfs/dbraw/zinc/04/63/53/1417046353.db2.gz SDYIETCXEKNIKI-CQSZACIVSA-N 2 1 394.350 3.256 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]CC3(c4ccc(Cl)cc4)CCC3)cn2)CC1 ZINC000134270733 1417047731 /nfs/dbraw/zinc/04/77/31/1417047731.db2.gz PKHOARSIZFFPIJ-UHFFFAOYSA-N 2 1 385.943 3.093 20 0 GGADMP C[C@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(-c2ccncc2)cc1 ZINC000134383138 1417063217 /nfs/dbraw/zinc/06/32/17/1417063217.db2.gz YUVNOGFCYWVQFO-SFHVURJKSA-N 2 1 388.519 3.141 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@H](C)[N@@H+]1CCc2ccccc2C1 ZINC000134498358 1417077424 /nfs/dbraw/zinc/07/74/24/1417077424.db2.gz MNAMXXQYPXRXAG-IBGZPJMESA-N 2 1 392.547 3.132 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000134498358 1417077427 /nfs/dbraw/zinc/07/74/27/1417077427.db2.gz MNAMXXQYPXRXAG-IBGZPJMESA-N 2 1 392.547 3.132 20 0 GGADMP Cc1c(C(=O)NCC2([NH+]3CCCCC3)CCCCC2)cnn1-c1cc[nH+]cc1 ZINC000134688465 1417112446 /nfs/dbraw/zinc/11/24/46/1417112446.db2.gz AHKWKTSQJJCGAT-UHFFFAOYSA-N 2 1 381.524 3.494 20 0 GGADMP CC(=O)Nc1ccc2c(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc(=O)oc2c1 ZINC000134876013 1417138112 /nfs/dbraw/zinc/13/81/12/1417138112.db2.gz SQXORUJXOZBURI-IERDGZPVSA-N 2 1 395.503 3.200 20 0 GGADMP CC(=O)Nc1ccc2c(C[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc(=O)oc2c1 ZINC000134876013 1417138116 /nfs/dbraw/zinc/13/81/16/1417138116.db2.gz SQXORUJXOZBURI-IERDGZPVSA-N 2 1 395.503 3.200 20 0 GGADMP CC(=O)Nc1ccc2c(C[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc(=O)oc2c1 ZINC000134876013 1417138121 /nfs/dbraw/zinc/13/81/21/1417138121.db2.gz SQXORUJXOZBURI-IERDGZPVSA-N 2 1 395.503 3.200 20 0 GGADMP CC(=O)Nc1ccc2c(C[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc(=O)oc2c1 ZINC000134876013 1417138129 /nfs/dbraw/zinc/13/81/29/1417138129.db2.gz SQXORUJXOZBURI-IERDGZPVSA-N 2 1 395.503 3.200 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(OCCC[NH+](C)C)c1)[N@@H+]1CCc2ccccc2C1 ZINC000134910589 1417142910 /nfs/dbraw/zinc/14/29/10/1417142910.db2.gz FQDKXEYEVYFUKN-SFHVURJKSA-N 2 1 381.520 3.402 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(OCCC[NH+](C)C)c1)[N@H+]1CCc2ccccc2C1 ZINC000134910589 1417142915 /nfs/dbraw/zinc/14/29/15/1417142915.db2.gz FQDKXEYEVYFUKN-SFHVURJKSA-N 2 1 381.520 3.402 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NCCC[N@@H+](C)Cc2ccccc2)cc1F ZINC000134992561 1417158013 /nfs/dbraw/zinc/15/80/13/1417158013.db2.gz SSYNWBYAIJDLNT-UHFFFAOYSA-N 2 1 386.515 3.209 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NCCC[N@H+]2CCc3ccccc3C2)cc1F ZINC000135028865 1417164806 /nfs/dbraw/zinc/16/48/06/1417164806.db2.gz RJSKPCHKRXFYJP-UHFFFAOYSA-N 2 1 398.526 3.135 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C1 ZINC000135139846 1417176861 /nfs/dbraw/zinc/17/68/61/1417176861.db2.gz NLDKPWXLWXOUEN-KRWDZBQOSA-N 2 1 378.536 3.199 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C1 ZINC000135139829 1417177036 /nfs/dbraw/zinc/17/70/36/1417177036.db2.gz NLDKPWXLWXOUEN-QGZVFWFLSA-N 2 1 378.536 3.199 20 0 GGADMP C[C@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000135266488 1417199982 /nfs/dbraw/zinc/19/99/82/1417199982.db2.gz WJLWBRQGVXUPMS-FXAWDEMLSA-N 2 1 394.531 3.271 20 0 GGADMP Fc1ccc(-c2noc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)n2)cc1F ZINC000135267142 1417200002 /nfs/dbraw/zinc/20/00/02/1417200002.db2.gz UQLWUSCBXSTNCQ-UHFFFAOYSA-N 2 1 392.450 3.092 20 0 GGADMP CC[N@@H+](CCNC(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000135343271 1417209926 /nfs/dbraw/zinc/20/99/26/1417209926.db2.gz SUIXUSGZTPNIOH-HNAYVOBHSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+](CCNC(=O)NC[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000135343271 1417209930 /nfs/dbraw/zinc/20/99/30/1417209930.db2.gz SUIXUSGZTPNIOH-HNAYVOBHSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+](CCNC(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000135343271 1417209934 /nfs/dbraw/zinc/20/99/34/1417209934.db2.gz SUIXUSGZTPNIOH-HNAYVOBHSA-N 2 1 396.938 3.255 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccc(C[NH+](C)C)c(F)c1)[N@@H+](C)Cc1ccccc1 ZINC000135385167 1417213516 /nfs/dbraw/zinc/21/35/16/1417213516.db2.gz MQVNSDCGLNFAHJ-KRWDZBQOSA-N 2 1 386.515 3.207 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)NC[C@H]2CCC[NH+](C)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000135641622 1417252486 /nfs/dbraw/zinc/25/24/86/1417252486.db2.gz CZIOBGYVZOSRPR-SIXWZSSISA-N 2 1 396.938 3.113 20 0 GGADMP C[NH+]1CC[C@@H](CNC(=O)NC[C@H]2CCC[N@H+](C)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000135641622 1417252488 /nfs/dbraw/zinc/25/24/88/1417252488.db2.gz CZIOBGYVZOSRPR-SIXWZSSISA-N 2 1 396.938 3.113 20 0 GGADMP C[NH+]1CC[C@@H](CNC(=O)NC[C@H]2CCC[N@@H+](C)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000135641622 1417252492 /nfs/dbraw/zinc/25/24/92/1417252492.db2.gz CZIOBGYVZOSRPR-SIXWZSSISA-N 2 1 396.938 3.113 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C[N@H+]1Cc1ccccc1 ZINC000136170300 1417297314 /nfs/dbraw/zinc/29/73/14/1417297314.db2.gz ZKGLRXRXWLJATD-DYESRHJHSA-N 2 1 398.526 3.350 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C1 ZINC000136169480 1417297339 /nfs/dbraw/zinc/29/73/39/1417297339.db2.gz UURLYGANKCLHIX-GOSISDBHSA-N 2 1 378.536 3.055 20 0 GGADMP Cc1nn(-c2ccccc2)c(Cl)c1C[NH2+]Cc1ccnc(OCC[NH+](C)C)c1 ZINC000136219522 1417302137 /nfs/dbraw/zinc/30/21/37/1417302137.db2.gz XSZQFNNUMPPGKM-UHFFFAOYSA-N 2 1 399.926 3.459 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)CC2)c1 ZINC000136378012 1417312450 /nfs/dbraw/zinc/31/24/50/1417312450.db2.gz ADOBLBQOECNFGG-SFHVURJKSA-N 2 1 399.564 3.120 20 0 GGADMP O[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc(F)c(Br)c2)CC1 ZINC000136565229 1417326874 /nfs/dbraw/zinc/32/68/74/1417326874.db2.gz ISIMKFDCEVUCNF-MSOLQXFVSA-N 2 1 385.321 3.446 20 0 GGADMP CCCOc1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1OC ZINC000136580946 1417328750 /nfs/dbraw/zinc/32/87/50/1417328750.db2.gz QNVNJGWABAJQBW-UXHICEINSA-N 2 1 376.541 3.342 20 0 GGADMP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1 ZINC000136595938 1417330356 /nfs/dbraw/zinc/33/03/56/1417330356.db2.gz KRPXNOHHXWTTBB-BJKOFHAPSA-N 2 1 396.579 3.406 20 0 GGADMP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000136595898 1417330771 /nfs/dbraw/zinc/33/07/71/1417330771.db2.gz KRPXNOHHXWTTBB-DNQXCXABSA-N 2 1 396.579 3.406 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)ccc1OC(C)C ZINC000136595641 1417330827 /nfs/dbraw/zinc/33/08/27/1417330827.db2.gz LFHWELPRTJTPQG-UXHICEINSA-N 2 1 376.541 3.340 20 0 GGADMP CC[N@H+]1CCCC[C@H]1C(=O)NC1CC[NH+](CCOc2ccc(Cl)cc2)CC1 ZINC000136694716 1417339088 /nfs/dbraw/zinc/33/90/88/1417339088.db2.gz AWGPEQBRXRUHLJ-FQEVSTJZSA-N 2 1 393.959 3.174 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)c1ccsc1 ZINC000136810252 1417347264 /nfs/dbraw/zinc/34/72/64/1417347264.db2.gz RPIGETCCQNBPMJ-BHIYHBOVSA-N 2 1 378.586 3.257 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1)Cc1ccccc1 ZINC000136813409 1417347485 /nfs/dbraw/zinc/34/74/85/1417347485.db2.gz RYCYZCUXZORAHA-FSSWDIPSSA-N 2 1 386.584 3.065 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[NH+]1CCCCC1 ZINC000139847318 1417476957 /nfs/dbraw/zinc/47/69/57/1417476957.db2.gz BNGKJPUDSADVLB-KRWDZBQOSA-N 2 1 376.570 3.231 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[NH+]1CCCCC1 ZINC000139847436 1417477079 /nfs/dbraw/zinc/47/70/79/1417477079.db2.gz BNGKJPUDSADVLB-QGZVFWFLSA-N 2 1 376.570 3.231 20 0 GGADMP CC1CC[NH+](CCNC(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000139874015 1417478703 /nfs/dbraw/zinc/47/87/03/1417478703.db2.gz QVYBPXWQHDKJBV-UHFFFAOYSA-N 2 1 376.570 3.089 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@H](c2ccccc2OC)[NH+](C)C)c1 ZINC000140078617 1417487483 /nfs/dbraw/zinc/48/74/83/1417487483.db2.gz VHMSMDTYENRCIT-OAQYLSRUSA-N 2 1 398.551 3.249 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H](c2ccccc2OC)[NH+](C)C)c1 ZINC000140078617 1417487492 /nfs/dbraw/zinc/48/74/92/1417487492.db2.gz VHMSMDTYENRCIT-OAQYLSRUSA-N 2 1 398.551 3.249 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H](c2cccc(F)c2)[NH+](C)C)c1 ZINC000140072732 1417487709 /nfs/dbraw/zinc/48/77/09/1417487709.db2.gz WFOCWNKPDNXAKF-OAQYLSRUSA-N 2 1 386.515 3.380 20 0 GGADMP Cc1cccc(N2CCC(NC(=O)N3CC[NH+](C4CCCCC4)CC3)CC2)[nH+]1 ZINC000141194410 1417528639 /nfs/dbraw/zinc/52/86/39/1417528639.db2.gz DPQYKDXXBVNERY-UHFFFAOYSA-N 2 1 385.556 3.019 20 0 GGADMP C[C@H]([NH3+])C1CCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000178850948 1429195522 /nfs/dbraw/zinc/19/55/22/1429195522.db2.gz ALEDAURMKTVLSV-HNAYVOBHSA-N 2 1 383.458 3.027 20 0 GGADMP O=C(C[C@@H]1CCC[NH2+]1)Nc1ccc(C[NH+]2CCN(Cc3ccccc3)CC2)cc1 ZINC000178875949 1429206366 /nfs/dbraw/zinc/20/63/66/1429206366.db2.gz FFRMPLNPAYGYON-QHCPKHFHSA-N 2 1 392.547 3.085 20 0 GGADMP CC1CC[NH+](CCCNC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000149020860 1417771389 /nfs/dbraw/zinc/77/13/89/1417771389.db2.gz BTBVVVOEVUJKQB-IBGZPJMESA-N 2 1 392.613 3.381 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000150759902 1417801628 /nfs/dbraw/zinc/80/16/28/1417801628.db2.gz RNCTWHXBFNLSJC-OAQYLSRUSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2F)C1 ZINC000150768557 1417803628 /nfs/dbraw/zinc/80/36/28/1417803628.db2.gz YIAWGPRFHFCMEZ-QGZVFWFLSA-N 2 1 396.526 3.016 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150804171 1417809896 /nfs/dbraw/zinc/80/98/96/1417809896.db2.gz SKZGOGKEBXABCG-HXUWFJFHSA-N 2 1 395.551 3.235 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N2CCC(CC[NH+]3CCCC[C@@H]3C)CC2)C1 ZINC000150808445 1417811199 /nfs/dbraw/zinc/81/11/99/1417811199.db2.gz QYCXSYDQURJWAB-FPOVZHCZSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)C1 ZINC000150808445 1417811200 /nfs/dbraw/zinc/81/12/00/1417811200.db2.gz QYCXSYDQURJWAB-FPOVZHCZSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)C1 ZINC000150808445 1417811201 /nfs/dbraw/zinc/81/12/01/1417811201.db2.gz QYCXSYDQURJWAB-FPOVZHCZSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CCC(CC[NH+]3CCCC[C@@H]3C)CC2)C1 ZINC000150808422 1417811239 /nfs/dbraw/zinc/81/12/39/1417811239.db2.gz QYCXSYDQURJWAB-PZJWPPBQSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)C1 ZINC000150808422 1417811240 /nfs/dbraw/zinc/81/12/40/1417811240.db2.gz QYCXSYDQURJWAB-PZJWPPBQSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)C1 ZINC000150808422 1417811242 /nfs/dbraw/zinc/81/12/42/1417811242.db2.gz QYCXSYDQURJWAB-PZJWPPBQSA-N 2 1 378.605 3.404 20 0 GGADMP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2ncc(-c3ccccc3)o2)CC1 ZINC000150998167 1417852519 /nfs/dbraw/zinc/85/25/19/1417852519.db2.gz MYRLFMVYDMNZDS-UHFFFAOYSA-N 2 1 398.551 3.402 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)C1 ZINC000151105713 1417873232 /nfs/dbraw/zinc/87/32/32/1417873232.db2.gz WXBQYRNEVNYWCF-ZWKOTPCHSA-N 2 1 381.586 3.100 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cccnc2N2CCOCC2)cc1 ZINC000151250267 1417903508 /nfs/dbraw/zinc/90/35/08/1417903508.db2.gz JTGFKPJIZHNBNX-KRWDZBQOSA-N 2 1 377.492 3.263 20 0 GGADMP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CCC[NH+]2CCC(O)CC2)cc1 ZINC000151354321 1417934139 /nfs/dbraw/zinc/93/41/39/1417934139.db2.gz BCVGQFHCBKJUNU-QGZVFWFLSA-N 2 1 376.545 3.058 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)[C@@H](c1ccccc1)[NH+]1CCC(O)CC1)CC(C)C ZINC000151391622 1417946845 /nfs/dbraw/zinc/94/68/45/1417946845.db2.gz PFZYGJOXAQHZDQ-IFMALSPDSA-N 2 1 389.584 3.057 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000151504509 1418006170 /nfs/dbraw/zinc/00/61/70/1418006170.db2.gz OWUPRJLWGSVILJ-XJUOHMSHSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000151504509 1418006181 /nfs/dbraw/zinc/00/61/81/1418006181.db2.gz OWUPRJLWGSVILJ-XJUOHMSHSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000151504509 1418006189 /nfs/dbraw/zinc/00/61/89/1418006189.db2.gz OWUPRJLWGSVILJ-XJUOHMSHSA-N 2 1 396.579 3.167 20 0 GGADMP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3csc(N(C)C4CC4)n3)CC2)C[C@H](C)O1 ZINC000151527635 1418013489 /nfs/dbraw/zinc/01/34/89/1418013489.db2.gz GIPJAQWPHXGHSH-CALCHBBNSA-N 2 1 392.613 3.453 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3csc(N(C)C4CC4)n3)CC2)C[C@H](C)O1 ZINC000151527635 1418013498 /nfs/dbraw/zinc/01/34/98/1418013498.db2.gz GIPJAQWPHXGHSH-CALCHBBNSA-N 2 1 392.613 3.453 20 0 GGADMP C[C@@H]1CCN(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)C[C@@H]1n1ccnc1 ZINC000151650040 1418049848 /nfs/dbraw/zinc/04/98/48/1418049848.db2.gz WKVSQCDWSZFTMW-QYZOEREBSA-N 2 1 385.512 3.296 20 0 GGADMP O=C(NC[C@@H](c1ccco1)N1CCCCC1)N1CC[C@@H](Oc2ccncc2)C1 ZINC000151649655 1418050094 /nfs/dbraw/zinc/05/00/94/1418050094.db2.gz QBQRZHWACQYOAJ-MOPGFXCFSA-N 2 1 384.480 3.065 20 0 GGADMP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3cnn(C)c3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000152023394 1418123185 /nfs/dbraw/zinc/12/31/85/1418123185.db2.gz KOPJOJSCNNEBTQ-GASCZTMLSA-N 2 1 388.478 3.150 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3cnn(C)c3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000152023394 1418123191 /nfs/dbraw/zinc/12/31/91/1418123191.db2.gz KOPJOJSCNNEBTQ-GASCZTMLSA-N 2 1 388.478 3.150 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NC[C@@H](C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000152304044 1418199234 /nfs/dbraw/zinc/19/92/34/1418199234.db2.gz FXIIGWIUEOFTMA-NQIIRXRSSA-N 2 1 395.551 3.239 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)C1 ZINC000152304044 1418199238 /nfs/dbraw/zinc/19/92/38/1418199238.db2.gz FXIIGWIUEOFTMA-NQIIRXRSSA-N 2 1 395.551 3.239 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000179073963 1429255234 /nfs/dbraw/zinc/25/52/34/1429255234.db2.gz GNDZWBFCNTVDLM-UHFFFAOYSA-N 2 1 383.540 3.135 20 0 GGADMP CS[C@@H]1CCCC[N@@H+](CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)C1 ZINC000179111130 1429265727 /nfs/dbraw/zinc/26/57/27/1429265727.db2.gz GAYRYKYPNIZQET-OAQYLSRUSA-N 2 1 389.609 3.293 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H](O)COc1ccccc1F ZINC000179388350 1429353762 /nfs/dbraw/zinc/35/37/62/1429353762.db2.gz RAOVRWLLLSQORC-HXUWFJFHSA-N 2 1 387.499 3.199 20 0 GGADMP CN(Cc1ccccc1F)C(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179390747 1429355558 /nfs/dbraw/zinc/35/55/58/1429355558.db2.gz GMVXXLXIMHSBOB-UHFFFAOYSA-N 2 1 398.526 3.418 20 0 GGADMP C[C@H](c1nnnn1-c1ccccc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179392524 1429357068 /nfs/dbraw/zinc/35/70/68/1429357068.db2.gz LPLKFAYOOOIXOI-GOSISDBHSA-N 2 1 391.523 3.357 20 0 GGADMP C[C@H](c1nnnn1-c1ccccc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179392524 1429357073 /nfs/dbraw/zinc/35/70/73/1429357073.db2.gz LPLKFAYOOOIXOI-GOSISDBHSA-N 2 1 391.523 3.357 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)Nc1ccc(Cl)cn1 ZINC000179397691 1429359021 /nfs/dbraw/zinc/35/90/21/1429359021.db2.gz MSDXIBXRUXDTDA-UHFFFAOYSA-N 2 1 387.915 3.307 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2C[C@H](O)CN2Cc2ccccc2)cc1 ZINC000179485484 1429390437 /nfs/dbraw/zinc/39/04/37/1429390437.db2.gz KMNJXZCSPPVDQP-GLYQVZKVSA-N 2 1 390.531 3.467 20 0 GGADMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000179636498 1429482998 /nfs/dbraw/zinc/48/29/98/1429482998.db2.gz CQAZEQVJELXJIO-FQEVSTJZSA-N 2 1 375.520 3.377 20 0 GGADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000179636498 1429483004 /nfs/dbraw/zinc/48/30/04/1429483004.db2.gz CQAZEQVJELXJIO-FQEVSTJZSA-N 2 1 375.520 3.377 20 0 GGADMP Cn1c(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)nc2ccccc2c1=O ZINC000179662317 1429496434 /nfs/dbraw/zinc/49/64/34/1429496434.db2.gz SENWTUHJSOFRRC-UHFFFAOYSA-N 2 1 391.519 3.067 20 0 GGADMP Cn1c(C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)nc2ccccc2c1=O ZINC000179662317 1429496436 /nfs/dbraw/zinc/49/64/36/1429496436.db2.gz SENWTUHJSOFRRC-UHFFFAOYSA-N 2 1 391.519 3.067 20 0 GGADMP COc1ccc2cc(CN(C)C(=O)[C@@H](C)N(C)C[C@@H]3CCC[N@@H+](C)C3)ccc2c1 ZINC000152394654 1422091832 /nfs/dbraw/zinc/09/18/32/1422091832.db2.gz LLRHPYNPOWPRCY-UYAOXDASSA-N 2 1 397.563 3.469 20 0 GGADMP COc1ccc2cc(CN(C)C(=O)[C@H](C)N(C)C[C@@H]3CCC[N@@H+](C)C3)ccc2c1 ZINC000152394561 1422092038 /nfs/dbraw/zinc/09/20/38/1422092038.db2.gz LLRHPYNPOWPRCY-AZUAARDMSA-N 2 1 397.563 3.469 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(-c2ncco2)c1 ZINC000152517934 1422129121 /nfs/dbraw/zinc/12/91/21/1422129121.db2.gz VCLJRWIHYHPPTN-LJQANCHMSA-N 2 1 385.512 3.221 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N3CC[C@@H]4[C@H](CCC[N@H+]4C)C3)CC2)CC1 ZINC000152745783 1422234327 /nfs/dbraw/zinc/23/43/27/1422234327.db2.gz OJQLLWVABAYIHE-WCHWRFHJSA-N 2 1 376.589 3.155 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)Nc2cc(C(N)=O)ccc2C[NH+](C)C)cc1)C(C)C ZINC000152832098 1422264563 /nfs/dbraw/zinc/26/45/63/1422264563.db2.gz OEVVTAMJPWUBMP-UHFFFAOYSA-N 2 1 396.535 3.330 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000152865580 1422276059 /nfs/dbraw/zinc/27/60/59/1422276059.db2.gz CJKMGIZVIYLABE-QUCCMNQESA-N 2 1 384.524 3.188 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000152865580 1422276070 /nfs/dbraw/zinc/27/60/70/1422276070.db2.gz CJKMGIZVIYLABE-QUCCMNQESA-N 2 1 384.524 3.188 20 0 GGADMP OC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ncccc2C(F)(F)F)CC1 ZINC000152902121 1422290020 /nfs/dbraw/zinc/29/00/20/1422290020.db2.gz QESHSTCUSBJLHJ-UHFFFAOYSA-N 2 1 379.426 3.347 20 0 GGADMP CCCN(CC[NH+](CC)CC)C(=O)NC1CCN(c2cccc(C)[nH+]2)CC1 ZINC000153047001 1422337866 /nfs/dbraw/zinc/33/78/66/1422337866.db2.gz TZSZRGXXUHLROS-UHFFFAOYSA-N 2 1 375.561 3.122 20 0 GGADMP c1ccc(CC[NH+]2CCC([NH2+]C3CCN(Cc4ccccn4)CC3)CC2)cc1 ZINC000153239181 1422412309 /nfs/dbraw/zinc/41/23/09/1422412309.db2.gz QQTWNYOQMWNVRB-UHFFFAOYSA-N 2 1 378.564 3.343 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC2CC[NH+](CCc3ccccc3)CC2)[C@H](C)C1 ZINC000153246348 1422415569 /nfs/dbraw/zinc/41/55/69/1422415569.db2.gz YIHXAJVLCSATDH-QPPBQGQZSA-N 2 1 387.612 3.420 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NC2CC[NH+](CCc3ccccc3)CC2)[C@H](C)C1 ZINC000153246453 1422415845 /nfs/dbraw/zinc/41/58/45/1422415845.db2.gz YIHXAJVLCSATDH-ZJSXRUAMSA-N 2 1 387.612 3.420 20 0 GGADMP Cc1c(C(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)cnn1-c1cc[nH+]cc1 ZINC000153426677 1422529877 /nfs/dbraw/zinc/52/98/77/1422529877.db2.gz QGWUBJRNOJWNPO-PKOBYXMFSA-N 2 1 381.524 3.302 20 0 GGADMP Cc1c(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cnn1-c1cc[nH+]cc1 ZINC000153426677 1422529890 /nfs/dbraw/zinc/52/98/90/1422529890.db2.gz QGWUBJRNOJWNPO-PKOBYXMFSA-N 2 1 381.524 3.302 20 0 GGADMP Cc1c(C(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cnn1-c1cc[nH+]cc1 ZINC000153455792 1422546510 /nfs/dbraw/zinc/54/65/10/1422546510.db2.gz SSPIPCLAUCIYGA-HXUWFJFHSA-N 2 1 389.503 3.170 20 0 GGADMP Cc1c(C(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cnn1-c1cc[nH+]cc1 ZINC000153455792 1422546526 /nfs/dbraw/zinc/54/65/26/1422546526.db2.gz SSPIPCLAUCIYGA-HXUWFJFHSA-N 2 1 389.503 3.170 20 0 GGADMP CC(C)N(CC[NH+](C)C)C(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000153572486 1422626787 /nfs/dbraw/zinc/62/67/87/1422626787.db2.gz UITJMLDYJFXBPJ-VQIMIIECSA-N 2 1 398.954 3.454 20 0 GGADMP CC1CC[NH+](CC(=O)Nc2ccnn2[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000153642133 1422670399 /nfs/dbraw/zinc/67/03/99/1422670399.db2.gz YPXOFSIRCJASAM-HXUWFJFHSA-N 2 1 381.524 3.001 20 0 GGADMP CC1CC[NH+](CC(=O)Nc2ccnn2[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000153642133 1422670412 /nfs/dbraw/zinc/67/04/12/1422670412.db2.gz YPXOFSIRCJASAM-HXUWFJFHSA-N 2 1 381.524 3.001 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCN(C(=O)c3ccoc3)CC2)cc1F ZINC000153693491 1422705847 /nfs/dbraw/zinc/70/58/47/1422705847.db2.gz BPISZJGMQUHDNR-UHFFFAOYSA-N 2 1 382.439 3.307 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc(CN3CCCC3=O)c2)[C@H](C)C1 ZINC000153920202 1422811061 /nfs/dbraw/zinc/81/10/61/1422811061.db2.gz LSTIBNIBEJIPOR-KNQAVFIVSA-N 2 1 387.568 3.036 20 0 GGADMP C[C@@H]1CC[C@@H](C)[NH+]1CCN1CC[NH+](CCC(=O)Nc2ccccc2Cl)CC1 ZINC000153926759 1422812131 /nfs/dbraw/zinc/81/21/31/1422812131.db2.gz SINJZUPKHMUTQX-QZTJIDSGSA-N 2 1 392.975 3.159 20 0 GGADMP OC[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC1CC[NH+](C2CCCCC2)CC1 ZINC000154040811 1422830469 /nfs/dbraw/zinc/83/04/69/1422830469.db2.gz ZXNNEUKISUXWHE-ZJSXRUAMSA-N 2 1 385.596 3.256 20 0 GGADMP OC[C@H]1CCN(Cc2ccccc2)C[C@H]1[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000154040811 1422830474 /nfs/dbraw/zinc/83/04/74/1422830474.db2.gz ZXNNEUKISUXWHE-ZJSXRUAMSA-N 2 1 385.596 3.256 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)[C@@H]3CCC[N@H+]3C3CCOCC3)cc2)CC1 ZINC000154302783 1422869659 /nfs/dbraw/zinc/86/96/59/1422869659.db2.gz CIBSQEKDPITRIN-QHCPKHFHSA-N 2 1 399.579 3.178 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@]2(N3CCOCC3)CCSC2)cc1 ZINC000154443431 1422889004 /nfs/dbraw/zinc/88/90/04/1422889004.db2.gz HKXVAGVBHQEFKK-DYESRHJHSA-N 2 1 386.565 3.039 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@]2(N3CCOCC3)CCSC2)cc1 ZINC000154443549 1422889584 /nfs/dbraw/zinc/88/95/84/1422889584.db2.gz HKXVAGVBHQEFKK-LAUBAEHRSA-N 2 1 386.565 3.039 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)CC1 ZINC000154460878 1422891422 /nfs/dbraw/zinc/89/14/22/1422891422.db2.gz ZNTCFLVYKKQTIG-SFHVURJKSA-N 2 1 387.572 3.039 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+]C2CCN(Cc3ccccc3Cl)CC2)CC1 ZINC000154474153 1422893578 /nfs/dbraw/zinc/89/35/78/1422893578.db2.gz OBMNHUYOAYTLRA-UHFFFAOYSA-N 2 1 393.019 3.312 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCN1CCN(c2ccccc2Cl)CC1 ZINC000154660708 1422989199 /nfs/dbraw/zinc/98/91/99/1422989199.db2.gz XXMPOCQDWVNRLT-HBFSDRIKSA-N 2 1 378.992 3.170 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4c3cc(F)cc4F)c2)C1 ZINC000154673103 1422996917 /nfs/dbraw/zinc/99/69/17/1422996917.db2.gz VGTABIGBMLZQBL-VGOFRKELSA-N 2 1 399.485 3.439 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCNC(=O)c2cccc(O)c2)cc1 ZINC000155061169 1423140601 /nfs/dbraw/zinc/14/06/01/1423140601.db2.gz MDBIBFLSXMLPNG-MRXNPFEDSA-N 2 1 378.476 3.357 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCCCC1)[C@@H]1CCC[N@H+]1C1CCOCC1 ZINC000155343388 1423325068 /nfs/dbraw/zinc/32/50/68/1423325068.db2.gz HHYDUTXIVRPURR-QHCPKHFHSA-N 2 1 399.579 3.322 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCCCC1)[C@H]1CCC[N@H+]1C1CCOCC1 ZINC000155343480 1423325316 /nfs/dbraw/zinc/32/53/16/1423325316.db2.gz HHYDUTXIVRPURR-HSZRJFAPSA-N 2 1 399.579 3.322 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000155662712 1423474233 /nfs/dbraw/zinc/47/42/33/1423474233.db2.gz RQNRNHAGHOFOMC-CVDCTZTESA-N 2 1 392.547 3.388 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCN1CCN(c2cccc(Cl)c2)CC1 ZINC000155699968 1423492886 /nfs/dbraw/zinc/49/28/86/1423492886.db2.gz FWZWWJUSJFZVJW-OPYAIIAOSA-N 2 1 378.992 3.170 20 0 GGADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)C(C)C ZINC000155822442 1423548026 /nfs/dbraw/zinc/54/80/26/1423548026.db2.gz GKJVMEQUHSKMDM-SFHVURJKSA-N 2 1 381.586 3.386 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCSCC1)N1CCC([NH+]2CC=CC2)CC1 ZINC000155836608 1423554367 /nfs/dbraw/zinc/55/43/67/1423554367.db2.gz QGHZWVAPOGQVJG-UHFFFAOYSA-N 2 1 386.565 3.104 20 0 GGADMP CCOc1ccc(-c2nc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)co2)cc1 ZINC000156196100 1423719709 /nfs/dbraw/zinc/71/97/09/1423719709.db2.gz SIFMMVPGGYSIAI-UHFFFAOYSA-N 2 1 385.508 3.285 20 0 GGADMP O=C1[C@@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000179972386 1429669742 /nfs/dbraw/zinc/66/97/42/1429669742.db2.gz LFGKBIILQBEWHD-OTWHNJEPSA-N 2 1 395.469 3.413 20 0 GGADMP O=C1[C@@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000179972386 1429669745 /nfs/dbraw/zinc/66/97/45/1429669745.db2.gz LFGKBIILQBEWHD-OTWHNJEPSA-N 2 1 395.469 3.413 20 0 GGADMP CC[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000156311861 1423771599 /nfs/dbraw/zinc/77/15/99/1423771599.db2.gz NZJIEYDJJOQPFB-DHIUTWEWSA-N 2 1 398.595 3.483 20 0 GGADMP CC1CC[NH+](CCNC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000156332917 1423785409 /nfs/dbraw/zinc/78/54/09/1423785409.db2.gz UAKUWUTXKKRGJZ-IFMALSPDSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1cccc(S(=O)(=O)CCC[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000156473468 1423814790 /nfs/dbraw/zinc/81/47/90/1423814790.db2.gz DPYPQULWZPBNDJ-RBUKOAKNSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1cccc(S(=O)(=O)CCC[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000156473468 1423814792 /nfs/dbraw/zinc/81/47/92/1423814792.db2.gz DPYPQULWZPBNDJ-RBUKOAKNSA-N 2 1 378.582 3.401 20 0 GGADMP CCNC(=O)c1ccc(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)cc1 ZINC000156510479 1423821127 /nfs/dbraw/zinc/82/11/27/1423821127.db2.gz CNCZEYHIABNYGC-UHFFFAOYSA-N 2 1 383.511 3.372 20 0 GGADMP CC[NH+]1CCN([C@H]2CCN(c3cc(C)[nH+]c4ccc(OC(F)F)cc43)C2)CC1 ZINC000156582231 1423831799 /nfs/dbraw/zinc/83/17/99/1423831799.db2.gz GJWFLLJOVRRUQE-INIZCTEOSA-N 2 1 390.478 3.361 20 0 GGADMP CC[NH+]1CCN([C@@H]2CCN(c3cc(C)[nH+]c4ccc(OC(F)F)cc43)C2)CC1 ZINC000156582117 1423831906 /nfs/dbraw/zinc/83/19/06/1423831906.db2.gz GJWFLLJOVRRUQE-MRXNPFEDSA-N 2 1 390.478 3.361 20 0 GGADMP Cc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156895054 1423881932 /nfs/dbraw/zinc/88/19/32/1423881932.db2.gz YVSLQGFYNXWOKC-REWPJTCUSA-N 2 1 377.532 3.469 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c(F)c1 ZINC000156893424 1423882138 /nfs/dbraw/zinc/88/21/38/1423882138.db2.gz BQQAUTDCGLHPLO-APWZRJJASA-N 2 1 399.510 3.382 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c(F)c1 ZINC000156893424 1423882140 /nfs/dbraw/zinc/88/21/40/1423882140.db2.gz BQQAUTDCGLHPLO-APWZRJJASA-N 2 1 399.510 3.382 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccnc1Cl ZINC000156909752 1423884261 /nfs/dbraw/zinc/88/42/61/1423884261.db2.gz KLEVFWYFIJWWRD-YJBOKZPZSA-N 2 1 386.927 3.283 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccnc1Cl ZINC000156909752 1423884265 /nfs/dbraw/zinc/88/42/65/1423884265.db2.gz KLEVFWYFIJWWRD-YJBOKZPZSA-N 2 1 386.927 3.283 20 0 GGADMP Cc1ccccc1C[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156929669 1423888484 /nfs/dbraw/zinc/88/84/84/1423888484.db2.gz FQOJYTPZADVCOU-XXBNENTESA-N 2 1 379.548 3.413 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000156949600 1423891832 /nfs/dbraw/zinc/89/18/32/1423891832.db2.gz CNPAHJPERKAYOI-UTKZUKDTSA-N 2 1 381.520 3.243 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)c2cccc(N3CCOC3=O)c2)[C@H](C)C1 ZINC000156982965 1423897295 /nfs/dbraw/zinc/89/72/95/1423897295.db2.gz PSURZWVQTGBJQU-LVCYWYKZSA-N 2 1 389.540 3.431 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(N3CCOC3=O)cc2)[C@H](C)C1 ZINC000157122765 1423931398 /nfs/dbraw/zinc/93/13/98/1423931398.db2.gz QWHGJWSTAOJIQK-LQWHRVPQSA-N 2 1 389.540 3.431 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)NCCC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000157289272 1423976088 /nfs/dbraw/zinc/97/60/88/1423976088.db2.gz VFJZHXKYTFVWFX-OALUTQOASA-N 2 1 387.572 3.171 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000157567575 1424039533 /nfs/dbraw/zinc/03/95/33/1424039533.db2.gz LECATVBIUXPXON-LJQANCHMSA-N 2 1 390.547 3.067 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)cn2)CCO1 ZINC000157712271 1424070922 /nfs/dbraw/zinc/07/09/22/1424070922.db2.gz NYHMPMSPXUJTAA-HXUWFJFHSA-N 2 1 394.563 3.103 20 0 GGADMP CCCOc1cccc(NC(=O)N(CC[NH+](C)C)C[C@@H]2CCC[N@H+]2CC)c1 ZINC000157857832 1424105272 /nfs/dbraw/zinc/10/52/72/1424105272.db2.gz IVKOEKFLEKXHRC-IBGZPJMESA-N 2 1 376.545 3.355 20 0 GGADMP CNS(=O)(=O)c1cccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000158583241 1424295502 /nfs/dbraw/zinc/29/55/02/1424295502.db2.gz QJSOEIYZKJHNNV-KSZLIROESA-N 2 1 381.586 3.003 20 0 GGADMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000158600460 1424299568 /nfs/dbraw/zinc/29/95/68/1424299568.db2.gz NXFSIDSGHLCBNZ-KSZLIROESA-N 2 1 381.586 3.003 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000158654042 1424311077 /nfs/dbraw/zinc/31/10/77/1424311077.db2.gz UVQORYCNALGZDI-OTWHNJEPSA-N 2 1 393.597 3.245 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000158654042 1424311081 /nfs/dbraw/zinc/31/10/81/1424311081.db2.gz UVQORYCNALGZDI-OTWHNJEPSA-N 2 1 393.597 3.245 20 0 GGADMP C[N@@H+]1CCC[C@@H]2C[NH+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000158747233 1424333223 /nfs/dbraw/zinc/33/32/23/1424333223.db2.gz MNRQHQKEMLIPTP-UYAOXDASSA-N 2 1 375.532 3.369 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000158747233 1424333231 /nfs/dbraw/zinc/33/32/31/1424333231.db2.gz MNRQHQKEMLIPTP-UYAOXDASSA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000158747233 1424333241 /nfs/dbraw/zinc/33/32/41/1424333241.db2.gz MNRQHQKEMLIPTP-UYAOXDASSA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000158747233 1424333250 /nfs/dbraw/zinc/33/32/50/1424333250.db2.gz MNRQHQKEMLIPTP-UYAOXDASSA-N 2 1 375.532 3.369 20 0 GGADMP COc1ccc2cc(CN(C)C(=O)CN3CC[C@H]4[C@H](CCC[N@H+]4C)C3)ccc2c1 ZINC000158943539 1424379018 /nfs/dbraw/zinc/37/90/18/1424379018.db2.gz NBHVFJYWTBXLMW-GGAORHGYSA-N 2 1 395.547 3.223 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000158959577 1424382477 /nfs/dbraw/zinc/38/24/77/1424382477.db2.gz VGWWKFBBMBZIGL-IBGZPJMESA-N 2 1 392.613 3.237 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)NCCC2CC[NH+](C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000158979041 1424386916 /nfs/dbraw/zinc/38/69/16/1424386916.db2.gz RYWVAAJLHVOEGI-KNQAVFIVSA-N 2 1 386.584 3.413 20 0 GGADMP CCc1cc(N2CCC([NH2+]C3CC[NH+](CCc4ccccc4)CC3)CC2)ncn1 ZINC000159048646 1424404713 /nfs/dbraw/zinc/40/47/13/1424404713.db2.gz VSNPGNRPYGMXGY-UHFFFAOYSA-N 2 1 393.579 3.305 20 0 GGADMP O[C@H](COCc1ccco1)C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000159207427 1424443249 /nfs/dbraw/zinc/44/32/49/1424443249.db2.gz UHMDJGDCJXDRFC-FUDKSRODSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000159207427 1424443257 /nfs/dbraw/zinc/44/32/57/1424443257.db2.gz UHMDJGDCJXDRFC-FUDKSRODSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000159207427 1424443260 /nfs/dbraw/zinc/44/32/60/1424443260.db2.gz UHMDJGDCJXDRFC-FUDKSRODSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000159207427 1424443267 /nfs/dbraw/zinc/44/32/67/1424443267.db2.gz UHMDJGDCJXDRFC-FUDKSRODSA-N 2 1 384.520 3.144 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cn2cnc3cc(F)c(F)cc32)CC1 ZINC000159871730 1424546470 /nfs/dbraw/zinc/54/64/70/1424546470.db2.gz MPYLIJSFEOXKPZ-UHFFFAOYSA-N 2 1 380.483 3.342 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000160264510 1424591474 /nfs/dbraw/zinc/59/14/74/1424591474.db2.gz FDYFWNYQFWHDKC-MSOLQXFVSA-N 2 1 379.570 3.142 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000160264510 1424591477 /nfs/dbraw/zinc/59/14/77/1424591477.db2.gz FDYFWNYQFWHDKC-MSOLQXFVSA-N 2 1 379.570 3.142 20 0 GGADMP C[C@@H](C[C@@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000160477030 1424606915 /nfs/dbraw/zinc/60/69/15/1424606915.db2.gz UIKZPJJKXFVSMI-OALUTQOASA-N 2 1 397.604 3.381 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000160578207 1424614951 /nfs/dbraw/zinc/61/49/51/1424614951.db2.gz KIQNRTQFOYNCNR-SFHVURJKSA-N 2 1 395.503 3.326 20 0 GGADMP CN(C(=O)NCCSC(C)(C)C)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000160609391 1424618184 /nfs/dbraw/zinc/61/81/84/1424618184.db2.gz ZZNGRJBUCASNLX-RBUKOAKNSA-N 2 1 398.661 3.497 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(N2CCOCC2)cc1Cl ZINC000160683745 1424626565 /nfs/dbraw/zinc/62/65/65/1424626565.db2.gz SSYCNOKMBRZQQB-IEBWSBKVSA-N 2 1 395.975 3.064 20 0 GGADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1 ZINC000161644281 1424731506 /nfs/dbraw/zinc/73/15/06/1424731506.db2.gz QZWYGGKUJBLNME-SFHVURJKSA-N 2 1 393.597 3.386 20 0 GGADMP COC(C)(C)C[C@H](C)NC(=O)N(C)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000161686777 1424740306 /nfs/dbraw/zinc/74/03/06/1424740306.db2.gz SUJOISHYFNQGEF-YSIASYRMSA-N 2 1 396.620 3.169 20 0 GGADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)c2cccc(-n3cnnn3)c2)CC1 ZINC000162129816 1424818484 /nfs/dbraw/zinc/81/84/84/1424818484.db2.gz DALDPEPCXSTAJD-GOSISDBHSA-N 2 1 376.508 3.286 20 0 GGADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)c2ccc(-n3cnnn3)cc2)CC1 ZINC000162162465 1424821193 /nfs/dbraw/zinc/82/11/93/1424821193.db2.gz OHDKAFJNSAKHKF-SFHVURJKSA-N 2 1 376.508 3.286 20 0 GGADMP Cc1csc(N2CCC([NH2+]C3CCN(c4cc(C)[nH+]c(C)n4)CC3)CC2)n1 ZINC000162240474 1424829775 /nfs/dbraw/zinc/82/97/75/1424829775.db2.gz DATRVTQXFULTNX-UHFFFAOYSA-N 2 1 386.569 3.086 20 0 GGADMP CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000162841482 1424895823 /nfs/dbraw/zinc/89/58/23/1424895823.db2.gz GQNCKGITMVNAPO-OAQYLSRUSA-N 2 1 399.583 3.204 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC000163072616 1424935327 /nfs/dbraw/zinc/93/53/27/1424935327.db2.gz ZYRASKJKIMUQRI-UHFFFAOYSA-N 2 1 378.536 3.021 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccc2)CC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000163240059 1424965091 /nfs/dbraw/zinc/96/50/91/1424965091.db2.gz UZJIGKBXDRRZIT-REWPJTCUSA-N 2 1 396.579 3.309 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc(-n2cnnn2)cc1 ZINC000163264100 1424968856 /nfs/dbraw/zinc/96/88/56/1424968856.db2.gz AELSFCJTZZADHU-LVCYWYKZSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc(-n2cnnn2)cc1 ZINC000163264100 1424968868 /nfs/dbraw/zinc/96/88/68/1424968868.db2.gz AELSFCJTZZADHU-LVCYWYKZSA-N 2 1 376.508 3.366 20 0 GGADMP Cn1cc([C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)c2cccc(F)c2)cn1 ZINC000180152035 1429763449 /nfs/dbraw/zinc/76/34/49/1429763449.db2.gz DEPJUPYSSRHSNK-JOCHJYFZSA-N 2 1 382.483 3.379 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(-n2cnnn2)cc1 ZINC000163264447 1424969405 /nfs/dbraw/zinc/96/94/05/1424969405.db2.gz AELSFCJTZZADHU-WFXMLNOXSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(-n2cnnn2)cc1 ZINC000163264447 1424969414 /nfs/dbraw/zinc/96/94/14/1424969414.db2.gz AELSFCJTZZADHU-WFXMLNOXSA-N 2 1 376.508 3.366 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cccc(OCC(=O)N(C)C)c2)cc1 ZINC000163805620 1425046389 /nfs/dbraw/zinc/04/63/89/1425046389.db2.gz PVMURXLBMRBZEU-QGZVFWFLSA-N 2 1 392.503 3.499 20 0 GGADMP CC[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1cnn(C)c1 ZINC000163934449 1425059727 /nfs/dbraw/zinc/05/97/27/1425059727.db2.gz ORFJMWZVVXQRSC-QFIPXVFZSA-N 2 1 386.540 3.151 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1cncs1 ZINC000163954250 1425061270 /nfs/dbraw/zinc/06/12/70/1425061270.db2.gz CSLNAUFUXNQGTI-INIZCTEOSA-N 2 1 375.538 3.484 20 0 GGADMP CCn1cc([C@@H](C)[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)cn1 ZINC000163963350 1425062316 /nfs/dbraw/zinc/06/23/16/1425062316.db2.gz WKNOVIYPYPEGRK-GOSISDBHSA-N 2 1 386.540 3.243 20 0 GGADMP CCn1cc([C@H](C)[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)cn1 ZINC000163963446 1425062403 /nfs/dbraw/zinc/06/24/03/1425062403.db2.gz WKNOVIYPYPEGRK-SFHVURJKSA-N 2 1 386.540 3.243 20 0 GGADMP CC[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)[C@@H]1CCOC1 ZINC000163968333 1425063519 /nfs/dbraw/zinc/06/35/19/1425063519.db2.gz ZMLYIQMNBNCOSJ-KNQAVFIVSA-N 2 1 376.541 3.081 20 0 GGADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cccc(N3CCCS3(=O)=O)c2)CC1 ZINC000164464776 1425115177 /nfs/dbraw/zinc/11/51/77/1425115177.db2.gz BUAHNUWMTBYUNG-QGZVFWFLSA-N 2 1 379.570 3.142 20 0 GGADMP CC[NH+](CC)CCOc1ccc(CN[C@@H]2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1OC ZINC000164923942 1425151635 /nfs/dbraw/zinc/15/16/35/1425151635.db2.gz GSHAJDQTUHCZGL-NLWGTHIKSA-N 2 1 377.573 3.234 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)cc1OC ZINC000164923942 1425151641 /nfs/dbraw/zinc/15/16/41/1425151641.db2.gz GSHAJDQTUHCZGL-NLWGTHIKSA-N 3 1 377.573 3.234 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1OC ZINC000164923942 1425151649 /nfs/dbraw/zinc/15/16/49/1425151649.db2.gz GSHAJDQTUHCZGL-NLWGTHIKSA-N 3 1 377.573 3.234 20 0 GGADMP CN(C)C(=O)C1(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CCCC1 ZINC000165101416 1425164807 /nfs/dbraw/zinc/16/48/07/1425164807.db2.gz KYMDMRWFRSYWNN-UHFFFAOYSA-N 2 1 375.532 3.071 20 0 GGADMP CN(C)C(=O)c1cccc(CC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000165105060 1425164890 /nfs/dbraw/zinc/16/48/90/1425164890.db2.gz PARQPQBHQGGWHX-UHFFFAOYSA-N 2 1 379.548 3.228 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(-n2cncn2)cc1 ZINC000165343485 1425176239 /nfs/dbraw/zinc/17/62/39/1425176239.db2.gz KBTAAFFWYYVVDF-FPOVZHCZSA-N 2 1 375.520 3.483 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(-n2cncn2)cc1 ZINC000165343847 1425176376 /nfs/dbraw/zinc/17/63/76/1425176376.db2.gz KBTAAFFWYYVVDF-TZIWHRDSSA-N 2 1 375.520 3.483 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(-n2cncn2)cc1 ZINC000165343707 1425176473 /nfs/dbraw/zinc/17/64/73/1425176473.db2.gz KBTAAFFWYYVVDF-PZJWPPBQSA-N 2 1 375.520 3.483 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000165343327 1425176559 /nfs/dbraw/zinc/17/65/59/1425176559.db2.gz OECMQKPORDXYMM-UYAOXDASSA-N 2 1 386.561 3.305 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000165343327 1425176563 /nfs/dbraw/zinc/17/65/63/1425176563.db2.gz OECMQKPORDXYMM-UYAOXDASSA-N 2 1 386.561 3.305 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000165343061 1425176644 /nfs/dbraw/zinc/17/66/44/1425176644.db2.gz OECMQKPORDXYMM-QUCCMNQESA-N 2 1 386.561 3.305 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000165343061 1425176649 /nfs/dbraw/zinc/17/66/49/1425176649.db2.gz OECMQKPORDXYMM-QUCCMNQESA-N 2 1 386.561 3.305 20 0 GGADMP C[C@@H]1C[C@@H](NCc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)CC[N@H+]1C ZINC000165579645 1425185756 /nfs/dbraw/zinc/18/57/56/1425185756.db2.gz HRFHGQVQMILADD-QAPCUYQASA-N 2 1 384.490 3.030 20 0 GGADMP CC[N@H+]1CC[C@@H](NCc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)[C@H](C)C1 ZINC000165584294 1425185884 /nfs/dbraw/zinc/18/58/84/1425185884.db2.gz RFHVONVLHNGTCS-VQIMIIECSA-N 2 1 398.517 3.277 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1NCc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000165587236 1425186078 /nfs/dbraw/zinc/18/60/78/1425186078.db2.gz FYHOVVDUMSIGBQ-GPMSIDNRSA-N 2 1 398.517 3.276 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1NCc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000165586974 1425186118 /nfs/dbraw/zinc/18/61/18/1425186118.db2.gz FYHOVVDUMSIGBQ-MDZRGWNJSA-N 2 1 398.517 3.276 20 0 GGADMP C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)C1CC[NH+](C)CC1 ZINC000165600454 1425187363 /nfs/dbraw/zinc/18/73/63/1425187363.db2.gz LJTDPJVNXJYMOG-MRXNPFEDSA-N 2 1 398.517 3.277 20 0 GGADMP COc1ccccc1[C@H]([NH3+])C(=O)NCc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000166421926 1425212679 /nfs/dbraw/zinc/21/26/79/1425212679.db2.gz ZKPQLVRTVVVKIQ-QFIPXVFZSA-N 2 1 381.520 3.243 20 0 GGADMP C[C@H]1C[C@H](NC(=O)C2(c3ccccc3)CC[NH2+]CC2)CC[N@H+]1Cc1ccccc1 ZINC000167544396 1425227365 /nfs/dbraw/zinc/22/73/65/1425227365.db2.gz BYJBROYEWCWUPE-NZQKXSOJSA-N 2 1 391.559 3.477 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)CC[N@@H+]1C ZINC000167889660 1425233053 /nfs/dbraw/zinc/23/30/53/1425233053.db2.gz OOKXBDRUECDWTH-XLIONFOSSA-N 2 1 398.551 3.014 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)CC[N@H+]1C ZINC000167889660 1425233064 /nfs/dbraw/zinc/23/30/64/1425233064.db2.gz OOKXBDRUECDWTH-XLIONFOSSA-N 2 1 398.551 3.014 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCN(c4ncccc4F)C3)CC2)cc1 ZINC000168165515 1425235513 /nfs/dbraw/zinc/23/55/13/1425235513.db2.gz MYFPNGJVTQAUCT-HXUWFJFHSA-N 2 1 386.490 3.235 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000168784284 1425239055 /nfs/dbraw/zinc/23/90/55/1425239055.db2.gz FXAQVTTYTPBXGC-SOUXKNCUSA-N 2 1 379.504 3.007 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000168784284 1425239065 /nfs/dbraw/zinc/23/90/65/1425239065.db2.gz FXAQVTTYTPBXGC-SOUXKNCUSA-N 2 1 379.504 3.007 20 0 GGADMP Cc1nc(C[NH+]2CCC(CNC(=O)CC[C@@H]([NH3+])c3ccccc3)CC2)oc1C ZINC000168625133 1425239122 /nfs/dbraw/zinc/23/91/22/1425239122.db2.gz VRPFAZBDGSKHMI-HXUWFJFHSA-N 2 1 384.524 3.100 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@H]3CCCCCC[C@H]3[NH3+])CC2)cs1 ZINC000168630576 1425239854 /nfs/dbraw/zinc/23/98/54/1425239854.db2.gz SIAMDQZQNQZAMV-RBUKOAKNSA-N 2 1 392.613 3.331 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@H]3CCCCCC[C@@H]3[NH3+])CC2)cs1 ZINC000168630401 1425240034 /nfs/dbraw/zinc/24/00/34/1425240034.db2.gz SIAMDQZQNQZAMV-OALUTQOASA-N 2 1 392.613 3.331 20 0 GGADMP COc1ccccc1[C@H]([NH3+])C(=O)Nc1ccc(N2CCC(C[NH+](C)C)CC2)cc1 ZINC000169207280 1425243765 /nfs/dbraw/zinc/24/37/65/1425243765.db2.gz RXUDVDJXHUBUPU-QFIPXVFZSA-N 2 1 396.535 3.112 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[NH+]3C[C@@H](C)C[C@H](C)C3)CC2)cs1 ZINC000170685344 1425298705 /nfs/dbraw/zinc/29/87/05/1425298705.db2.gz YBMFIWOSGJWALY-IRXDYDNUSA-N 2 1 392.613 3.148 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[N@H+]3CCCC[C@@H]3C)CC2)cs1 ZINC000170693399 1425303095 /nfs/dbraw/zinc/30/30/95/1425303095.db2.gz VQRXDVUCVBILIU-INIZCTEOSA-N 2 1 378.586 3.044 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[N@@H+]3CCCC[C@@H]3C)CC2)cs1 ZINC000170693399 1425303102 /nfs/dbraw/zinc/30/31/02/1425303102.db2.gz VQRXDVUCVBILIU-INIZCTEOSA-N 2 1 378.586 3.044 20 0 GGADMP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)CCCC[NH+]2CCOCC2)C1 ZINC000170694403 1425303872 /nfs/dbraw/zinc/30/38/72/1425303872.db2.gz LBFFKKJOMHZGEF-FQEVSTJZSA-N 2 1 387.568 3.037 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)CCCC[NH+]2CCOCC2)C1 ZINC000170694403 1425303881 /nfs/dbraw/zinc/30/38/81/1425303881.db2.gz LBFFKKJOMHZGEF-FQEVSTJZSA-N 2 1 387.568 3.037 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)CC1 ZINC000171043403 1425451997 /nfs/dbraw/zinc/45/19/97/1425451997.db2.gz KDZKPOHEUGCERC-INIZCTEOSA-N 2 1 378.586 3.011 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)CC1 ZINC000171043403 1425452007 /nfs/dbraw/zinc/45/20/07/1425452007.db2.gz KDZKPOHEUGCERC-INIZCTEOSA-N 2 1 378.586 3.011 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cnc(-c2ccccc2)nc1 ZINC000171165836 1425522558 /nfs/dbraw/zinc/52/25/58/1425522558.db2.gz ZCHLUIGVHIBPEW-FQEVSTJZSA-N 2 1 396.539 3.023 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cnc(-c2ccccc2)nc1 ZINC000171165831 1425522669 /nfs/dbraw/zinc/52/26/69/1425522669.db2.gz ZCHLUIGVHIBPEW-HXUWFJFHSA-N 2 1 396.539 3.023 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000171189096 1425530627 /nfs/dbraw/zinc/53/06/27/1425530627.db2.gz BVQSIZUGFCLLFM-GOSISDBHSA-N 2 1 383.540 3.039 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000171189087 1425530996 /nfs/dbraw/zinc/53/09/96/1425530996.db2.gz BVQSIZUGFCLLFM-SFHVURJKSA-N 2 1 383.540 3.039 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000171212140 1425542629 /nfs/dbraw/zinc/54/26/29/1425542629.db2.gz WRWDVUVGGSRXHE-MRXNPFEDSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@H](c1ccc(C)cc1)[NH+]1CCCC1 ZINC000171211901 1425542747 /nfs/dbraw/zinc/54/27/47/1425542747.db2.gz UNNGGLCEHRSLQU-WIYYLYMNSA-N 2 1 383.540 3.272 20 0 GGADMP C[C@@H]1C[N@H+](CC2CCN(C(=O)Nc3cccc(C[NH+](C)C)c3)CC2)C[C@H](C)O1 ZINC000171247588 1425566244 /nfs/dbraw/zinc/56/62/44/1425566244.db2.gz XXSHLJNYOUXPCX-HDICACEKSA-N 2 1 388.556 3.101 20 0 GGADMP CC(C)n1ncc2cc(C[NH+]3CCC(C[N@@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)cnc21 ZINC000171303918 1425605746 /nfs/dbraw/zinc/60/57/46/1425605746.db2.gz BBMFBOAEBZUQJF-HDICACEKSA-N 2 1 385.556 3.333 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CCC(=O)Nc3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000171304521 1425606173 /nfs/dbraw/zinc/60/61/73/1425606173.db2.gz BARCFFFPPMYVBI-CALCHBBNSA-N 2 1 393.959 3.490 20 0 GGADMP Cc1ccc(C)c(NC(=O)[C@@H](C)[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000171306000 1425606795 /nfs/dbraw/zinc/60/67/95/1425606795.db2.gz STCITNMLQCQYLH-HSALFYBXSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1ccc(C)c(NC(=O)[C@@H](C)[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000171306000 1425606801 /nfs/dbraw/zinc/60/68/01/1425606801.db2.gz STCITNMLQCQYLH-HSALFYBXSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000171362697 1425641088 /nfs/dbraw/zinc/64/10/88/1425641088.db2.gz BXCVTISWSBCYJF-ICSRJNTNSA-N 2 1 375.561 3.125 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[C@H]1C[NH+]1CCCC1)c1ccccc1Cl ZINC000171588147 1425748971 /nfs/dbraw/zinc/74/89/71/1425748971.db2.gz DCHHKPSEJOECQJ-QFBILLFUSA-N 2 1 378.948 3.213 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[C@@H]1C[NH+]1CCCC1)c1ccccc1Cl ZINC000171588132 1425749178 /nfs/dbraw/zinc/74/91/78/1425749178.db2.gz DCHHKPSEJOECQJ-APWZRJJASA-N 2 1 378.948 3.213 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)NCC[N@@H+](C)C3CCCC3)c(C)c2)CC1 ZINC000171650583 1425773712 /nfs/dbraw/zinc/77/37/12/1425773712.db2.gz DHZSQPGAJRSDHT-UHFFFAOYSA-N 2 1 387.572 3.133 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[C@H]2C[NH+]2CCCC2)cc1F ZINC000171661749 1425780534 /nfs/dbraw/zinc/78/05/34/1425780534.db2.gz DZGAENOCBJPDRM-SFHVURJKSA-N 2 1 385.487 3.090 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000171679988 1425787077 /nfs/dbraw/zinc/78/70/77/1425787077.db2.gz SHWFBEPPUBUGAW-UHFFFAOYSA-N 2 1 387.568 3.181 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)CCCC[NH+]2CCOCC2)c2ccccc2)CC1 ZINC000171762842 1425813894 /nfs/dbraw/zinc/81/38/94/1425813894.db2.gz KHHSVGJHCDEQLY-JOCHJYFZSA-N 2 1 387.568 3.078 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)CCCC[NH+]2CCOCC2)c2ccccc2)CC1 ZINC000171762839 1425814051 /nfs/dbraw/zinc/81/40/51/1425814051.db2.gz KHHSVGJHCDEQLY-QFIPXVFZSA-N 2 1 387.568 3.078 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)CCCC[NH+]3CCOCC3)c2)CC1 ZINC000171771931 1425816261 /nfs/dbraw/zinc/81/62/61/1425816261.db2.gz CIAJXZRYNDUHNN-UHFFFAOYSA-N 2 1 387.568 3.037 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000171863230 1425837720 /nfs/dbraw/zinc/83/77/20/1425837720.db2.gz IDRKWDJABVCFJY-FQEVSTJZSA-N 2 1 391.559 3.257 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000171863230 1425837722 /nfs/dbraw/zinc/83/77/22/1425837722.db2.gz IDRKWDJABVCFJY-FQEVSTJZSA-N 2 1 391.559 3.257 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](C)[C@H](C)c2cccc(O)c2)CC1 ZINC000171939049 1425857407 /nfs/dbraw/zinc/85/74/07/1425857407.db2.gz UOQDVHIBGLSAKD-LJQANCHMSA-N 2 1 395.547 3.474 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+](C)[C@H](C)c2cccc(O)c2)CC1 ZINC000171939049 1425857408 /nfs/dbraw/zinc/85/74/08/1425857408.db2.gz UOQDVHIBGLSAKD-LJQANCHMSA-N 2 1 395.547 3.474 20 0 GGADMP c1cc(C[NH+]2CCCCC2)cc(-c2noc(CCCC[NH+]3CCOCC3)n2)c1 ZINC000172051095 1425882899 /nfs/dbraw/zinc/88/28/99/1425882899.db2.gz RVMUOBBNTDYVLW-UHFFFAOYSA-N 2 1 384.524 3.377 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)NC2CC[NH+](CC3CC3)CC2)C1 ZINC000172223607 1425953913 /nfs/dbraw/zinc/95/39/13/1425953913.db2.gz XPAKMQANBCBYSA-QUCCMNQESA-N 2 1 376.589 3.157 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)[nH+]c1 ZINC000172247570 1425965214 /nfs/dbraw/zinc/96/52/14/1425965214.db2.gz UUYYLFLMYCZNMW-UHFFFAOYSA-N 2 1 395.551 3.498 20 0 GGADMP CSCC[C@H](C)[N@@H+](C)CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000172432926 1426042390 /nfs/dbraw/zinc/04/23/90/1426042390.db2.gz OIZNAOZRSKXUJL-SFHVURJKSA-N 2 1 377.598 3.149 20 0 GGADMP O=C(N[C@@H](C[NH+]1CCCC1)c1ccccc1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172543033 1426080043 /nfs/dbraw/zinc/08/00/43/1426080043.db2.gz BELDZEWWDIFESJ-QFIPXVFZSA-N 2 1 384.568 3.483 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CCC[NH+](C3CCCC3)CC2)C1 ZINC000172544360 1426080766 /nfs/dbraw/zinc/08/07/66/1426080766.db2.gz IIADMUGKARGSIR-BGYRXZFFSA-N 2 1 378.605 3.404 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CCC[N@@H+](C3CCCC3)CC2)C1 ZINC000172544360 1426080774 /nfs/dbraw/zinc/08/07/74/1426080774.db2.gz IIADMUGKARGSIR-BGYRXZFFSA-N 2 1 378.605 3.404 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CCC[N@H+](C3CCCC3)CC2)C1 ZINC000172544360 1426080781 /nfs/dbraw/zinc/08/07/81/1426080781.db2.gz IIADMUGKARGSIR-BGYRXZFFSA-N 2 1 378.605 3.404 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CCC[N@H+](C3CCCC3)CC2)C1 ZINC000172544371 1426080831 /nfs/dbraw/zinc/08/08/31/1426080831.db2.gz IIADMUGKARGSIR-WOJBJXKFSA-N 2 1 378.605 3.404 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)[NH+]1CCc2ccccc2C1 ZINC000172550020 1426082492 /nfs/dbraw/zinc/08/24/92/1426082492.db2.gz MJZBNFCULWJOPN-LJQANCHMSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](CNC(=O)N1CCC[NH+](C2CCCC2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000172550020 1426082499 /nfs/dbraw/zinc/08/24/99/1426082499.db2.gz MJZBNFCULWJOPN-LJQANCHMSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](CNC(=O)N1CCC[NH+](C2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000172550020 1426082508 /nfs/dbraw/zinc/08/25/08/1426082508.db2.gz MJZBNFCULWJOPN-LJQANCHMSA-N 2 1 384.568 3.093 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)c1ccco1 ZINC000172569029 1426091794 /nfs/dbraw/zinc/09/17/94/1426091794.db2.gz NNQIKFVDQBUCME-LJQANCHMSA-N 2 1 376.545 3.322 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccc2)CC1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172651924 1426128214 /nfs/dbraw/zinc/12/82/14/1426128214.db2.gz HSPPCKTUCIDMFV-UHFFFAOYSA-N 2 1 384.568 3.311 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)cc1)[NH+]1CCOCC1 ZINC000173136848 1426358936 /nfs/dbraw/zinc/35/89/36/1426358936.db2.gz GGIJJTQCICSDIP-GHTZIAJQSA-N 2 1 388.556 3.418 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1)[NH+]1CCOCC1 ZINC000173136848 1426358943 /nfs/dbraw/zinc/35/89/43/1426358943.db2.gz GGIJJTQCICSDIP-GHTZIAJQSA-N 2 1 388.556 3.418 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(C)c(OC(F)F)c1 ZINC000173187788 1426383050 /nfs/dbraw/zinc/38/30/50/1426383050.db2.gz ODNKMSGUMHYRMR-QGZVFWFLSA-N 2 1 398.498 3.476 20 0 GGADMP CCc1nc2cc(NC(=O)N(CC[NH+](C)C)C[C@@H]3CCC[N@@H+]3CC)ccc2o1 ZINC000173238558 1426423845 /nfs/dbraw/zinc/42/38/45/1426423845.db2.gz LHCCFKONRGGWTM-KRWDZBQOSA-N 2 1 387.528 3.270 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173304407 1426486492 /nfs/dbraw/zinc/48/64/92/1426486492.db2.gz JULLHRQBKFYWSU-QGZVFWFLSA-N 2 1 381.586 3.242 20 0 GGADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173304407 1426486507 /nfs/dbraw/zinc/48/65/07/1426486507.db2.gz JULLHRQBKFYWSU-QGZVFWFLSA-N 2 1 381.586 3.242 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000173323592 1426506489 /nfs/dbraw/zinc/50/64/89/1426506489.db2.gz GZKORVOZBUCXRA-GGAORHGYSA-N 2 1 394.563 3.453 20 0 GGADMP C[C@@H]1CCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000173351892 1426528602 /nfs/dbraw/zinc/52/86/02/1426528602.db2.gz HUQKEHJTLFBIST-QUCCMNQESA-N 2 1 384.524 3.188 20 0 GGADMP C[C@@H]1CCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@H+]1Cc1ccccc1 ZINC000173351892 1426528609 /nfs/dbraw/zinc/52/86/09/1426528609.db2.gz HUQKEHJTLFBIST-QUCCMNQESA-N 2 1 384.524 3.188 20 0 GGADMP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000173351300 1426529020 /nfs/dbraw/zinc/52/90/20/1426529020.db2.gz SQODDHSHGQZLKP-UXHICEINSA-N 2 1 384.524 3.046 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000173351300 1426529032 /nfs/dbraw/zinc/52/90/32/1426529032.db2.gz SQODDHSHGQZLKP-UXHICEINSA-N 2 1 384.524 3.046 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@@H]1CCSc2ccccc21 ZINC000173376072 1426548988 /nfs/dbraw/zinc/54/89/88/1426548988.db2.gz LQCITPQNKPRXIP-PKOBYXMFSA-N 2 1 390.597 3.281 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000173430208 1426611900 /nfs/dbraw/zinc/61/19/00/1426611900.db2.gz GRDVQLLLYAVGHE-LJQANCHMSA-N 2 1 383.540 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000173430208 1426611906 /nfs/dbraw/zinc/61/19/06/1426611906.db2.gz GRDVQLLLYAVGHE-LJQANCHMSA-N 2 1 383.540 3.278 20 0 GGADMP C(CC[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1)C[NH+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173605252 1426778325 /nfs/dbraw/zinc/77/83/25/1426778325.db2.gz LIUXMIMPQUAWFP-PSWAGMNNSA-N 4 1 390.660 3.382 20 0 GGADMP C(CC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1)C[NH+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000173605252 1426778343 /nfs/dbraw/zinc/77/83/43/1426778343.db2.gz LIUXMIMPQUAWFP-PSWAGMNNSA-N 4 1 390.660 3.382 20 0 GGADMP C(CC[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1)C[NH+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000173605252 1426778374 /nfs/dbraw/zinc/77/83/74/1426778374.db2.gz LIUXMIMPQUAWFP-PSWAGMNNSA-N 4 1 390.660 3.382 20 0 GGADMP C[C@H](CCNC(=O)CC1([NH+]2CCOCC2)CCCC1)[N@@H+](C)Cc1ccccc1 ZINC000173615609 1426794401 /nfs/dbraw/zinc/79/44/01/1426794401.db2.gz SVZSEFGTEOKXFK-HXUWFJFHSA-N 2 1 387.568 3.048 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3ccn(-c4ccc(F)cc4)n3)CC2)C[C@H](C)O1 ZINC000173623233 1426801189 /nfs/dbraw/zinc/80/11/89/1426801189.db2.gz PPJRAMWFYCLLNC-HDICACEKSA-N 2 1 386.515 3.333 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3ccn(-c4ccc(F)cc4)n3)CC2)C[C@H](C)O1 ZINC000173623233 1426801190 /nfs/dbraw/zinc/80/11/90/1426801190.db2.gz PPJRAMWFYCLLNC-HDICACEKSA-N 2 1 386.515 3.333 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](Cc3ccn(-c4ccc(F)cc4)n3)CC2)C[C@@H](C)O1 ZINC000173623262 1426801230 /nfs/dbraw/zinc/80/12/30/1426801230.db2.gz PPJRAMWFYCLLNC-QZTJIDSGSA-N 2 1 386.515 3.333 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc4c(c3)CCC4)c2)C1 ZINC000173838059 1426865362 /nfs/dbraw/zinc/86/53/62/1426865362.db2.gz PNLGZLKJTAYTOW-HSZRJFAPSA-N 2 1 377.532 3.162 20 0 GGADMP CC(C)[C@@H]1C[N@H+]([C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CCS1 ZINC000173864069 1426874665 /nfs/dbraw/zinc/87/46/65/1426874665.db2.gz HDFANKXAOOHWAH-RXVVDRJESA-N 2 1 389.609 3.229 20 0 GGADMP O[C@H](COc1cccc(C(F)(F)F)c1)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173872139 1426877584 /nfs/dbraw/zinc/87/75/84/1426877584.db2.gz SXLCWGUWOSLIPC-AEFFLSMTSA-N 2 1 386.458 3.253 20 0 GGADMP O[C@H](COc1cccc(C(F)(F)F)c1)C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173872139 1426877588 /nfs/dbraw/zinc/87/75/88/1426877588.db2.gz SXLCWGUWOSLIPC-AEFFLSMTSA-N 2 1 386.458 3.253 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCN(c2ccn(C)n2)C1=O ZINC000173923815 1426893773 /nfs/dbraw/zinc/89/37/73/1426893773.db2.gz ZYZSIBKXAHZHKZ-WIYYLYMNSA-N 2 1 395.551 3.080 20 0 GGADMP CC(C)[C@H](NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000173946663 1426904054 /nfs/dbraw/zinc/90/40/54/1426904054.db2.gz FNLHYBGFJZVSQD-QHCPKHFHSA-N 2 1 387.568 3.077 20 0 GGADMP Cc1ccc(F)cc1NC(=O)[C@@H](C)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173948813 1426904547 /nfs/dbraw/zinc/90/45/47/1426904547.db2.gz GQXLLVIHUGFVGO-QGZVFWFLSA-N 2 1 377.504 3.038 20 0 GGADMP Clc1ccc(-c2noc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)n2)cc1 ZINC000173948495 1426904565 /nfs/dbraw/zinc/90/45/65/1426904565.db2.gz PGFHJASGMOZUHT-UHFFFAOYSA-N 2 1 390.915 3.467 20 0 GGADMP Cc1sc(NC(=O)C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(C)c1C ZINC000173947525 1426904857 /nfs/dbraw/zinc/90/48/57/1426904857.db2.gz JFNKHWFPDRDFJQ-UHFFFAOYSA-N 2 1 379.570 3.189 20 0 GGADMP COc1cccc(NC(=O)CC[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000173980457 1426923951 /nfs/dbraw/zinc/92/39/51/1426923951.db2.gz UBYJQPYAZPTNSX-HXUWFJFHSA-N 2 1 381.520 3.478 20 0 GGADMP COc1cccc(NC(=O)CC[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000173980457 1426923956 /nfs/dbraw/zinc/92/39/56/1426923956.db2.gz UBYJQPYAZPTNSX-HXUWFJFHSA-N 2 1 381.520 3.478 20 0 GGADMP COc1cccc(NC(=O)CC[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000173980457 1426923962 /nfs/dbraw/zinc/92/39/62/1426923962.db2.gz UBYJQPYAZPTNSX-HXUWFJFHSA-N 2 1 381.520 3.478 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccncc2)CC1)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000174049721 1426971842 /nfs/dbraw/zinc/97/18/42/1426971842.db2.gz OELZZGUVMMMGRK-QHCPKHFHSA-N 2 1 392.547 3.217 20 0 GGADMP CN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174112309 1427007124 /nfs/dbraw/zinc/00/71/24/1427007124.db2.gz YKXCPFFCVVFDRJ-UXHICEINSA-N 2 1 384.524 3.188 20 0 GGADMP CN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174112309 1427007126 /nfs/dbraw/zinc/00/71/26/1427007126.db2.gz YKXCPFFCVVFDRJ-UXHICEINSA-N 2 1 384.524 3.188 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](C)C[NH+]1CCCC1 ZINC000174114934 1427008538 /nfs/dbraw/zinc/00/85/38/1427008538.db2.gz OCVGQWMZCNANSZ-IRLDBZIGSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](C)C[NH+]1CCCC1 ZINC000174114920 1427008602 /nfs/dbraw/zinc/00/86/02/1427008602.db2.gz OCVGQWMZCNANSZ-IFMALSPDSA-N 2 1 386.584 3.272 20 0 GGADMP Cc1cc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)on1 ZINC000174156368 1427024823 /nfs/dbraw/zinc/02/48/23/1427024823.db2.gz JFTRPZJPUBVNJI-INIZCTEOSA-N 2 1 382.464 3.325 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCN(CC(F)(F)F)C1=O ZINC000174156385 1427024999 /nfs/dbraw/zinc/02/49/99/1427024999.db2.gz ABODXUGALZXWGV-GOSISDBHSA-N 2 1 395.425 3.164 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174241316 1427065492 /nfs/dbraw/zinc/06/54/92/1427065492.db2.gz WXPWBJZNUXLVCN-MRXNPFEDSA-N 2 1 379.932 3.244 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)N[C@H](C)C[NH+]3C[C@@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000174313902 1427097538 /nfs/dbraw/zinc/09/75/38/1427097538.db2.gz AOFNKMAJGSYSOO-GBESFXJTSA-N 2 1 387.572 3.024 20 0 GGADMP C[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000174395740 1427137085 /nfs/dbraw/zinc/13/70/85/1427137085.db2.gz KMHRTVHXSNUHER-RBBKRZOGSA-N 2 1 379.504 3.466 20 0 GGADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000174395740 1427137089 /nfs/dbraw/zinc/13/70/89/1427137089.db2.gz KMHRTVHXSNUHER-RBBKRZOGSA-N 2 1 379.504 3.466 20 0 GGADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000174395740 1427137093 /nfs/dbraw/zinc/13/70/93/1427137093.db2.gz KMHRTVHXSNUHER-RBBKRZOGSA-N 2 1 379.504 3.466 20 0 GGADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000174395740 1427137097 /nfs/dbraw/zinc/13/70/97/1427137097.db2.gz KMHRTVHXSNUHER-RBBKRZOGSA-N 2 1 379.504 3.466 20 0 GGADMP C[N@@H+](CCC(=O)Nc1ccc2c(c1)OCO2)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174400609 1427140554 /nfs/dbraw/zinc/14/05/54/1427140554.db2.gz XJIOVRWWIXCLCG-LJQANCHMSA-N 2 1 395.503 3.198 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc2c(c1)OCO2)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174400609 1427140564 /nfs/dbraw/zinc/14/05/64/1427140564.db2.gz XJIOVRWWIXCLCG-LJQANCHMSA-N 2 1 395.503 3.198 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc2c(c1)OCO2)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174400609 1427140570 /nfs/dbraw/zinc/14/05/70/1427140570.db2.gz XJIOVRWWIXCLCG-LJQANCHMSA-N 2 1 395.503 3.198 20 0 GGADMP CC(C)[NH+]1CCC(C(=O)Nc2ccc3c(ccn3CC[NH+]3CCOCC3)c2)CC1 ZINC000174417252 1427148902 /nfs/dbraw/zinc/14/89/02/1427148902.db2.gz NLCISAHNCNHRMJ-UHFFFAOYSA-N 2 1 398.551 3.032 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1oc(-c2ccccc2)nc1C ZINC000174458169 1427165284 /nfs/dbraw/zinc/16/52/84/1427165284.db2.gz ZFVDOFKHTPEHFW-IBGZPJMESA-N 2 1 384.524 3.138 20 0 GGADMP O=C([C@@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000174568942 1427229531 /nfs/dbraw/zinc/22/95/31/1427229531.db2.gz RFBKZXHEXSBNAC-TZIWHRDSSA-N 2 1 387.593 3.111 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000174568953 1427229631 /nfs/dbraw/zinc/22/96/31/1427229631.db2.gz RFBKZXHEXSBNAC-FPOVZHCZSA-N 2 1 387.593 3.111 20 0 GGADMP C[C@@H](C(=O)Nc1ccccc1-c1ccccc1)[N@@H+](C)CCCN1CC[NH+](C)CC1 ZINC000174715875 1427327495 /nfs/dbraw/zinc/32/74/95/1427327495.db2.gz SUXKLQJLQSXIFB-FQEVSTJZSA-N 2 1 394.563 3.250 20 0 GGADMP Cc1ccccc1NC(=O)CC[NH+]1CCN(CC[N@H+](C)Cc2ccccc2)CC1 ZINC000174780271 1427362745 /nfs/dbraw/zinc/36/27/45/1427362745.db2.gz UUKXWVQFHAPLAY-UHFFFAOYSA-N 2 1 394.563 3.073 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCc1ccc(C[NH+](C)C)cc1 ZINC000174781013 1427363567 /nfs/dbraw/zinc/36/35/67/1427363567.db2.gz KXZGAEQPARQRER-QHCPKHFHSA-N 2 1 394.563 3.412 20 0 GGADMP C[NH+]1CCN(c2ccc(NC(=O)[C@@H]3CCC[N@@H+]3Cc3ccc(F)cc3)cc2)CC1 ZINC000174900600 1427435209 /nfs/dbraw/zinc/43/52/09/1427435209.db2.gz KJBPWBUTSDCBAR-QFIPXVFZSA-N 2 1 396.510 3.181 20 0 GGADMP C[NH+]1CCN(c2ccc(NC(=O)[C@@H]3CCC[N@H+]3Cc3ccc(F)cc3)cc2)CC1 ZINC000174900600 1427435213 /nfs/dbraw/zinc/43/52/13/1427435213.db2.gz KJBPWBUTSDCBAR-QFIPXVFZSA-N 2 1 396.510 3.181 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2ncsc2c1 ZINC000174963237 1427469135 /nfs/dbraw/zinc/46/91/35/1427469135.db2.gz UICGNDRDYATQJV-INIZCTEOSA-N 2 1 375.542 3.176 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](c1ncccc1C)C(C)C ZINC000174981870 1427478048 /nfs/dbraw/zinc/47/80/48/1427478048.db2.gz XDMCQTQCQHUHLP-WOJBJXKFSA-N 2 1 389.588 3.145 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000175060087 1427524951 /nfs/dbraw/zinc/52/49/51/1427524951.db2.gz CPHFYSRAUSSUNG-QHCPKHFHSA-N 2 1 398.595 3.257 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000175224222 1427612033 /nfs/dbraw/zinc/61/20/33/1427612033.db2.gz WXEQAEHPCICYKE-UHFFFAOYSA-N 2 1 387.503 3.075 20 0 GGADMP C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000175251064 1427626452 /nfs/dbraw/zinc/62/64/52/1427626452.db2.gz ZULJEAHXVNKELS-MRXNPFEDSA-N 2 1 392.588 3.449 20 0 GGADMP CCOc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000175302583 1427662246 /nfs/dbraw/zinc/66/22/46/1427662246.db2.gz MCVARKWGCLVTDS-QFIPXVFZSA-N 2 1 396.535 3.079 20 0 GGADMP CC[N@@H+]1CCC[C@H]1CNC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175364748 1427709428 /nfs/dbraw/zinc/70/94/28/1427709428.db2.gz KJEQGRZKUZAHPV-FQEVSTJZSA-N 2 1 384.524 3.195 20 0 GGADMP CC[N@H+]1CCC[C@H]1CNC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175364748 1427709429 /nfs/dbraw/zinc/70/94/29/1427709429.db2.gz KJEQGRZKUZAHPV-FQEVSTJZSA-N 2 1 384.524 3.195 20 0 GGADMP CC[NH+]1CCC[C@H]1CNC(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000175364748 1427709431 /nfs/dbraw/zinc/70/94/31/1427709431.db2.gz KJEQGRZKUZAHPV-FQEVSTJZSA-N 2 1 384.524 3.195 20 0 GGADMP CC[NH+]1CCC[C@H]1CNC(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000175364748 1427709432 /nfs/dbraw/zinc/70/94/32/1427709432.db2.gz KJEQGRZKUZAHPV-FQEVSTJZSA-N 2 1 384.524 3.195 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]([NH+]2CCCC2)C1 ZINC000175455055 1427762794 /nfs/dbraw/zinc/76/27/94/1427762794.db2.gz LOXUGHGSBXNGLA-OAQYLSRUSA-N 2 1 396.535 3.291 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]([NH+]2CCCC2)C1 ZINC000175455055 1427762819 /nfs/dbraw/zinc/76/28/19/1427762819.db2.gz LOXUGHGSBXNGLA-OAQYLSRUSA-N 2 1 396.535 3.291 20 0 GGADMP C[NH+](C)[C@H]1CCCN(C(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000175455880 1427764418 /nfs/dbraw/zinc/76/44/18/1427764418.db2.gz WHGVYHRJLHVWLP-FQEVSTJZSA-N 2 1 384.524 3.147 20 0 GGADMP C[NH+](C)[C@H]1CCCN(C(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000175455880 1427764421 /nfs/dbraw/zinc/76/44/21/1427764421.db2.gz WHGVYHRJLHVWLP-FQEVSTJZSA-N 2 1 384.524 3.147 20 0 GGADMP C[C@@H]1CCC[N@H+](CCNC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000175479312 1427778233 /nfs/dbraw/zinc/77/82/33/1427778233.db2.gz ZZNCGVJDZDQTSC-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000175479312 1427778241 /nfs/dbraw/zinc/77/82/41/1427778241.db2.gz ZZNCGVJDZDQTSC-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000175479312 1427778248 /nfs/dbraw/zinc/77/82/48/1427778248.db2.gz ZZNCGVJDZDQTSC-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000175479312 1427778258 /nfs/dbraw/zinc/77/82/58/1427778258.db2.gz ZZNCGVJDZDQTSC-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+]1CCC[C@H](C)C1 ZINC000175482497 1427778720 /nfs/dbraw/zinc/77/87/20/1427778720.db2.gz CIFQIRLWZFFQGV-UNMCSNQZSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@@H+]1CCC[C@H](C)C1 ZINC000175482497 1427778721 /nfs/dbraw/zinc/77/87/21/1427778721.db2.gz CIFQIRLWZFFQGV-UNMCSNQZSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@H+]1CCC[C@H](C)C1 ZINC000175482497 1427778723 /nfs/dbraw/zinc/77/87/23/1427778723.db2.gz CIFQIRLWZFFQGV-UNMCSNQZSA-N 2 1 386.584 3.272 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCCC[N@H+]3C[C@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000175485098 1427780832 /nfs/dbraw/zinc/78/08/32/1427780832.db2.gz GDWULOYDCDFRQA-KDURUIRLSA-N 2 1 387.572 3.026 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCCC[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000175485098 1427780846 /nfs/dbraw/zinc/78/08/46/1427780846.db2.gz GDWULOYDCDFRQA-KDURUIRLSA-N 2 1 387.572 3.026 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)c1ccco1 ZINC000175542012 1427809419 /nfs/dbraw/zinc/80/94/19/1427809419.db2.gz ROQJYDVYUIQBMO-FQEVSTJZSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]2C[NH+]2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000175629351 1427837883 /nfs/dbraw/zinc/83/78/83/1427837883.db2.gz LAWZJARWWBXULQ-CEMLEFRQSA-N 2 1 384.568 3.309 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000175636030 1427839296 /nfs/dbraw/zinc/83/92/96/1427839296.db2.gz CLQPLYGOMNDZOB-CEMLEFRQSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000175636030 1427839298 /nfs/dbraw/zinc/83/92/98/1427839298.db2.gz CLQPLYGOMNDZOB-CEMLEFRQSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000175636030 1427839299 /nfs/dbraw/zinc/83/92/99/1427839299.db2.gz CLQPLYGOMNDZOB-CEMLEFRQSA-N 2 1 386.584 3.413 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000175755648 1427880097 /nfs/dbraw/zinc/88/00/97/1427880097.db2.gz NFMNTMNUSFQNRK-HXUWFJFHSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCC(C)(C)[N@@H+]3CCC[C@H](C)C3)CC2)[nH+]c1 ZINC000175820539 1427910111 /nfs/dbraw/zinc/91/01/11/1427910111.db2.gz IHMSKVVPRJYZBE-SFHVURJKSA-N 2 1 387.572 3.169 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCC(C)(C)[N@H+]3CCC[C@H](C)C3)CC2)[nH+]c1 ZINC000175820539 1427910115 /nfs/dbraw/zinc/91/01/15/1427910115.db2.gz IHMSKVVPRJYZBE-SFHVURJKSA-N 2 1 387.572 3.169 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCC(C)(C)[N@@H+]3CCC[C@@H](C)C3)CC2)[nH+]c1 ZINC000175820564 1427910245 /nfs/dbraw/zinc/91/02/45/1427910245.db2.gz IHMSKVVPRJYZBE-GOSISDBHSA-N 2 1 387.572 3.169 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCC(C)(C)[N@H+]3CCC[C@@H](C)C3)CC2)[nH+]c1 ZINC000175820564 1427910247 /nfs/dbraw/zinc/91/02/47/1427910247.db2.gz IHMSKVVPRJYZBE-GOSISDBHSA-N 2 1 387.572 3.169 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2scnc2c1 ZINC000175878668 1427947446 /nfs/dbraw/zinc/94/74/46/1427947446.db2.gz VPMROWHDPKQWHA-INIZCTEOSA-N 2 1 375.542 3.176 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2scnc2c1 ZINC000175878645 1427947733 /nfs/dbraw/zinc/94/77/33/1427947733.db2.gz VPMROWHDPKQWHA-MRXNPFEDSA-N 2 1 375.542 3.176 20 0 GGADMP CCN1CC[NH+]([C@@H]2CCN(Cc3csc(CCc4ccccc4)n3)C2)CC1 ZINC000175906930 1427964312 /nfs/dbraw/zinc/96/43/12/1427964312.db2.gz NLNXRGQMQYSUOZ-OAQYLSRUSA-N 2 1 384.593 3.140 20 0 GGADMP CCN1CC[NH+]([C@H]2CCN(Cc3csc(CCc4ccccc4)n3)C2)CC1 ZINC000175906950 1427964428 /nfs/dbraw/zinc/96/44/28/1427964428.db2.gz NLNXRGQMQYSUOZ-NRFANRHFSA-N 2 1 384.593 3.140 20 0 GGADMP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)C1 ZINC000175923374 1427974730 /nfs/dbraw/zinc/97/47/30/1427974730.db2.gz LKXQTLNVIIKSFD-ZWKOTPCHSA-N 2 1 394.510 3.101 20 0 GGADMP C[N@@H+](CCNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)Cc1ccccc1 ZINC000175965131 1428002047 /nfs/dbraw/zinc/00/20/47/1428002047.db2.gz CRHIZMVYUUYEQS-UHFFFAOYSA-N 2 1 394.563 3.424 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(CCSC)cc1 ZINC000176022519 1428032096 /nfs/dbraw/zinc/03/20/96/1428032096.db2.gz BPAFQAYMYNSWPK-HXUWFJFHSA-N 2 1 392.613 3.472 20 0 GGADMP C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000176044503 1428046663 /nfs/dbraw/zinc/04/66/63/1428046663.db2.gz PGXHMZVIDYDFBQ-RCCFBDPRSA-N 2 1 378.586 3.132 20 0 GGADMP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)C1 ZINC000176190204 1428153804 /nfs/dbraw/zinc/15/38/04/1428153804.db2.gz TYKNCYNOVDFIGL-RBUKOAKNSA-N 2 1 375.561 3.266 20 0 GGADMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)C1 ZINC000176190204 1428153824 /nfs/dbraw/zinc/15/38/24/1428153824.db2.gz TYKNCYNOVDFIGL-RBUKOAKNSA-N 2 1 375.561 3.266 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(-c2ccccc2)on1 ZINC000176202779 1428164726 /nfs/dbraw/zinc/16/47/26/1428164726.db2.gz ZVSWHKMFTPIQKH-SFHVURJKSA-N 2 1 385.512 3.221 20 0 GGADMP C[NH+](C)CCOc1ccc(CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)cc1 ZINC000176205168 1428166620 /nfs/dbraw/zinc/16/66/20/1428166620.db2.gz PMFCVFVNOMFAIL-QFIPXVFZSA-N 2 1 399.510 3.047 20 0 GGADMP C[NH+](C)CCOc1ccc(CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)cc1 ZINC000176205168 1428166631 /nfs/dbraw/zinc/16/66/31/1428166631.db2.gz PMFCVFVNOMFAIL-QFIPXVFZSA-N 2 1 399.510 3.047 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2C)cn1 ZINC000180176515 1429782144 /nfs/dbraw/zinc/78/21/44/1429782144.db2.gz OARXCHLZSTYINE-CRAIPNDOSA-N 2 1 385.512 3.311 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cnc(N3CCOCC3)s2)CC1 ZINC000180182387 1429786648 /nfs/dbraw/zinc/78/66/48/1429786648.db2.gz ZJQARPPBKYYYOF-GOSISDBHSA-N 2 1 392.613 3.456 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cnc(N3CCOCC3)s2)CC1 ZINC000180182408 1429786983 /nfs/dbraw/zinc/78/69/83/1429786983.db2.gz ZJQARPPBKYYYOF-SFHVURJKSA-N 2 1 392.613 3.456 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2C)C[C@H](C)O1 ZINC000180312385 1429833537 /nfs/dbraw/zinc/83/35/37/1429833537.db2.gz ONSWQLHDMRDKHH-INDMIFKZSA-N 2 1 383.577 3.111 20 0 GGADMP COc1ccc(C(=O)NCC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000180425252 1429865795 /nfs/dbraw/zinc/86/57/95/1429865795.db2.gz SNDQXBZSPLKWCF-INIZCTEOSA-N 2 1 378.476 3.270 20 0 GGADMP Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000180526466 1429890466 /nfs/dbraw/zinc/89/04/66/1429890466.db2.gz WEXKCHZFUQSQAE-NRFANRHFSA-N 2 1 395.551 3.076 20 0 GGADMP Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000180526466 1429890470 /nfs/dbraw/zinc/89/04/70/1429890470.db2.gz WEXKCHZFUQSQAE-NRFANRHFSA-N 2 1 395.551 3.076 20 0 GGADMP CCOc1cccc([C@@H](C)NCC(=O)Nc2ccc(CN3CCOCC3)cc2)c1 ZINC000180693743 1429981640 /nfs/dbraw/zinc/98/16/40/1429981640.db2.gz FAQXOCTZYOFOCG-GOSISDBHSA-N 2 1 397.519 3.207 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+]([C@@H]2CC(=O)N(c3ccccc3F)C2=O)CC1 ZINC000180725849 1430002464 /nfs/dbraw/zinc/00/24/64/1430002464.db2.gz COWNIZMVCKYRAY-HXUWFJFHSA-N 2 1 389.515 3.292 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)N1CCC(CCC[NH+]2CCOCC2)CC1)c1ccccc1 ZINC000180749022 1430016196 /nfs/dbraw/zinc/01/61/96/1430016196.db2.gz YAZCYLLYHFNOBK-JOCHJYFZSA-N 2 1 387.568 3.030 20 0 GGADMP COC(=O)COc1c(C)cc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000180786338 1430039486 /nfs/dbraw/zinc/03/94/86/1430039486.db2.gz POBNJTJAMALTOX-CTNGQTDRSA-N 2 1 386.536 3.304 20 0 GGADMP COC(=O)COc1c(C)cc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1C ZINC000180786338 1430039495 /nfs/dbraw/zinc/03/94/95/1430039495.db2.gz POBNJTJAMALTOX-CTNGQTDRSA-N 2 1 386.536 3.304 20 0 GGADMP COC(=O)COc1c(C)cc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1C ZINC000180786338 1430039506 /nfs/dbraw/zinc/03/95/06/1430039506.db2.gz POBNJTJAMALTOX-CTNGQTDRSA-N 2 1 386.536 3.304 20 0 GGADMP CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180879807 1430085421 /nfs/dbraw/zinc/08/54/21/1430085421.db2.gz WENFADWJYNZQJL-OALUTQOASA-N 2 1 395.588 3.305 20 0 GGADMP CN(CC[N@@H+](C)Cc1cccc(NC(=O)OC(C)(C)C)c1)C1CC[NH+](C)CC1 ZINC000180951030 1430131441 /nfs/dbraw/zinc/13/14/41/1430131441.db2.gz OQGJNVDIWYLKEJ-UHFFFAOYSA-N 2 1 390.572 3.491 20 0 GGADMP CN(CC[N@@H+](C)Cc1ccc(C(=O)Nc2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC000180957630 1430135645 /nfs/dbraw/zinc/13/56/45/1430135645.db2.gz CYNWSROPDOAZSL-UHFFFAOYSA-N 2 1 394.563 3.397 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)o1 ZINC000180984507 1430152418 /nfs/dbraw/zinc/15/24/18/1430152418.db2.gz NFKUYWGRPKXDHL-HXUWFJFHSA-N 2 1 380.492 3.225 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000181048647 1430185451 /nfs/dbraw/zinc/18/54/51/1430185451.db2.gz YMMZEPQMJQIGNK-LJQANCHMSA-N 2 1 398.551 3.406 20 0 GGADMP COc1ccc([C@H](CNC(=O)C[NH2+][C@@H](C)c2cccnc2)[NH+]2CCCCC2)cc1 ZINC000181345951 1430278791 /nfs/dbraw/zinc/27/87/91/1430278791.db2.gz LWIMXGZOOAPDHM-AVRDEDQJSA-N 2 1 396.535 3.084 20 0 GGADMP COc1ccc([C@@H](CNC(=O)C[NH2+][C@@H](C)c2cccnc2)[NH+]2CCCCC2)cc1 ZINC000181345988 1430278838 /nfs/dbraw/zinc/27/88/38/1430278838.db2.gz LWIMXGZOOAPDHM-PGRDOPGGSA-N 2 1 396.535 3.084 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cnn(Cc2ccccc2)c1 ZINC000181409949 1430290893 /nfs/dbraw/zinc/29/08/93/1430290893.db2.gz FQULUJVGVVFZEL-TZYHBYERSA-N 2 1 382.552 3.350 20 0 GGADMP C[C@H](NC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000181413969 1430292195 /nfs/dbraw/zinc/29/21/95/1430292195.db2.gz DTPOUCLTEWPRBV-NMNUPHIUSA-N 2 1 389.584 3.046 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)C[NH2+][C@@H](C)c2cccc(O)c2)CC1 ZINC000181489102 1430309469 /nfs/dbraw/zinc/30/94/69/1430309469.db2.gz FZGYDUMZNCCIJZ-IBGZPJMESA-N 2 1 381.520 3.086 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH2+][C@@H](C)c2cccc(O)c2)CC1 ZINC000181489102 1430309472 /nfs/dbraw/zinc/30/94/72/1430309472.db2.gz FZGYDUMZNCCIJZ-IBGZPJMESA-N 2 1 381.520 3.086 20 0 GGADMP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000181494863 1430310280 /nfs/dbraw/zinc/31/02/80/1430310280.db2.gz WSUFGIRFUFAOSK-FQEVSTJZSA-N 2 1 399.539 3.225 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c(OC)c1 ZINC000181518472 1430314076 /nfs/dbraw/zinc/31/40/76/1430314076.db2.gz HKNCVUGNSMDVBV-ZWKOTPCHSA-N 2 1 391.556 3.379 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c(OC)c1 ZINC000181518497 1430314207 /nfs/dbraw/zinc/31/42/07/1430314207.db2.gz HKNCVUGNSMDVBV-ROUUACIJSA-N 2 1 391.556 3.379 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000181525687 1430315213 /nfs/dbraw/zinc/31/52/13/1430315213.db2.gz MJBSHSNZKIATHC-SUMWQHHRSA-N 2 1 380.414 3.385 20 0 GGADMP CCC[NH+]1CCN(c2ccc(NC(=O)N3CCC[N@@H+](C)CC3)cc2Cl)CC1 ZINC000181535638 1430316946 /nfs/dbraw/zinc/31/69/46/1430316946.db2.gz CVALIUDFUORHKT-UHFFFAOYSA-N 2 1 393.963 3.041 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)cc1 ZINC000181593829 1430325004 /nfs/dbraw/zinc/32/50/04/1430325004.db2.gz SDHCARBFXBAAQW-HXUWFJFHSA-N 2 1 376.545 3.211 20 0 GGADMP CCO[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)C12CCCC2 ZINC000181726406 1430348626 /nfs/dbraw/zinc/34/86/26/1430348626.db2.gz IUORWBNAALIMBA-BHDDXSALSA-N 2 1 399.579 3.211 20 0 GGADMP CC(C)(C[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1 ZINC000181782279 1430359140 /nfs/dbraw/zinc/35/91/40/1430359140.db2.gz NHDANPLSBZCXJL-NRFANRHFSA-N 2 1 379.548 3.451 20 0 GGADMP O[C@@H](COc1ccccc1C(F)(F)F)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000181916621 1430382939 /nfs/dbraw/zinc/38/29/39/1430382939.db2.gz ODDSAYODEDGUBO-IAGOWNOFSA-N 2 1 386.458 3.253 20 0 GGADMP O[C@@H](COc1ccccc1C(F)(F)F)C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000181916621 1430382943 /nfs/dbraw/zinc/38/29/43/1430382943.db2.gz ODDSAYODEDGUBO-IAGOWNOFSA-N 2 1 386.458 3.253 20 0 GGADMP CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1 ZINC000181972157 1430390323 /nfs/dbraw/zinc/39/03/23/1430390323.db2.gz NKFVMYXNGFVPHG-GOSISDBHSA-N 2 1 380.536 3.243 20 0 GGADMP COc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1OC ZINC000182258847 1430438772 /nfs/dbraw/zinc/43/87/72/1430438772.db2.gz SXIPFLQPDNZNDH-XLIONFOSSA-N 2 1 384.520 3.430 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000182265910 1430439783 /nfs/dbraw/zinc/43/97/83/1430439783.db2.gz ASBNTNXPIKKESZ-XXBNENTESA-N 3 1 397.563 3.044 20 0 GGADMP COc1cccc(C[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)C2CC2)c1 ZINC000182267381 1430440140 /nfs/dbraw/zinc/44/01/40/1430440140.db2.gz VTMKPQORWPKLGR-LADGPHEKSA-N 2 1 380.532 3.373 20 0 GGADMP CC[C@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)[C@H]1CCCO1 ZINC000182271568 1430440644 /nfs/dbraw/zinc/44/06/44/1430440644.db2.gz MFUZYUMLCMTTRT-SLFFLAALSA-N 2 1 393.959 3.140 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000182273516 1430441110 /nfs/dbraw/zinc/44/11/10/1430441110.db2.gz FABYBWMPPPVITK-CVDCTZTESA-N 3 1 397.563 3.044 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21)c1ccsc1 ZINC000182329595 1430449524 /nfs/dbraw/zinc/44/95/24/1430449524.db2.gz RNKXBYHXUOCHRZ-YTQUADARSA-N 2 1 378.586 3.257 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21)Cc1ccccc1 ZINC000182330880 1430449689 /nfs/dbraw/zinc/44/96/89/1430449689.db2.gz ZYMUIODBPBGPLV-FKBYEOEOSA-N 2 1 386.584 3.065 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccnn1-c1ccccc1C ZINC000182391269 1430458086 /nfs/dbraw/zinc/45/80/86/1430458086.db2.gz RRVCNMXKIJKLDJ-LJQANCHMSA-N 2 1 398.555 3.061 20 0 GGADMP C[C@H](NC(=O)NCCC[N@H+]1CCc2ccccc2C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182401825 1430460657 /nfs/dbraw/zinc/46/06/57/1430460657.db2.gz QDWXSJOPDGNYOC-FPOVZHCZSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+]1CCc2ccccc2C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182401825 1430460660 /nfs/dbraw/zinc/46/06/60/1430460660.db2.gz QDWXSJOPDGNYOC-FPOVZHCZSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+]1CCc2ccccc2C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182401825 1430460664 /nfs/dbraw/zinc/46/06/64/1430460664.db2.gz QDWXSJOPDGNYOC-FPOVZHCZSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@@H](NC(=O)NCCC[N@H+]1CCc2ccccc2C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182401842 1430460730 /nfs/dbraw/zinc/46/07/30/1430460730.db2.gz QDWXSJOPDGNYOC-CTNGQTDRSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+]1CCc2ccccc2C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182401842 1430460731 /nfs/dbraw/zinc/46/07/31/1430460731.db2.gz QDWXSJOPDGNYOC-CTNGQTDRSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)[NH+]1CCc2ccccc2C1 ZINC000182471464 1430473573 /nfs/dbraw/zinc/47/35/73/1430473573.db2.gz NCYSACUVMIKOTD-SVFBPWRDSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000182471464 1430473574 /nfs/dbraw/zinc/47/35/74/1430473574.db2.gz NCYSACUVMIKOTD-SVFBPWRDSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000182471464 1430473577 /nfs/dbraw/zinc/47/35/77/1430473577.db2.gz NCYSACUVMIKOTD-SVFBPWRDSA-N 2 1 398.595 3.385 20 0 GGADMP CC[C@H]([NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)c1c(C)noc1C ZINC000182509457 1430480377 /nfs/dbraw/zinc/48/03/77/1430480377.db2.gz VHHNJAPEGAOXPC-NRFANRHFSA-N 2 1 398.551 3.421 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000182534668 1430485375 /nfs/dbraw/zinc/48/53/75/1430485375.db2.gz IUVAVILXLFFPFL-NLWGTHIKSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000182534668 1430485377 /nfs/dbraw/zinc/48/53/77/1430485377.db2.gz IUVAVILXLFFPFL-NLWGTHIKSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000182534668 1430485381 /nfs/dbraw/zinc/48/53/81/1430485381.db2.gz IUVAVILXLFFPFL-NLWGTHIKSA-N 2 1 390.597 3.086 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000182554080 1430490539 /nfs/dbraw/zinc/49/05/39/1430490539.db2.gz PYYVIVZDRYPLKI-YVWKXTFCSA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000182554080 1430490543 /nfs/dbraw/zinc/49/05/43/1430490543.db2.gz PYYVIVZDRYPLKI-YVWKXTFCSA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000182554080 1430490547 /nfs/dbraw/zinc/49/05/47/1430490547.db2.gz PYYVIVZDRYPLKI-YVWKXTFCSA-N 2 1 378.944 3.337 20 0 GGADMP C[C@@H](NC(=O)NCC[N@@H+]1CCc2sccc2C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182555043 1430491173 /nfs/dbraw/zinc/49/11/73/1430491173.db2.gz AMGGUULHLBAFRA-IAGOWNOFSA-N 2 1 390.597 3.058 20 0 GGADMP C[C@@H](NC(=O)NCC[N@H+]1CCc2sccc2C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182555043 1430491175 /nfs/dbraw/zinc/49/11/75/1430491175.db2.gz AMGGUULHLBAFRA-IAGOWNOFSA-N 2 1 390.597 3.058 20 0 GGADMP C[C@@H](NC(=O)NCC[NH+]1CCc2sccc2C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182555043 1430491176 /nfs/dbraw/zinc/49/11/76/1430491176.db2.gz AMGGUULHLBAFRA-IAGOWNOFSA-N 2 1 390.597 3.058 20 0 GGADMP C[C@@H](NC(=O)NCC[NH+]1CCc2sccc2C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182555043 1430491177 /nfs/dbraw/zinc/49/11/77/1430491177.db2.gz AMGGUULHLBAFRA-IAGOWNOFSA-N 2 1 390.597 3.058 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCC[NH+]2CCC(O)CC2)cc1C[NH+]1CCCCC1 ZINC000182568453 1430494158 /nfs/dbraw/zinc/49/41/58/1430494158.db2.gz CQVZJFASTBIRQA-LJQANCHMSA-N 3 1 389.584 3.179 20 0 GGADMP C[C@H](CCNC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)[NH+]1CCCCC1 ZINC000182673067 1430514557 /nfs/dbraw/zinc/51/45/57/1430514557.db2.gz HDWHROCJDFRWIC-LJQANCHMSA-N 2 1 390.547 3.308 20 0 GGADMP C[C@H](CCNC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)[NH+]1CCCCC1 ZINC000182673067 1430514560 /nfs/dbraw/zinc/51/45/60/1430514560.db2.gz HDWHROCJDFRWIC-LJQANCHMSA-N 2 1 390.547 3.308 20 0 GGADMP C[C@H](NC(=O)NCC[N@@H+](C)Cc1ccc(F)cc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182689865 1430517942 /nfs/dbraw/zinc/51/79/42/1430517942.db2.gz GIRVAHAKTUDLJP-HKUYNNGSSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@H](NC(=O)NCC[NH+](C)Cc1ccc(F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182689865 1430517947 /nfs/dbraw/zinc/51/79/47/1430517947.db2.gz GIRVAHAKTUDLJP-HKUYNNGSSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@H](NC(=O)NCC[NH+](C)Cc1ccc(F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182689865 1430517952 /nfs/dbraw/zinc/51/79/52/1430517952.db2.gz GIRVAHAKTUDLJP-HKUYNNGSSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@H](NC(=O)NC1CC[NH+](C2CCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182690258 1430518004 /nfs/dbraw/zinc/51/80/04/1430518004.db2.gz FKOJFQJVKCJZTA-ROUUACIJSA-N 2 1 376.589 3.346 20 0 GGADMP C[C@@H](NC(=O)N1CCC[N@H+](C2CCCC2)CC1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182835897 1430550528 /nfs/dbraw/zinc/55/05/28/1430550528.db2.gz TXOQEVWJNNZXGP-MOPGFXCFSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H](NC(=O)N1CCC[NH+](C2CCCC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182835897 1430550530 /nfs/dbraw/zinc/55/05/30/1430550530.db2.gz TXOQEVWJNNZXGP-MOPGFXCFSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H](NC(=O)N1CCC[NH+](C2CCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182835897 1430550532 /nfs/dbraw/zinc/55/05/32/1430550532.db2.gz TXOQEVWJNNZXGP-MOPGFXCFSA-N 2 1 376.589 3.299 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000182837076 1430550719 /nfs/dbraw/zinc/55/07/19/1430550719.db2.gz KDHCRVOVNWOKNN-IFMALSPDSA-N 2 1 398.595 3.475 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)CC1 ZINC000182837076 1430550720 /nfs/dbraw/zinc/55/07/20/1430550720.db2.gz KDHCRVOVNWOKNN-IFMALSPDSA-N 2 1 398.595 3.475 20 0 GGADMP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCCC[C@@H]3S(C)(=O)=O)c2)CC1 ZINC000182841088 1430551497 /nfs/dbraw/zinc/55/14/97/1430551497.db2.gz MBWFIKPUKMCEJN-SFTDATJTSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182925441 1430573333 /nfs/dbraw/zinc/57/33/33/1430573333.db2.gz BKKJYRKKZQBYKF-JZJXAQOMSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182925441 1430573337 /nfs/dbraw/zinc/57/33/37/1430573337.db2.gz BKKJYRKKZQBYKF-JZJXAQOMSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182925441 1430573339 /nfs/dbraw/zinc/57/33/39/1430573339.db2.gz BKKJYRKKZQBYKF-JZJXAQOMSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)CC1 ZINC000182951335 1430579297 /nfs/dbraw/zinc/57/92/97/1430579297.db2.gz UUCMURUJYKVNOL-UZKOGDIHSA-N 2 1 384.568 3.338 20 0 GGADMP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+]CCc4nnc5n4CCCCC5)[C@@H]3C2)cc1 ZINC000183127380 1430622293 /nfs/dbraw/zinc/62/22/93/1430622293.db2.gz JYJQVRSHHWSGPY-BDTNDASRSA-N 2 1 393.579 3.437 20 0 GGADMP CNC(=O)c1cccc(CC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000183145141 1430628358 /nfs/dbraw/zinc/62/83/58/1430628358.db2.gz BEJUDJGXKRTVJJ-KMDXXIMOSA-N 2 1 391.559 3.479 20 0 GGADMP CC(C)(C)S(=O)(=O)CC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000183151086 1430630209 /nfs/dbraw/zinc/63/02/09/1430630209.db2.gz KQXKHXUEZVZUAB-SLFFLAALSA-N 2 1 378.582 3.090 20 0 GGADMP CC(C)(C)S(=O)(=O)CC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000183151086 1430630212 /nfs/dbraw/zinc/63/02/12/1430630212.db2.gz KQXKHXUEZVZUAB-SLFFLAALSA-N 2 1 378.582 3.090 20 0 GGADMP COc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000183184537 1430642218 /nfs/dbraw/zinc/64/22/18/1430642218.db2.gz OYNNFVDVHWSWKE-LZLYRXPVSA-N 2 1 394.581 3.402 20 0 GGADMP COc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000183184537 1430642224 /nfs/dbraw/zinc/64/22/24/1430642224.db2.gz OYNNFVDVHWSWKE-LZLYRXPVSA-N 2 1 394.581 3.402 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183197614 1430645392 /nfs/dbraw/zinc/64/53/92/1430645392.db2.gz DRYPZUBVQCTVNF-YQVWRLOYSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183197614 1430645398 /nfs/dbraw/zinc/64/53/98/1430645398.db2.gz DRYPZUBVQCTVNF-YQVWRLOYSA-N 2 1 393.597 3.241 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+]([C@@H](C)CCc3cccc(F)c3)CC2)CC1 ZINC000183270342 1430665751 /nfs/dbraw/zinc/66/57/51/1430665751.db2.gz SRDNLANWQVCQSM-IBGZPJMESA-N 2 1 389.559 3.413 20 0 GGADMP CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000183504528 1430730323 /nfs/dbraw/zinc/73/03/23/1430730323.db2.gz VYQXIZNJCCTOCM-XJKSGUPXSA-N 2 1 395.569 3.190 20 0 GGADMP C[C@H](CCNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)[NH+]1CCCCC1 ZINC000183677852 1430770167 /nfs/dbraw/zinc/77/01/67/1430770167.db2.gz WGZATYWKVRREQX-MOPGFXCFSA-N 2 1 388.556 3.466 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccc3c(c2)OCCO3)cc1 ZINC000183681403 1430770971 /nfs/dbraw/zinc/77/09/71/1430770971.db2.gz LTFSMGLZLWJMJD-OAHLLOKOSA-N 2 1 392.459 3.241 20 0 GGADMP C[NH+](C)CC1(CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)CCCC1 ZINC000183979218 1430822415 /nfs/dbraw/zinc/82/24/15/1430822415.db2.gz HYFHNXARQSNZMY-UHFFFAOYSA-N 2 1 390.597 3.479 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NCC2(C[NH+](C)C)CCCC2)cc1)[NH+]1CCOCC1 ZINC000184014731 1430829322 /nfs/dbraw/zinc/82/93/22/1430829322.db2.gz HAMTZANXCNHHJW-SFHVURJKSA-N 2 1 388.556 3.323 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC(C)(C)CC[NH+]2CCN(C)CC2)cc1)C(C)C ZINC000184197727 1430854866 /nfs/dbraw/zinc/85/48/66/1430854866.db2.gz YJLZYFUJZXDUIL-UHFFFAOYSA-N 2 1 388.600 3.063 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)NC(C)(C)CCN2CC[NH+](C)CC2)cc1)C(C)C ZINC000184197727 1430854871 /nfs/dbraw/zinc/85/48/71/1430854871.db2.gz YJLZYFUJZXDUIL-UHFFFAOYSA-N 2 1 388.600 3.063 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC(C)(C)CCN2CC[NH+](C)CC2)cc1)C(C)C ZINC000184197727 1430854872 /nfs/dbraw/zinc/85/48/72/1430854872.db2.gz YJLZYFUJZXDUIL-UHFFFAOYSA-N 2 1 388.600 3.063 20 0 GGADMP CC[C@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1nc(C)cs1 ZINC000184341510 1430875252 /nfs/dbraw/zinc/87/52/52/1430875252.db2.gz YNGMKZMJHDKEFY-IBGZPJMESA-N 2 1 386.565 3.404 20 0 GGADMP COc1ccccc1S(=O)(=O)CCC[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000184405359 1430884022 /nfs/dbraw/zinc/88/40/22/1430884022.db2.gz PHDBSGMEJXMNQV-MSOLQXFVSA-N 2 1 394.581 3.102 20 0 GGADMP COc1ccccc1S(=O)(=O)CCC[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000184405359 1430884024 /nfs/dbraw/zinc/88/40/24/1430884024.db2.gz PHDBSGMEJXMNQV-MSOLQXFVSA-N 2 1 394.581 3.102 20 0 GGADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000184502515 1430895881 /nfs/dbraw/zinc/89/58/81/1430895881.db2.gz LVCCRPWOVWLTII-ZWKOTPCHSA-N 2 1 379.570 3.142 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000184553431 1430903344 /nfs/dbraw/zinc/90/33/44/1430903344.db2.gz LNGRUKOGRFAZFZ-QFIPXVFZSA-N 2 1 386.584 3.317 20 0 GGADMP COc1cccc(NC(=O)C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000184740701 1430960870 /nfs/dbraw/zinc/96/08/70/1430960870.db2.gz WCEYEYKWQGCKQC-QZTJIDSGSA-N 2 1 381.520 3.380 20 0 GGADMP Cc1ccc(CNC(=O)C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000184741992 1430961536 /nfs/dbraw/zinc/96/15/36/1430961536.db2.gz LAVIAFKUPLIMEX-WOJBJXKFSA-N 2 1 379.548 3.357 20 0 GGADMP COc1ccccc1CNC(=O)C[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000184749474 1430964809 /nfs/dbraw/zinc/96/48/09/1430964809.db2.gz SXJYUNPGOQCBMI-OALUTQOASA-N 2 1 395.547 3.058 20 0 GGADMP COc1ccc(NC(=O)C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000184751490 1430965607 /nfs/dbraw/zinc/96/56/07/1430965607.db2.gz JYGSUSNTIFIUIK-QZTJIDSGSA-N 2 1 381.520 3.380 20 0 GGADMP Cc1cccc(CNC(=O)C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000184752883 1430966133 /nfs/dbraw/zinc/96/61/33/1430966133.db2.gz NKUHECCRIWCFDE-PMACEKPBSA-N 2 1 379.548 3.357 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1cccc(N2CC[NH+](CC)CC2)c1 ZINC000184885780 1431012582 /nfs/dbraw/zinc/01/25/82/1431012582.db2.gz HWUWQVADAHARGV-HXUWFJFHSA-N 2 1 387.572 3.215 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC[C@H](C)[NH+]2CCCCC2)cc1F ZINC000184960300 1431031144 /nfs/dbraw/zinc/03/11/44/1431031144.db2.gz QXBLWVNVDFINIX-INIZCTEOSA-N 2 1 387.503 3.384 20 0 GGADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000185082582 1431056587 /nfs/dbraw/zinc/05/65/87/1431056587.db2.gz SNHDWPPRSVHHIX-RBBKRZOGSA-N 2 1 379.552 3.278 20 0 GGADMP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3c[nH+]ccc3N(C)C)CC2)c1 ZINC000185133160 1431069211 /nfs/dbraw/zinc/06/92/11/1431069211.db2.gz PCERGKGHDDXOME-UHFFFAOYSA-N 3 1 381.568 3.148 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000185136351 1431070155 /nfs/dbraw/zinc/07/01/55/1431070155.db2.gz HOXHTAKZVZQFED-IBGZPJMESA-N 2 1 378.948 3.213 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC1(C[NH+](C)C)CCCC1 ZINC000185170507 1431077043 /nfs/dbraw/zinc/07/70/43/1431077043.db2.gz WOVJWLURSMQFNW-NRFANRHFSA-N 2 1 386.584 3.272 20 0 GGADMP CC[C@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1cc(Br)ccc1O ZINC000185210468 1431085860 /nfs/dbraw/zinc/08/58/60/1431085860.db2.gz QVMRJEKZDIYCHS-KRWDZBQOSA-N 2 1 384.362 3.223 20 0 GGADMP Cc1cnc([C@@H]([NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C2CC2)s1 ZINC000185274614 1431097902 /nfs/dbraw/zinc/09/79/02/1431097902.db2.gz FHYXXUOZOIWZDS-NRFANRHFSA-N 2 1 398.576 3.404 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000185309766 1431108929 /nfs/dbraw/zinc/10/89/29/1431108929.db2.gz AGOVUPLAEOIOGX-UTKZUKDTSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000185309766 1431108946 /nfs/dbraw/zinc/10/89/46/1431108946.db2.gz AGOVUPLAEOIOGX-UTKZUKDTSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)nc(C)[nH+]1 ZINC000185318544 1431112186 /nfs/dbraw/zinc/11/21/86/1431112186.db2.gz AQJJLTRFMQQXKA-UHFFFAOYSA-N 2 1 375.860 3.414 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)[NH+](C)C ZINC000185661662 1431199281 /nfs/dbraw/zinc/19/92/81/1431199281.db2.gz IIZUCSINHWSMHC-QGZVFWFLSA-N 2 1 386.462 3.044 20 0 GGADMP CCOC(=O)c1ccc(NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185669579 1431201336 /nfs/dbraw/zinc/20/13/36/1431201336.db2.gz UFJRBYGGHAXBJE-FUHWJXTLSA-N 2 1 387.524 3.044 20 0 GGADMP CCOC(=O)c1ccc(NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185669579 1431201341 /nfs/dbraw/zinc/20/13/41/1431201341.db2.gz UFJRBYGGHAXBJE-FUHWJXTLSA-N 2 1 387.524 3.044 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000185677415 1431203510 /nfs/dbraw/zinc/20/35/10/1431203510.db2.gz YCZJAZLPVJNQJP-ULQDDVLXSA-N 2 1 387.524 3.027 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000185677415 1431203512 /nfs/dbraw/zinc/20/35/12/1431203512.db2.gz YCZJAZLPVJNQJP-ULQDDVLXSA-N 2 1 387.524 3.027 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NCCc1c[nH]c2ccccc12)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185680168 1431203926 /nfs/dbraw/zinc/20/39/26/1431203926.db2.gz OYENDEQUBMLSLI-HBFSDRIKSA-N 2 1 396.579 3.458 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NCCc1c[nH]c2ccccc12)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185680168 1431203934 /nfs/dbraw/zinc/20/39/34/1431203934.db2.gz OYENDEQUBMLSLI-HBFSDRIKSA-N 2 1 396.579 3.458 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000185680112 1431203952 /nfs/dbraw/zinc/20/39/52/1431203952.db2.gz OYENDEQUBMLSLI-CMKODMSKSA-N 2 1 396.579 3.458 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000185680112 1431203956 /nfs/dbraw/zinc/20/39/56/1431203956.db2.gz OYENDEQUBMLSLI-CMKODMSKSA-N 2 1 396.579 3.458 20 0 GGADMP COc1ccc(Cl)cc1CNC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185683510 1431205027 /nfs/dbraw/zinc/20/50/27/1431205027.db2.gz OVVBUGQOOWJRDI-JKSUJKDBSA-N 2 1 393.959 3.207 20 0 GGADMP COc1ccc(Cl)cc1CNC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185683510 1431205030 /nfs/dbraw/zinc/20/50/30/1431205030.db2.gz OVVBUGQOOWJRDI-JKSUJKDBSA-N 2 1 393.959 3.207 20 0 GGADMP CCN(Cc1cccc(F)c1)C(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185688830 1431206470 /nfs/dbraw/zinc/20/64/70/1431206470.db2.gz PQHZZCFKMMWDFG-HKUYNNGSSA-N 2 1 375.532 3.417 20 0 GGADMP CCN(Cc1cccc(F)c1)C(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185688830 1431206473 /nfs/dbraw/zinc/20/64/73/1431206473.db2.gz PQHZZCFKMMWDFG-HKUYNNGSSA-N 2 1 375.532 3.417 20 0 GGADMP COc1ccc2c(c1)CCCN2C(=O)C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185689481 1431206679 /nfs/dbraw/zinc/20/66/79/1431206679.db2.gz VNCZXYPTDNETJF-MJGOQNOKSA-N 2 1 385.552 3.217 20 0 GGADMP COc1ccc2c(c1)CCCN2C(=O)C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185689481 1431206683 /nfs/dbraw/zinc/20/66/83/1431206683.db2.gz VNCZXYPTDNETJF-MJGOQNOKSA-N 2 1 385.552 3.217 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000185697994 1431209240 /nfs/dbraw/zinc/20/92/40/1431209240.db2.gz XIVPWUFMATXLRU-ROUUACIJSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC000185697994 1431209244 /nfs/dbraw/zinc/20/92/44/1431209244.db2.gz XIVPWUFMATXLRU-ROUUACIJSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000185697977 1431209374 /nfs/dbraw/zinc/20/93/74/1431209374.db2.gz XIVPWUFMATXLRU-QZTJIDSGSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC000185697977 1431209376 /nfs/dbraw/zinc/20/93/76/1431209376.db2.gz XIVPWUFMATXLRU-QZTJIDSGSA-N 2 1 386.540 3.194 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N(C)Cc1cccc(F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185704294 1431211163 /nfs/dbraw/zinc/21/11/63/1431211163.db2.gz NSJZFVXDGYUWLT-AOIWGVFYSA-N 2 1 375.532 3.415 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N(C)Cc1cccc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185704294 1431211166 /nfs/dbraw/zinc/21/11/66/1431211166.db2.gz NSJZFVXDGYUWLT-AOIWGVFYSA-N 2 1 375.532 3.415 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185707915 1431211879 /nfs/dbraw/zinc/21/18/79/1431211879.db2.gz HQOMYDICJQFICE-KGLIPLIRSA-N 2 1 395.450 3.189 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185707915 1431211884 /nfs/dbraw/zinc/21/18/84/1431211884.db2.gz HQOMYDICJQFICE-KGLIPLIRSA-N 2 1 395.450 3.189 20 0 GGADMP CCOCc1ccc(CNC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185726697 1431216917 /nfs/dbraw/zinc/21/69/17/1431216917.db2.gz UFYIONRVORKWJU-GHTZIAJQSA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccc(CNC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185726697 1431216927 /nfs/dbraw/zinc/21/69/27/1431216927.db2.gz UFYIONRVORKWJU-GHTZIAJQSA-N 2 1 387.568 3.082 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC000185742060 1431220717 /nfs/dbraw/zinc/22/07/17/1431220717.db2.gz UAUPUEWCEGAJFU-QZTJIDSGSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC000185742060 1431220720 /nfs/dbraw/zinc/22/07/20/1431220720.db2.gz UAUPUEWCEGAJFU-QZTJIDSGSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(S(=O)(=O)CCC[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185743997 1431221479 /nfs/dbraw/zinc/22/14/79/1431221479.db2.gz QOVSAFGHCMIUGO-RTBURBONSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1ccc(S(=O)(=O)CCC[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185743997 1431221489 /nfs/dbraw/zinc/22/14/89/1431221489.db2.gz QOVSAFGHCMIUGO-RTBURBONSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185748159 1431222718 /nfs/dbraw/zinc/22/27/18/1431222718.db2.gz SQLBZNULBPBDNJ-SLFFLAALSA-N 2 1 387.568 3.121 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185748159 1431222724 /nfs/dbraw/zinc/22/27/24/1431222724.db2.gz SQLBZNULBPBDNJ-SLFFLAALSA-N 2 1 387.568 3.121 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185752320 1431224215 /nfs/dbraw/zinc/22/42/15/1431224215.db2.gz CMQHFWFOCKSKKC-UONOGXRCSA-N 2 1 394.903 3.429 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185752320 1431224216 /nfs/dbraw/zinc/22/42/16/1431224216.db2.gz CMQHFWFOCKSKKC-UONOGXRCSA-N 2 1 394.903 3.429 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185757935 1431226784 /nfs/dbraw/zinc/22/67/84/1431226784.db2.gz PJGFVIKNHGFPPC-ULQDDVLXSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185757935 1431226789 /nfs/dbraw/zinc/22/67/89/1431226789.db2.gz PJGFVIKNHGFPPC-ULQDDVLXSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185757897 1431226908 /nfs/dbraw/zinc/22/69/08/1431226908.db2.gz PJGFVIKNHGFPPC-YESZJQIVSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185757897 1431226913 /nfs/dbraw/zinc/22/69/13/1431226913.db2.gz PJGFVIKNHGFPPC-YESZJQIVSA-N 2 1 389.540 3.273 20 0 GGADMP CCCOc1cccc(CNC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185764749 1431228609 /nfs/dbraw/zinc/22/86/09/1431228609.db2.gz VDZPCBYUKSIHCT-UYAOXDASSA-N 2 1 387.568 3.334 20 0 GGADMP CCCOc1cccc(CNC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185764749 1431228615 /nfs/dbraw/zinc/22/86/15/1431228615.db2.gz VDZPCBYUKSIHCT-UYAOXDASSA-N 2 1 387.568 3.334 20 0 GGADMP COc1ccsc1[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000186158947 1431343907 /nfs/dbraw/zinc/34/39/07/1431343907.db2.gz XUMZNSYRSKQPOT-YJBOKZPZSA-N 2 1 387.549 3.305 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H](C1CC1)[NH+](C)Cc1ccccc1 ZINC000186273077 1431368408 /nfs/dbraw/zinc/36/84/08/1431368408.db2.gz HZGYLDNJKPUPFI-FSSWDIPSSA-N 2 1 384.568 3.165 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000186273077 1431368412 /nfs/dbraw/zinc/36/84/12/1431368412.db2.gz HZGYLDNJKPUPFI-FSSWDIPSSA-N 2 1 384.568 3.165 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000186273077 1431368416 /nfs/dbraw/zinc/36/84/16/1431368416.db2.gz HZGYLDNJKPUPFI-FSSWDIPSSA-N 2 1 384.568 3.165 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)N1CCC([NH+]2CCCC2)CC1)C1CC1 ZINC000186280082 1431370635 /nfs/dbraw/zinc/37/06/35/1431370635.db2.gz XGGOYKBYAJOULO-JOCHJYFZSA-N 2 1 384.568 3.167 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000186310862 1431379028 /nfs/dbraw/zinc/37/90/28/1431379028.db2.gz SFQWBMQQJNUHED-HDICACEKSA-N 2 1 398.551 3.365 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000186310862 1431379032 /nfs/dbraw/zinc/37/90/32/1431379032.db2.gz SFQWBMQQJNUHED-HDICACEKSA-N 2 1 398.551 3.365 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O ZINC000186408154 1431405673 /nfs/dbraw/zinc/40/56/73/1431405673.db2.gz QDWCWRUKMHVRGB-KRWDZBQOSA-N 2 1 380.414 3.338 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O ZINC000186408154 1431405682 /nfs/dbraw/zinc/40/56/82/1431405682.db2.gz QDWCWRUKMHVRGB-KRWDZBQOSA-N 2 1 380.414 3.338 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC[N@@H+]1C ZINC000186467748 1431427194 /nfs/dbraw/zinc/42/71/94/1431427194.db2.gz YFCPKJZBCCPGGX-ZBFHGGJFSA-N 2 1 383.458 3.382 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC[N@H+]1C ZINC000186467748 1431427196 /nfs/dbraw/zinc/42/71/96/1431427196.db2.gz YFCPKJZBCCPGGX-ZBFHGGJFSA-N 2 1 383.458 3.382 20 0 GGADMP COc1ccc2nc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)sc2c1 ZINC000187106192 1431617552 /nfs/dbraw/zinc/61/75/52/1431617552.db2.gz JCQPMMQQDBBALL-UHFFFAOYSA-N 2 1 375.538 3.382 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000187134419 1431627052 /nfs/dbraw/zinc/62/70/52/1431627052.db2.gz JVJCNJWVLYDXCI-KDOFPFPSSA-N 2 1 398.473 3.092 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)C1CCSCC1 ZINC000187186634 1431640937 /nfs/dbraw/zinc/64/09/37/1431640937.db2.gz PMSGVHBNTZJYFB-UZLBHIALSA-N 2 1 375.582 3.005 20 0 GGADMP Cc1cc(Br)cc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)c1O ZINC000187190684 1431641816 /nfs/dbraw/zinc/64/18/16/1431641816.db2.gz OTJCATBRLTZXAE-GDBMZVCRSA-N 2 1 385.346 3.351 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CCS(=O)(=O)CC1 ZINC000187246013 1431664006 /nfs/dbraw/zinc/66/40/06/1431664006.db2.gz SRNYFSGASMKMOA-KRWDZBQOSA-N 2 1 390.549 3.215 20 0 GGADMP C[C@H](Cc1ccccc1F)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000187987475 1431833881 /nfs/dbraw/zinc/83/38/81/1431833881.db2.gz RMBXLPSOIMJHSB-UTKZUKDTSA-N 2 1 383.511 3.244 20 0 GGADMP CCn1nccc1N1CCC[C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)C1=O ZINC000188570770 1431896146 /nfs/dbraw/zinc/89/61/46/1431896146.db2.gz VEGIQPPRTINBLU-SXLOBPIMSA-N 2 1 387.572 3.031 20 0 GGADMP CCCN(CCC[NH+](C)C)C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000188981487 1432021465 /nfs/dbraw/zinc/02/14/65/1432021465.db2.gz OCLXVCAIKCIWSH-UHFFFAOYSA-N 2 1 375.492 3.193 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000189144755 1432051962 /nfs/dbraw/zinc/05/19/62/1432051962.db2.gz BRCOHZRLPQEZFX-ZLPCBKJTSA-N 2 1 380.492 3.025 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](Cc2nc(-c3ccccc3F)no2)CC1 ZINC000189145670 1432052078 /nfs/dbraw/zinc/05/20/78/1432052078.db2.gz PYOSFXKKSIHPID-UHFFFAOYSA-N 2 1 390.503 3.446 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2nc(-c3ccccc3F)no2)CC1 ZINC000189145670 1432052082 /nfs/dbraw/zinc/05/20/82/1432052082.db2.gz PYOSFXKKSIHPID-UHFFFAOYSA-N 2 1 390.503 3.446 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(Cl)cc3F)c2)C1 ZINC000189328961 1432087333 /nfs/dbraw/zinc/08/73/33/1432087333.db2.gz JZAIOTPRHPCZLR-SFHVURJKSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(Cl)cc3F)c2)C1 ZINC000189328961 1432087335 /nfs/dbraw/zinc/08/73/35/1432087335.db2.gz JZAIOTPRHPCZLR-SFHVURJKSA-N 2 1 389.902 3.466 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](CCOCC(F)(F)C(F)F)CC2)C[C@H](C)O1 ZINC000189519238 1432145333 /nfs/dbraw/zinc/14/53/33/1432145333.db2.gz YSWCQABGDLNMLA-GASCZTMLSA-N 2 1 384.458 3.115 20 0 GGADMP CN(CC1([NH+](C)C)CCC1)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000189754064 1432224618 /nfs/dbraw/zinc/22/46/18/1432224618.db2.gz UVTARNAVAMBGKA-KRWDZBQOSA-N 2 1 378.586 3.086 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)N(C)Cc1ccccc1 ZINC000189950554 1432287161 /nfs/dbraw/zinc/28/71/61/1432287161.db2.gz GXFJJDMHEYKUBX-PMACEKPBSA-N 2 1 379.548 3.391 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(=O)oc3cc(OC)ccc23)[C@H](C)C1 ZINC000190006884 1432303358 /nfs/dbraw/zinc/30/33/58/1432303358.db2.gz HBSWMUQLZFFHQC-UZLBHIALSA-N 2 1 388.508 3.028 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(=O)oc3cc(OC)ccc23)[C@H](C)C1 ZINC000190006884 1432303363 /nfs/dbraw/zinc/30/33/63/1432303363.db2.gz HBSWMUQLZFFHQC-UZLBHIALSA-N 2 1 388.508 3.028 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](C[C@@H]3CCC4(CCCCC4)O3)CC2)CC1 ZINC000190967111 1432539874 /nfs/dbraw/zinc/53/98/74/1432539874.db2.gz DTJVMJDFNAJOHJ-NRFANRHFSA-N 2 1 391.600 3.135 20 0 GGADMP COCCN(C)c1ccc(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)cn1 ZINC000191092069 1432565962 /nfs/dbraw/zinc/56/59/62/1432565962.db2.gz USIRZNULPQWSOL-LJQANCHMSA-N 2 1 382.552 3.479 20 0 GGADMP C[C@H](C[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000191154316 1432577409 /nfs/dbraw/zinc/57/74/09/1432577409.db2.gz KOICONFZYCSIAB-OAHLLOKOSA-N 2 1 393.457 3.141 20 0 GGADMP Cc1c([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cnn1C(C)C ZINC000191275988 1432617997 /nfs/dbraw/zinc/61/79/97/1432617997.db2.gz IBDZSJAGAVMXPS-UTKZUKDTSA-N 2 1 397.567 3.321 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cn1 ZINC000191294984 1432623930 /nfs/dbraw/zinc/62/39/30/1432623930.db2.gz KTXBQVKYPGRWOQ-SIKLNZKXSA-N 2 1 382.552 3.307 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cn1 ZINC000191294984 1432623940 /nfs/dbraw/zinc/62/39/40/1432623940.db2.gz KTXBQVKYPGRWOQ-SIKLNZKXSA-N 2 1 382.552 3.307 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cn1 ZINC000191295014 1432624019 /nfs/dbraw/zinc/62/40/19/1432624019.db2.gz KTXBQVKYPGRWOQ-UGKGYDQZSA-N 2 1 382.552 3.307 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cn1 ZINC000191295014 1432624031 /nfs/dbraw/zinc/62/40/31/1432624031.db2.gz KTXBQVKYPGRWOQ-UGKGYDQZSA-N 2 1 382.552 3.307 20 0 GGADMP COc1ccc([C@@H]2CCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)c(OC)c1 ZINC000191390697 1432648810 /nfs/dbraw/zinc/64/88/10/1432648810.db2.gz LAWVWWPSUSSFJG-NRFANRHFSA-N 2 1 375.557 3.257 20 0 GGADMP COc1ccccc1C[N@@H+](CCCN1CC[NH+](C(C)C)CC1)C[C@H]1CCCO1 ZINC000191436560 1432661895 /nfs/dbraw/zinc/66/18/95/1432661895.db2.gz GSHUWBLZENYFSU-JOCHJYFZSA-N 2 1 389.584 3.092 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)NC(=O)Nc1ccc(C)cc1C ZINC000191472948 1432668456 /nfs/dbraw/zinc/66/84/56/1432668456.db2.gz BEFLNXHPSQKFRJ-UHFFFAOYSA-N 2 1 385.512 3.123 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)NC(=O)Nc1ccc(C)cc1C ZINC000191472948 1432668461 /nfs/dbraw/zinc/66/84/61/1432668461.db2.gz BEFLNXHPSQKFRJ-UHFFFAOYSA-N 2 1 385.512 3.123 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H]1CCN(c2c(F)cccc2F)C1=O ZINC000191494430 1432672229 /nfs/dbraw/zinc/67/22/29/1432672229.db2.gz GJFFYQCZSBTMLC-QGZVFWFLSA-N 2 1 376.451 3.241 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H]1CCN(c2c(F)cccc2F)C1=O ZINC000191494430 1432672239 /nfs/dbraw/zinc/67/22/39/1432672239.db2.gz GJFFYQCZSBTMLC-QGZVFWFLSA-N 2 1 376.451 3.241 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H]1CCN(c2c(F)cccc2F)C1=O ZINC000191494447 1432672271 /nfs/dbraw/zinc/67/22/71/1432672271.db2.gz GJFFYQCZSBTMLC-KRWDZBQOSA-N 2 1 376.451 3.241 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H]1CCN(c2c(F)cccc2F)C1=O ZINC000191494447 1432672277 /nfs/dbraw/zinc/67/22/77/1432672277.db2.gz GJFFYQCZSBTMLC-KRWDZBQOSA-N 2 1 376.451 3.241 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000191509026 1432675733 /nfs/dbraw/zinc/67/57/33/1432675733.db2.gz XNJANLIABBWWDS-IEBWSBKVSA-N 2 1 384.524 3.186 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000191509026 1432675744 /nfs/dbraw/zinc/67/57/44/1432675744.db2.gz XNJANLIABBWWDS-IEBWSBKVSA-N 2 1 384.524 3.186 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)Nc1cc(OC)ccc1OC ZINC000191513545 1432676253 /nfs/dbraw/zinc/67/62/53/1432676253.db2.gz AXRRXSHGXRHTKP-INIZCTEOSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1cc(OC)ccc1OC ZINC000191513545 1432676258 /nfs/dbraw/zinc/67/62/58/1432676258.db2.gz AXRRXSHGXRHTKP-INIZCTEOSA-N 2 1 388.512 3.202 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537965 1432679846 /nfs/dbraw/zinc/67/98/46/1432679846.db2.gz KUFNDFXEFFAVKG-VWNXMTODSA-N 2 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537965 1432679849 /nfs/dbraw/zinc/67/98/49/1432679849.db2.gz KUFNDFXEFFAVKG-VWNXMTODSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537965 1432679853 /nfs/dbraw/zinc/67/98/53/1432679853.db2.gz KUFNDFXEFFAVKG-VWNXMTODSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537965 1432679857 /nfs/dbraw/zinc/67/98/57/1432679857.db2.gz KUFNDFXEFFAVKG-VWNXMTODSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537965 1432679860 /nfs/dbraw/zinc/67/98/60/1432679860.db2.gz KUFNDFXEFFAVKG-VWNXMTODSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537938 1432680084 /nfs/dbraw/zinc/68/00/84/1432680084.db2.gz KUFNDFXEFFAVKG-ISKFKSNPSA-N 2 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537938 1432680088 /nfs/dbraw/zinc/68/00/88/1432680088.db2.gz KUFNDFXEFFAVKG-ISKFKSNPSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537938 1432680092 /nfs/dbraw/zinc/68/00/92/1432680092.db2.gz KUFNDFXEFFAVKG-ISKFKSNPSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537938 1432680094 /nfs/dbraw/zinc/68/00/94/1432680094.db2.gz KUFNDFXEFFAVKG-ISKFKSNPSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000191537938 1432680096 /nfs/dbraw/zinc/68/00/96/1432680096.db2.gz KUFNDFXEFFAVKG-ISKFKSNPSA-N 3 1 386.628 3.387 20 0 GGADMP Cc1cc(-n2ccnc2)ccc1C[NH+]1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000191975960 1432772649 /nfs/dbraw/zinc/77/26/49/1432772649.db2.gz WFCQHUSHGLJDDU-OYRHEFFESA-N 2 1 381.568 3.171 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](CCSCc3ccccc3)CC2)CC1 ZINC000192583555 1432863029 /nfs/dbraw/zinc/86/30/29/1432863029.db2.gz LRNIABJYLOQPIV-UHFFFAOYSA-N 2 1 389.609 3.186 20 0 GGADMP COCC[N@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1ccc(F)cc1Cl ZINC000192736884 1432882386 /nfs/dbraw/zinc/88/23/86/1432882386.db2.gz ZYRINKHQCLLCAK-UHFFFAOYSA-N 2 1 385.955 3.344 20 0 GGADMP COCC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1ccc(F)cc1Cl ZINC000192736884 1432882388 /nfs/dbraw/zinc/88/23/88/1432882388.db2.gz ZYRINKHQCLLCAK-UHFFFAOYSA-N 2 1 385.955 3.344 20 0 GGADMP CC(C)C1CCC([NH+]2CCN(CCC[NH+]3CCN(C(C)C)CC3)CC2)CC1 ZINC000192755231 1432885211 /nfs/dbraw/zinc/88/52/11/1432885211.db2.gz FNIUSDBBRUBHAA-UHFFFAOYSA-N 2 1 378.649 3.235 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)CC1 ZINC000192759425 1432885779 /nfs/dbraw/zinc/88/57/79/1432885779.db2.gz OFDCTMKPMUBIKK-JOCHJYFZSA-N 3 1 378.649 3.379 20 0 GGADMP C[C@@H]1COCC[N@@H+]1CCN1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000192767745 1432887734 /nfs/dbraw/zinc/88/77/34/1432887734.db2.gz NRYMQNOGQCVCOJ-QGZVFWFLSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@@H]1COCC[N@H+]1CCN1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000192767745 1432887736 /nfs/dbraw/zinc/88/77/36/1432887736.db2.gz NRYMQNOGQCVCOJ-QGZVFWFLSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@@H]1COCC[NH+]1CCN1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000192767745 1432887738 /nfs/dbraw/zinc/88/77/38/1432887738.db2.gz NRYMQNOGQCVCOJ-QGZVFWFLSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@@H]1COCC[NH+]1CCN1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000192767745 1432887740 /nfs/dbraw/zinc/88/77/40/1432887740.db2.gz NRYMQNOGQCVCOJ-QGZVFWFLSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@H]1C[N@H+](CCN2CCC([NH+](C)Cc3cccc(C(F)(F)F)c3)CC2)CCO1 ZINC000192776225 1432889032 /nfs/dbraw/zinc/88/90/32/1432889032.db2.gz VIAPKOBHZRWDMS-KRWDZBQOSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@H]1C[N@@H+](CCN2CCC([NH+](C)Cc3cccc(C(F)(F)F)c3)CC2)CCO1 ZINC000192776225 1432889033 /nfs/dbraw/zinc/88/90/33/1432889033.db2.gz VIAPKOBHZRWDMS-KRWDZBQOSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@H]1C[NH+](CCN2CCC([N@H+](C)Cc3cccc(C(F)(F)F)c3)CC2)CCO1 ZINC000192776225 1432889034 /nfs/dbraw/zinc/88/90/34/1432889034.db2.gz VIAPKOBHZRWDMS-KRWDZBQOSA-N 2 1 399.501 3.322 20 0 GGADMP C[C@H]1C[NH+](CCN2CCC([N@@H+](C)Cc3cccc(C(F)(F)F)c3)CC2)CCO1 ZINC000192776225 1432889035 /nfs/dbraw/zinc/88/90/35/1432889035.db2.gz VIAPKOBHZRWDMS-KRWDZBQOSA-N 2 1 399.501 3.322 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)C2CC[NH+](C3CC3)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000192792259 1432891842 /nfs/dbraw/zinc/89/18/42/1432891842.db2.gz HCSQGYIUKUSGMD-JXFKEZNVSA-N 2 1 393.934 3.463 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCCNc4ccccc43)c2)C1 ZINC000192846364 1432898370 /nfs/dbraw/zinc/89/83/70/1432898370.db2.gz ZKGFAVMMVSJWDA-NZQKXSOJSA-N 2 1 392.547 3.421 20 0 GGADMP CCOC(=O)c1oc2c(c1C)[C@H]([NH2+]C1CC[NH+](C[C@H]3CCOC3)CC1)CCC2 ZINC000192880853 1432902461 /nfs/dbraw/zinc/90/24/61/1432902461.db2.gz GQSYZMAAYKWHSD-SJLPKXTDSA-N 2 1 390.524 3.233 20 0 GGADMP COC(=O)[C@H](C)Oc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192929926 1432909530 /nfs/dbraw/zinc/90/95/30/1432909530.db2.gz IFDITCBEDLHOOS-RXVVDRJESA-N 2 1 382.504 3.239 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)NC(=O)OC(C)(C)C ZINC000192953478 1432912528 /nfs/dbraw/zinc/91/25/28/1432912528.db2.gz NFKJFAKMYXDRQJ-MRXNPFEDSA-N 2 1 379.520 3.335 20 0 GGADMP C[C@H](CNC(=O)NC[C@H](c1ccccc1)[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000192959295 1432913440 /nfs/dbraw/zinc/91/34/40/1432913440.db2.gz QVZACBIFDAEVLT-VQIMIIECSA-N 2 1 386.565 3.097 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)CC1 ZINC000193193408 1432955124 /nfs/dbraw/zinc/95/51/24/1432955124.db2.gz ZJYOVAZQTKILJI-IBGZPJMESA-N 2 1 380.964 3.362 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000193307516 1432976875 /nfs/dbraw/zinc/97/68/75/1432976875.db2.gz RFVDZLSKPLGQDH-FQEVSTJZSA-N 2 1 386.584 3.257 20 0 GGADMP Cc1ccc(NCCCNC(=O)NCc2cccc(C[NH+]3CCCC3)c2)[nH+]c1 ZINC000193342490 1432982732 /nfs/dbraw/zinc/98/27/32/1432982732.db2.gz PNUQDPIGTCQKTO-UHFFFAOYSA-N 2 1 381.524 3.287 20 0 GGADMP CCOC1CC(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)(N2CCOCC2)C1 ZINC000193402827 1432991755 /nfs/dbraw/zinc/99/17/55/1432991755.db2.gz MOUGQFCVSBQAFR-NWLLBJEDSA-N 2 1 398.551 3.101 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)CC1 ZINC000193461123 1433003317 /nfs/dbraw/zinc/00/33/17/1433003317.db2.gz DHDQKPJNUXEUTA-UHFFFAOYSA-N 2 1 394.510 3.101 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000193719855 1433046850 /nfs/dbraw/zinc/04/68/50/1433046850.db2.gz PCMNNCSOIAXGII-WOJBJXKFSA-N 2 1 386.584 3.113 20 0 GGADMP O=C(NC1CC[NH+](CC2CC2)CC1)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000193762697 1433054838 /nfs/dbraw/zinc/05/48/38/1433054838.db2.gz DMMMBTYCFPUEQQ-UHFFFAOYSA-N 2 1 376.589 3.158 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000193824868 1433067652 /nfs/dbraw/zinc/06/76/52/1433067652.db2.gz BXUYCDCTXWAXQZ-GMAHTHKFSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000193824868 1433067654 /nfs/dbraw/zinc/06/76/54/1433067654.db2.gz BXUYCDCTXWAXQZ-GMAHTHKFSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CCC[NH+]1Cc1ccc(F)cc1 ZINC000193824868 1433067656 /nfs/dbraw/zinc/06/76/56/1433067656.db2.gz BXUYCDCTXWAXQZ-GMAHTHKFSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCC[NH+]1Cc1ccc(F)cc1 ZINC000193824868 1433067659 /nfs/dbraw/zinc/06/76/59/1433067659.db2.gz BXUYCDCTXWAXQZ-GMAHTHKFSA-N 2 1 395.522 3.428 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(C)c(Cl)c3)CC2)CC1 ZINC000193889614 1433078626 /nfs/dbraw/zinc/07/86/26/1433078626.db2.gz XZNUBGZMDNWJHJ-UHFFFAOYSA-N 2 1 377.960 3.415 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]CCSCc3ccccc3)c2)C1 ZINC000193907628 1433082664 /nfs/dbraw/zinc/08/26/64/1433082664.db2.gz RJRJFMOBQKQWDC-JOCHJYFZSA-N 2 1 397.588 3.407 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000193926483 1433086181 /nfs/dbraw/zinc/08/61/81/1433086181.db2.gz RXDIFRLJCQNKJU-IRLDBZIGSA-N 2 1 380.536 3.111 20 0 GGADMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193928456 1433086355 /nfs/dbraw/zinc/08/63/55/1433086355.db2.gz TYUSMPZDYXCXCP-SFTDATJTSA-N 2 1 396.535 3.238 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000194020794 1433102185 /nfs/dbraw/zinc/10/21/85/1433102185.db2.gz LFOYFOSPHLWISN-IRLDBZIGSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000194020794 1433102188 /nfs/dbraw/zinc/10/21/88/1433102188.db2.gz LFOYFOSPHLWISN-IRLDBZIGSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000194020794 1433102190 /nfs/dbraw/zinc/10/21/90/1433102190.db2.gz LFOYFOSPHLWISN-IRLDBZIGSA-N 2 1 386.584 3.320 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3[C@H]4CCO[C@H]4C34CCC4)CC2)cs1 ZINC000194036874 1433105171 /nfs/dbraw/zinc/10/51/71/1433105171.db2.gz CSXWGECDPJILAZ-MISYRCLQSA-N 2 1 375.582 3.465 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000194069685 1433111443 /nfs/dbraw/zinc/11/14/43/1433111443.db2.gz YFPLXTASMAJJRD-UGKGYDQZSA-N 2 1 398.526 3.250 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NC[C@@H](C(C)C)[NH+]3CCC(C)CC3)CC2)[nH+]c1 ZINC000194149406 1433126852 /nfs/dbraw/zinc/12/68/52/1433126852.db2.gz KHBSFCTUFQMCPN-NRFANRHFSA-N 2 1 386.584 3.479 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NC[C@H](C(C)C)[NH+]3CCC(C)CC3)CC2)[nH+]c1 ZINC000194149420 1433126901 /nfs/dbraw/zinc/12/69/01/1433126901.db2.gz KHBSFCTUFQMCPN-OAQYLSRUSA-N 2 1 386.584 3.479 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NCCCC[NH+]3C[C@H](C)C[C@@H](C)C3)CC2)[nH+]c1 ZINC000194163318 1433129147 /nfs/dbraw/zinc/12/91/47/1433129147.db2.gz JWSTWCBDABJWPW-WOJBJXKFSA-N 2 1 386.584 3.481 20 0 GGADMP O=C(NCCCCC[NH+]1CCCCC1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194188699 1433134691 /nfs/dbraw/zinc/13/46/91/1433134691.db2.gz YVFJDMBCBJUGBL-QFIPXVFZSA-N 2 1 386.584 3.464 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000194265130 1433151906 /nfs/dbraw/zinc/15/19/06/1433151906.db2.gz SLLXNPMJJQPPQC-YADHBBJMSA-N 2 1 386.584 3.176 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000194265130 1433151911 /nfs/dbraw/zinc/15/19/11/1433151911.db2.gz SLLXNPMJJQPPQC-YADHBBJMSA-N 2 1 386.584 3.176 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000194265130 1433151917 /nfs/dbraw/zinc/15/19/17/1433151917.db2.gz SLLXNPMJJQPPQC-YADHBBJMSA-N 2 1 386.584 3.176 20 0 GGADMP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3nc(-c4ccccc4)c[nH]3)cc2)CC1 ZINC000194296781 1433157468 /nfs/dbraw/zinc/15/74/68/1433157468.db2.gz PSMWCJKQCFFQHS-UHFFFAOYSA-N 2 1 376.504 3.323 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)NCCCNc2ccc(C)c[nH+]2)CC1 ZINC000194475829 1433184366 /nfs/dbraw/zinc/18/43/66/1433184366.db2.gz YDFDTTUUQAHAIQ-UHFFFAOYSA-N 2 1 375.561 3.346 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)NCCCNc2ccc(C)c[nH+]2)CC1 ZINC000194475829 1433184367 /nfs/dbraw/zinc/18/43/67/1433184367.db2.gz YDFDTTUUQAHAIQ-UHFFFAOYSA-N 2 1 375.561 3.346 20 0 GGADMP C[C@@H](C(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000194746844 1433223684 /nfs/dbraw/zinc/22/36/84/1433223684.db2.gz KHUKHDLSTZZERB-PZJWPPBQSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@@H](C(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000194746844 1433223687 /nfs/dbraw/zinc/22/36/87/1433223687.db2.gz KHUKHDLSTZZERB-PZJWPPBQSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@@H](C(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000194746844 1433223691 /nfs/dbraw/zinc/22/36/91/1433223691.db2.gz KHUKHDLSTZZERB-PZJWPPBQSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@@H](C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000194746844 1433223694 /nfs/dbraw/zinc/22/36/94/1433223694.db2.gz KHUKHDLSTZZERB-PZJWPPBQSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@H](C(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000194746860 1433223785 /nfs/dbraw/zinc/22/37/85/1433223785.db2.gz KHUKHDLSTZZERB-TZIWHRDSSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@H](C(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000194746860 1433223789 /nfs/dbraw/zinc/22/37/89/1433223789.db2.gz KHUKHDLSTZZERB-TZIWHRDSSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@H](C(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000194746860 1433223793 /nfs/dbraw/zinc/22/37/93/1433223793.db2.gz KHUKHDLSTZZERB-TZIWHRDSSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@H](C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000194746860 1433223797 /nfs/dbraw/zinc/22/37/97/1433223797.db2.gz KHUKHDLSTZZERB-TZIWHRDSSA-N 2 1 377.532 3.072 20 0 GGADMP c1c[nH]c([C@@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)c2cccnc2)n1 ZINC000195087848 1433290932 /nfs/dbraw/zinc/29/09/32/1433290932.db2.gz HHIUJJLGMZVZRH-QFIPXVFZSA-N 2 1 391.519 3.201 20 0 GGADMP COC(=O)COc1ccccc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000195132944 1433296978 /nfs/dbraw/zinc/29/69/78/1433296978.db2.gz MAJXMGLLTAWWSN-AZUAARDMSA-N 2 1 382.504 3.411 20 0 GGADMP COC(=O)COc1ccccc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195132944 1433296982 /nfs/dbraw/zinc/29/69/82/1433296982.db2.gz MAJXMGLLTAWWSN-AZUAARDMSA-N 2 1 382.504 3.411 20 0 GGADMP COC(=O)COc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000195132937 1433297148 /nfs/dbraw/zinc/29/71/48/1433297148.db2.gz MAJXMGLLTAWWSN-QUCCMNQESA-N 2 1 382.504 3.411 20 0 GGADMP COC(=O)COc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195132937 1433297151 /nfs/dbraw/zinc/29/71/51/1433297151.db2.gz MAJXMGLLTAWWSN-QUCCMNQESA-N 2 1 382.504 3.411 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195136330 1433297556 /nfs/dbraw/zinc/29/75/56/1433297556.db2.gz DTQOMZKAPRVFAQ-SFLYRZDNSA-N 2 1 378.564 3.404 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000195136962 1433297705 /nfs/dbraw/zinc/29/77/05/1433297705.db2.gz SAKUSQFROFNARG-MJGOQNOKSA-N 2 1 387.549 3.231 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000195136984 1433297801 /nfs/dbraw/zinc/29/78/01/1433297801.db2.gz SAKUSQFROFNARG-IEBWSBKVSA-N 2 1 387.549 3.231 20 0 GGADMP Cc1ccccc1CN1CCN(C(=O)CN2CCC(OC3CCCC3)CC2)CC1 ZINC000195320300 1433318579 /nfs/dbraw/zinc/31/85/79/1433318579.db2.gz YGTBOCDRDDMWBU-UHFFFAOYSA-N 2 1 399.579 3.063 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC[C@@H]2C[NH+](CC(C)C)CCO2)cc1)C(C)C ZINC000195459358 1433332483 /nfs/dbraw/zinc/33/24/83/1433332483.db2.gz MMHQDQCWONYOEU-OAQYLSRUSA-N 2 1 375.557 3.004 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)NC[C@@H]2C[N@H+](CC(C)C)CCO2)cc1)C(C)C ZINC000195459358 1433332485 /nfs/dbraw/zinc/33/24/85/1433332485.db2.gz MMHQDQCWONYOEU-OAQYLSRUSA-N 2 1 375.557 3.004 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)NC[C@@H]2C[N@@H+](CC(C)C)CCO2)cc1)C(C)C ZINC000195459358 1433332487 /nfs/dbraw/zinc/33/24/87/1433332487.db2.gz MMHQDQCWONYOEU-OAQYLSRUSA-N 2 1 375.557 3.004 20 0 GGADMP C[C@H](CNC(=O)NCc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)C[NH+]1CCCC1 ZINC000195562938 1433339506 /nfs/dbraw/zinc/33/95/06/1433339506.db2.gz JNGDKRKDVGDZLM-WOJBJXKFSA-N 2 1 386.584 3.450 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NCCC[N@@H+](C)C1CCCCC1)c1cccc(F)c1 ZINC000195601123 1433341293 /nfs/dbraw/zinc/34/12/93/1433341293.db2.gz HQHPVCWDKQOLTK-HXUWFJFHSA-N 2 1 378.536 3.382 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1CCC[NH+]1Cc1ccccc1 ZINC000215246795 1433361780 /nfs/dbraw/zinc/36/17/80/1433361780.db2.gz DRASIGYARWBYTP-PKTZIBPZSA-N 2 1 377.532 3.432 20 0 GGADMP O=C(NC[C@H]1CCC[NH+]1Cc1ccccc1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000215246795 1433361782 /nfs/dbraw/zinc/36/17/82/1433361782.db2.gz DRASIGYARWBYTP-PKTZIBPZSA-N 2 1 377.532 3.432 20 0 GGADMP O=C(NC[C@H]1CCC[NH+]1Cc1ccccc1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000215246795 1433361785 /nfs/dbraw/zinc/36/17/85/1433361785.db2.gz DRASIGYARWBYTP-PKTZIBPZSA-N 2 1 377.532 3.432 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000227379008 1433369645 /nfs/dbraw/zinc/36/96/45/1433369645.db2.gz VDWVQZYKVMACDS-UEVCKROQSA-N 2 1 392.547 3.396 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@@H](NC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000227379008 1433369647 /nfs/dbraw/zinc/36/96/47/1433369647.db2.gz VDWVQZYKVMACDS-UEVCKROQSA-N 2 1 392.547 3.396 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@@H](NC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000227379008 1433369650 /nfs/dbraw/zinc/36/96/50/1433369650.db2.gz VDWVQZYKVMACDS-UEVCKROQSA-N 2 1 392.547 3.396 20 0 GGADMP CC(C)(CNC(=O)C1(c2ccccc2)CC[NH2+]CC1)[N@H+]1CCc2ccccc2C1 ZINC000236639593 1433375044 /nfs/dbraw/zinc/37/50/44/1433375044.db2.gz SUDIZQCLCQGTCV-UHFFFAOYSA-N 2 1 391.559 3.261 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(CNC(=O)C2(c3ccccc3)CC[NH2+]CC2)c1 ZINC000236667218 1433375639 /nfs/dbraw/zinc/37/56/39/1433375639.db2.gz GYDUHAZOICTDLZ-UHFFFAOYSA-N 2 1 379.548 3.464 20 0 GGADMP CC(C)c1ccc([C@@H]([NH3+])CNC(=O)C[C@@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC000236769923 1433378001 /nfs/dbraw/zinc/37/80/01/1433378001.db2.gz ICFPXWBRHRXDAM-PKTZIBPZSA-N 2 1 395.547 3.217 20 0 GGADMP CC(C)c1ccc([C@@H]([NH3+])CNC(=O)C[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC000236769923 1433378004 /nfs/dbraw/zinc/37/80/04/1433378004.db2.gz ICFPXWBRHRXDAM-PKTZIBPZSA-N 2 1 395.547 3.217 20 0 GGADMP CC(C)c1ccc([C@@H]([NH3+])CNC(=O)C[C@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC000236770166 1433378132 /nfs/dbraw/zinc/37/81/32/1433378132.db2.gz ICFPXWBRHRXDAM-GOTSBHOMSA-N 2 1 395.547 3.217 20 0 GGADMP CC(C)c1ccc([C@@H]([NH3+])CNC(=O)C[C@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC000236770166 1433378135 /nfs/dbraw/zinc/37/81/35/1433378135.db2.gz ICFPXWBRHRXDAM-GOTSBHOMSA-N 2 1 395.547 3.217 20 0 GGADMP CCC[C@@H]([NH3+])C(=O)Nc1ccccc1C[N@@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000236788933 1433378873 /nfs/dbraw/zinc/37/88/73/1433378873.db2.gz OVOJSGLKJYVKTD-LJQANCHMSA-N 2 1 397.519 3.328 20 0 GGADMP CCC[C@@H]([NH3+])C(=O)Nc1ccccc1C[N@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000236788933 1433378876 /nfs/dbraw/zinc/37/88/76/1433378876.db2.gz OVOJSGLKJYVKTD-LJQANCHMSA-N 2 1 397.519 3.328 20 0 GGADMP CC[C@@H](CNC(=O)C1(c2ccccc2)CC[NH2+]CC1)[N@H+]1CCc2ccccc2C1 ZINC000236951048 1433383761 /nfs/dbraw/zinc/38/37/61/1433383761.db2.gz MXBWTFYDLMTEBM-QHCPKHFHSA-N 2 1 391.559 3.261 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000237011967 1433385705 /nfs/dbraw/zinc/38/57/05/1433385705.db2.gz KCUNSCGGTCLWKX-KRWDZBQOSA-N 2 1 381.586 3.241 20 0 GGADMP CC[C@@H](C)CN(C)c1ccc(F)cc1C[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000237009970 1433385775 /nfs/dbraw/zinc/38/57/75/1433385775.db2.gz JWQCNCVKZNSQMY-LJQANCHMSA-N 2 1 378.580 3.425 20 0 GGADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000237112675 1433389481 /nfs/dbraw/zinc/38/94/81/1433389481.db2.gz JWQCNCVKZNSQMY-IBGZPJMESA-N 2 1 378.580 3.425 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCCC[NH2+]2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000237117190 1433389823 /nfs/dbraw/zinc/38/98/23/1433389823.db2.gz KTIVVKVJDUFFCX-JQHSSLGASA-N 2 1 383.458 3.347 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3cccc4c3OCCO4)CC2)cs1 ZINC000237121028 1433389904 /nfs/dbraw/zinc/38/99/04/1433389904.db2.gz MUGIPRHMPIUWTF-UHFFFAOYSA-N 2 1 387.549 3.479 20 0 GGADMP C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2c(F)cccc2N2CCCC2)c1 ZINC000237178857 1433391689 /nfs/dbraw/zinc/39/16/89/1433391689.db2.gz UVLUDNLAUBBDPH-UHFFFAOYSA-N 2 1 398.526 3.007 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)[C@@H]2[NH2+]CCc3ccccc32)CC1 ZINC000237193563 1433391875 /nfs/dbraw/zinc/39/18/75/1433391875.db2.gz LOEBNIOPIOIQRM-HSZRJFAPSA-N 2 1 377.532 3.244 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)[C@@H]2Cc3ccccc3C[NH2+]2)CC1 ZINC000237193653 1433392011 /nfs/dbraw/zinc/39/20/11/1433392011.db2.gz LSJYMTNFZFXSOG-QHCPKHFHSA-N 2 1 377.532 3.072 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000237244554 1433393873 /nfs/dbraw/zinc/39/38/73/1433393873.db2.gz OPTFKUXWUNTXJW-FGTMMUONSA-N 2 1 391.556 3.379 20 0 GGADMP C[NH2+]C[C@@H](C)C(=O)Nc1ccccc1C[N@@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000237253233 1433394487 /nfs/dbraw/zinc/39/44/87/1433394487.db2.gz ZFEUFIJBHMPCRJ-MRXNPFEDSA-N 2 1 397.519 3.056 20 0 GGADMP C[NH2+]C[C@@H](C)C(=O)Nc1ccccc1C[N@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000237253233 1433394489 /nfs/dbraw/zinc/39/44/89/1433394489.db2.gz ZFEUFIJBHMPCRJ-MRXNPFEDSA-N 2 1 397.519 3.056 20 0 GGADMP COc1cccc([C@H](C)[NH+]2CCN(C(=O)CC[C@@H]([NH3+])c3ccccc3)CC2)c1 ZINC000237310499 1433396560 /nfs/dbraw/zinc/39/65/60/1433396560.db2.gz RISITLALVAAVSR-PGRDOPGGSA-N 2 1 381.520 3.381 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)[C@@H]1Cc2ccccc2C[NH2+]1 ZINC000237344105 1433398161 /nfs/dbraw/zinc/39/81/61/1433398161.db2.gz JZTDUWNJRGMRDJ-JPYJTQIMSA-N 2 1 377.532 3.392 20 0 GGADMP Cc1c(C(=O)Nc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)nnn1C1CC[NH2+]CC1 ZINC000237354953 1433398858 /nfs/dbraw/zinc/39/88/58/1433398858.db2.gz GYODPGHQMPYPRS-MRXNPFEDSA-N 2 1 396.539 3.138 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000237389890 1433400406 /nfs/dbraw/zinc/40/04/06/1433400406.db2.gz MDYZUVCAJFSLMY-INIZCTEOSA-N 2 1 395.507 3.179 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)C[C@@H]([NH3+])c2ccccc2)C[C@@H](C)O1 ZINC000237409635 1433401625 /nfs/dbraw/zinc/40/16/25/1433401625.db2.gz XPGRIGATNADOIG-JBYIUTFZSA-N 2 1 381.520 3.002 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)CC[C@@H]([NH3+])c3ccccc3)c2)CCO1 ZINC000237421663 1433402297 /nfs/dbraw/zinc/40/22/97/1433402297.db2.gz LNOVHLUUWAZFRT-XMSQKQJNSA-N 2 1 381.520 3.004 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)CC[C@@H]([NH3+])c3ccccc3)c2)CCO1 ZINC000237421663 1433402298 /nfs/dbraw/zinc/40/22/98/1433402298.db2.gz LNOVHLUUWAZFRT-XMSQKQJNSA-N 2 1 381.520 3.004 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[C@@H]([NH3+])c1ccccc1 ZINC000237427000 1433402553 /nfs/dbraw/zinc/40/25/53/1433402553.db2.gz FZQPVWHNSZEZHZ-YCRPNKLZSA-N 2 1 387.474 3.382 20 0 GGADMP C[C@H]([NH3+])[C@@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000237492964 1433406259 /nfs/dbraw/zinc/40/62/59/1433406259.db2.gz YPFYULLFKARISZ-KVSKMBFKSA-N 2 1 383.458 3.027 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)[C@@H]2Cc3ccccc3C[NH2+]2)cc1 ZINC000237528125 1433408213 /nfs/dbraw/zinc/40/82/13/1433408213.db2.gz MNKOOSGNLRIZQG-MBSDFSHPSA-N 2 1 377.532 3.392 20 0 GGADMP C[C@]1(C(=O)NC2CC[NH+](Cc3cccc(C(F)(F)F)c3)CC2)CCC[NH2+]C1 ZINC000237541778 1433408396 /nfs/dbraw/zinc/40/83/96/1433408396.db2.gz XVCWVQKOQKUBDV-IBGZPJMESA-N 2 1 383.458 3.176 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]Cc2ccc(OC[C@H]3CCCO3)cc2)C[C@H](C)O1 ZINC000237609424 1433412191 /nfs/dbraw/zinc/41/21/91/1433412191.db2.gz ZVRBATKKGCSGPL-XQBPLPMBSA-N 2 1 376.541 3.223 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CCN(C(=O)CC[C@H]([NH3+])c3ccccc3)CC2)C[C@H](C)O1 ZINC000237605498 1433412429 /nfs/dbraw/zinc/41/24/29/1433412429.db2.gz QANBHYUXEUHQPK-JQVVWYNYSA-N 2 1 387.568 3.205 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)C[C@H]([NH3+])c3ccccc3)cc2)C[C@H](C)O1 ZINC000237630842 1433413609 /nfs/dbraw/zinc/41/36/09/1433413609.db2.gz QZJRWWSFMINDJJ-SVMVAKDDSA-N 2 1 381.520 3.002 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000237631449 1433413680 /nfs/dbraw/zinc/41/36/80/1433413680.db2.gz DPVMVMJZLJENBY-ISJRUSPKSA-N 2 1 395.547 3.248 20 0 GGADMP O=C(C1CC[NH2+]CC1)N1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000237776583 1433423361 /nfs/dbraw/zinc/42/33/61/1433423361.db2.gz UNIJAMLTQISNKR-UHFFFAOYSA-N 2 1 387.524 3.198 20 0 GGADMP Cc1ccc(COc2ccc(C[NH2+]CCC[N@H+]3CCC[C@H](C(N)=O)C3)cc2)cc1 ZINC000237816519 1433425659 /nfs/dbraw/zinc/42/56/59/1433425659.db2.gz BHCXSGIPVWYTCQ-QFIPXVFZSA-N 2 1 395.547 3.251 20 0 GGADMP [NH3+][C@H]1CCCCCC[C@H]1C(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1 ZINC000237832158 1433427568 /nfs/dbraw/zinc/42/75/68/1433427568.db2.gz MDVBHOGBBHTAMW-RTWAWAEBSA-N 2 1 398.551 3.210 20 0 GGADMP [NH3+]C[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000237832841 1433427619 /nfs/dbraw/zinc/42/76/19/1433427619.db2.gz UZUCLPHVVJSISN-OALUTQOASA-N 2 1 391.437 3.138 20 0 GGADMP [NH3+][C@@H]1CCCCCC[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000237859524 1433429708 /nfs/dbraw/zinc/42/97/08/1433429708.db2.gz PUDSJKHYWJGPIW-FXAWDEMLSA-N 2 1 379.495 3.343 20 0 GGADMP [NH3+][C@@H]1CCCCCC[C@@H]1C(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1 ZINC000237882761 1433431474 /nfs/dbraw/zinc/43/14/74/1433431474.db2.gz MDVBHOGBBHTAMW-LEWJYISDSA-N 2 1 398.551 3.210 20 0 GGADMP [NH3+][C@H](CC(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1)c1ccccc1 ZINC000237889127 1433431920 /nfs/dbraw/zinc/43/19/20/1433431920.db2.gz LXVXJRFEDOFFAH-OAQYLSRUSA-N 2 1 392.503 3.002 20 0 GGADMP O=C(N1CCC[N@@H+](Cc2ccccc2)CC1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000237903870 1433433364 /nfs/dbraw/zinc/43/33/64/1433433364.db2.gz AYOKFXWWCYZCOI-UHFFFAOYSA-N 2 1 377.532 3.042 20 0 GGADMP O=C(NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1)[C@@H]1CC12CC[NH2+]CC2 ZINC000237910406 1433433634 /nfs/dbraw/zinc/43/36/34/1433433634.db2.gz MUZUGUIBEYFYOK-VQTJNVASSA-N 2 1 395.572 3.353 20 0 GGADMP O=C(NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1)[C@@H]1CC12CC[NH2+]CC2 ZINC000237910406 1433433635 /nfs/dbraw/zinc/43/36/35/1433433635.db2.gz MUZUGUIBEYFYOK-VQTJNVASSA-N 2 1 395.572 3.353 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000237951660 1433436869 /nfs/dbraw/zinc/43/68/69/1433436869.db2.gz SBIKIZPTGDXBNN-IBGZPJMESA-N 2 1 397.588 3.398 20 0 GGADMP O=C([C@H]1CC12CC[NH2+]CC2)N1CC[N@@H+](Cc2ccccc2)C2(CCCCC2)C1 ZINC000237994392 1433438443 /nfs/dbraw/zinc/43/84/43/1433438443.db2.gz YVWWOJLGXHPNPC-OAQYLSRUSA-N 2 1 381.564 3.423 20 0 GGADMP O=C([C@H]1CC12CC[NH2+]CC2)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000237994321 1433438563 /nfs/dbraw/zinc/43/85/63/1433438563.db2.gz SGMBRDCGYYWYSV-JOCHJYFZSA-N 2 1 389.543 3.310 20 0 GGADMP [NH3+]CC1(C(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CCCC1 ZINC000238040707 1433440780 /nfs/dbraw/zinc/44/07/80/1433440780.db2.gz PMQDSCJKRLOSMB-UHFFFAOYSA-N 2 1 383.458 3.259 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000245201214 1433454778 /nfs/dbraw/zinc/45/47/78/1433454778.db2.gz GKYMTZVJHCTPDV-AJYBTWMASA-N 2 1 385.552 3.352 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[NH+]1[C@H](C)CC[C@H]1C ZINC000245202134 1433454902 /nfs/dbraw/zinc/45/49/02/1433454902.db2.gz QEZUNJGSRWHRHZ-BZUAXINKSA-N 2 1 379.495 3.307 20 0 GGADMP Cc1ccc(C)c(NC(=O)[C@H](C)[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000245387020 1433456842 /nfs/dbraw/zinc/45/68/42/1433456842.db2.gz STCITNMLQCQYLH-UFYCRDLUSA-N 2 1 387.568 3.452 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000245389580 1433457524 /nfs/dbraw/zinc/45/75/24/1433457524.db2.gz IPFURKDJHMLBQS-MSOLQXFVSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000245389581 1433457723 /nfs/dbraw/zinc/45/77/23/1433457723.db2.gz IPFURKDJHMLBQS-ROUUACIJSA-N 2 1 392.613 3.380 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1F ZINC000245391634 1433458390 /nfs/dbraw/zinc/45/83/90/1433458390.db2.gz QXTVIKXYKOYGOI-CVEARBPZSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1F ZINC000245391634 1433458393 /nfs/dbraw/zinc/45/83/93/1433458393.db2.gz QXTVIKXYKOYGOI-CVEARBPZSA-N 2 1 387.503 3.239 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000245421844 1433464626 /nfs/dbraw/zinc/46/46/26/1433464626.db2.gz IFBKMLUDAIFCEG-MOPGFXCFSA-N 2 1 390.597 3.087 20 0 GGADMP CC(C)[C@H](C(=O)NC1CC[NH+](C2CCCCC2)CC1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000245424479 1433465133 /nfs/dbraw/zinc/46/51/33/1433465133.db2.gz CNPOMEDGXNQGQF-DBXWQHBBSA-N 2 1 379.589 3.034 20 0 GGADMP CC(C)[C@H]1C[N@H+]([C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CCS1 ZINC000245441199 1433468255 /nfs/dbraw/zinc/46/82/55/1433468255.db2.gz HDFANKXAOOHWAH-WIYYLYMNSA-N 2 1 389.609 3.229 20 0 GGADMP C[C@H](C(=O)N(C)Cc1ccccc1)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000245462674 1433473113 /nfs/dbraw/zinc/47/31/13/1433473113.db2.gz XBCYVFUUSDQYKQ-NFBKMPQASA-N 2 1 379.548 3.487 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1Nc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000245566991 1433486219 /nfs/dbraw/zinc/48/62/19/1433486219.db2.gz RNEGHJQYKFLIAE-WMZHIEFXSA-N 2 1 379.552 3.156 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3F)C2=O)[C@H](C)C1 ZINC000245572646 1433486850 /nfs/dbraw/zinc/48/68/50/1433486850.db2.gz COFVDUQPJGOAQC-HOJAQTOUSA-N 2 1 391.531 3.048 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3F)C2=O)[C@H](C)C1 ZINC000245572646 1433486851 /nfs/dbraw/zinc/48/68/51/1433486851.db2.gz COFVDUQPJGOAQC-HOJAQTOUSA-N 2 1 391.531 3.048 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000245586399 1433488326 /nfs/dbraw/zinc/48/83/26/1433488326.db2.gz AMFPZLOYGIKSAQ-QIJUGHKUSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000245586399 1433488329 /nfs/dbraw/zinc/48/83/29/1433488329.db2.gz AMFPZLOYGIKSAQ-QIJUGHKUSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000245586399 1433488331 /nfs/dbraw/zinc/48/83/31/1433488331.db2.gz AMFPZLOYGIKSAQ-QIJUGHKUSA-N 2 1 384.568 3.439 20 0 GGADMP CC(C)CCO[C@H](C)C(=O)N(C)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000245622249 1433491926 /nfs/dbraw/zinc/49/19/26/1433491926.db2.gz BFQXYPCZADHTOT-HMXCVIKNSA-N 2 1 381.605 3.233 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000245639975 1433494212 /nfs/dbraw/zinc/49/42/12/1433494212.db2.gz DCHVEVSJNTUGGX-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000245639975 1433494214 /nfs/dbraw/zinc/49/42/14/1433494214.db2.gz DCHVEVSJNTUGGX-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000245639975 1433494217 /nfs/dbraw/zinc/49/42/17/1433494217.db2.gz DCHVEVSJNTUGGX-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)NC[C@H]2CCC[N@@H+](C)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245653867 1433495753 /nfs/dbraw/zinc/49/57/53/1433495753.db2.gz CZIOBGYVZOSRPR-IDHHARJASA-N 2 1 396.938 3.113 20 0 GGADMP CC(C)[NH+](C)CCNC(=O)NC[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245655100 1433496224 /nfs/dbraw/zinc/49/62/24/1433496224.db2.gz DHKTZMMJHJRFQW-QAPCUYQASA-N 2 1 384.927 3.111 20 0 GGADMP CC(C)[NH+](C)CCNC(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245655100 1433496226 /nfs/dbraw/zinc/49/62/26/1433496226.db2.gz DHKTZMMJHJRFQW-QAPCUYQASA-N 2 1 384.927 3.111 20 0 GGADMP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245823188 1433522291 /nfs/dbraw/zinc/52/22/91/1433522291.db2.gz FCVUZCSVQYXOOB-FGTMMUONSA-N 2 1 386.565 3.488 20 0 GGADMP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245823188 1433522298 /nfs/dbraw/zinc/52/22/98/1433522298.db2.gz FCVUZCSVQYXOOB-FGTMMUONSA-N 2 1 386.565 3.488 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245857756 1433527353 /nfs/dbraw/zinc/52/73/53/1433527353.db2.gz KJUNIXNEFXXMOO-OALUTQOASA-N 2 1 395.551 3.302 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245857756 1433527357 /nfs/dbraw/zinc/52/73/57/1433527357.db2.gz KJUNIXNEFXXMOO-OALUTQOASA-N 2 1 395.551 3.302 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000245859027 1433528507 /nfs/dbraw/zinc/52/85/07/1433528507.db2.gz BJKZDVFHVXGWJO-ZDFPQIBNSA-N 2 1 384.568 3.308 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000245859027 1433528511 /nfs/dbraw/zinc/52/85/11/1433528511.db2.gz BJKZDVFHVXGWJO-ZDFPQIBNSA-N 2 1 384.568 3.308 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000245859027 1433528517 /nfs/dbraw/zinc/52/85/17/1433528517.db2.gz BJKZDVFHVXGWJO-ZDFPQIBNSA-N 2 1 384.568 3.308 20 0 GGADMP CCO[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)C12CCCC2 ZINC000245866943 1433530498 /nfs/dbraw/zinc/53/04/98/1433530498.db2.gz IUORWBNAALIMBA-YPAWHYETSA-N 2 1 399.579 3.211 20 0 GGADMP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C ZINC000245904715 1433539108 /nfs/dbraw/zinc/53/91/08/1433539108.db2.gz UHYJKUPLIJQTOH-JTDSTZFVSA-N 2 1 378.948 3.211 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C ZINC000245904715 1433539111 /nfs/dbraw/zinc/53/91/11/1433539111.db2.gz UHYJKUPLIJQTOH-JTDSTZFVSA-N 2 1 378.948 3.211 20 0 GGADMP C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000245943439 1433548440 /nfs/dbraw/zinc/54/84/40/1433548440.db2.gz KEVIEGDNYSIAGQ-ICSRJNTNSA-N 2 1 390.597 3.086 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)CC1 ZINC000246019479 1433558479 /nfs/dbraw/zinc/55/84/79/1433558479.db2.gz UUCMURUJYKVNOL-SYYKKAFVSA-N 2 1 384.568 3.338 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@H](C)C[NH+]3C[C@H](C)C[C@@H](C)C3)CC2)cs1 ZINC000246025737 1433559264 /nfs/dbraw/zinc/55/92/64/1433559264.db2.gz NFVXDYHZIAYQQR-BRWVUGGUSA-N 2 1 392.613 3.146 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@H](C)c1cccc(F)c1F ZINC000246056033 1433562622 /nfs/dbraw/zinc/56/26/22/1433562622.db2.gz XXEKAJWRRZKGKP-CVEARBPZSA-N 2 1 382.499 3.083 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21)Cc1ccccc1 ZINC000246071043 1433564558 /nfs/dbraw/zinc/56/45/58/1433564558.db2.gz ZYMUIODBPBGPLV-FDFHNCONSA-N 2 1 386.584 3.065 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246123498 1433571488 /nfs/dbraw/zinc/57/14/88/1433571488.db2.gz KMKIEBSNHHPUTJ-PXNSSMCTSA-N 2 1 394.519 3.297 20 0 GGADMP C[C@@H]1CN(Cc2ccccc2NC(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)C[C@@H](C)O1 ZINC000246146446 1433574480 /nfs/dbraw/zinc/57/44/80/1433574480.db2.gz LLQIJLMIDUORQG-QRVBRYPASA-N 2 1 388.556 3.101 20 0 GGADMP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000246163195 1433576764 /nfs/dbraw/zinc/57/67/64/1433576764.db2.gz KWILNNSLGCDTSG-SIKLNZKXSA-N 2 1 397.567 3.381 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000246163195 1433576767 /nfs/dbraw/zinc/57/67/67/1433576767.db2.gz KWILNNSLGCDTSG-SIKLNZKXSA-N 2 1 397.567 3.381 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc(OCC)cc2)C1 ZINC000246163590 1433576804 /nfs/dbraw/zinc/57/68/04/1433576804.db2.gz IIIZMNPSKMQUIN-KNQAVFIVSA-N 2 1 387.568 3.413 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c2ccccc2)CC1 ZINC000246174959 1433578104 /nfs/dbraw/zinc/57/81/04/1433578104.db2.gz GKHAPDNBVSOANC-CEMLEFRQSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](CC(=O)N[C@H](c3ccccc3)C3CC3)CC2)C[C@H](C)O1 ZINC000246187766 1433579810 /nfs/dbraw/zinc/57/98/10/1433579810.db2.gz IDFAIAKNKBGLIN-YDIMBITNSA-N 2 1 399.579 3.075 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CC(=O)N[C@H](c3ccccc3)C3CC3)CC2)C[C@H](C)O1 ZINC000246187766 1433579812 /nfs/dbraw/zinc/57/98/12/1433579812.db2.gz IDFAIAKNKBGLIN-YDIMBITNSA-N 2 1 399.579 3.075 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246226251 1433584079 /nfs/dbraw/zinc/58/40/79/1433584079.db2.gz BUJFUTWKIZUDRR-SBHAEUEKSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246226251 1433584080 /nfs/dbraw/zinc/58/40/80/1433584080.db2.gz BUJFUTWKIZUDRR-SBHAEUEKSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246226251 1433584081 /nfs/dbraw/zinc/58/40/81/1433584081.db2.gz BUJFUTWKIZUDRR-SBHAEUEKSA-N 2 1 376.589 3.299 20 0 GGADMP Cc1cc2ncc([C@@H](C)[NH2+]Cc3cccc(C[N@@H+]4CCO[C@@H](C)C4)c3)c(C)n2n1 ZINC000246289685 1433589939 /nfs/dbraw/zinc/58/99/39/1433589939.db2.gz CEZVATXHIMGLLW-ZWKOTPCHSA-N 2 1 393.535 3.418 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)C[C@H]1CCC[NH+](C)C1 ZINC000246288169 1433590084 /nfs/dbraw/zinc/59/00/84/1433590084.db2.gz AQEPNOXGBZKVOV-YUVXSKOASA-N 2 1 386.584 3.126 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000246288169 1433590089 /nfs/dbraw/zinc/59/00/89/1433590089.db2.gz AQEPNOXGBZKVOV-YUVXSKOASA-N 2 1 386.584 3.126 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246288169 1433590091 /nfs/dbraw/zinc/59/00/91/1433590091.db2.gz AQEPNOXGBZKVOV-YUVXSKOASA-N 2 1 386.584 3.126 20 0 GGADMP Cc1cc2ncc([C@H](C)[NH2+]Cc3cccc(C[N@@H+]4CCO[C@@H](C)C4)c3)c(C)n2n1 ZINC000246289674 1433590137 /nfs/dbraw/zinc/59/01/37/1433590137.db2.gz CEZVATXHIMGLLW-ROUUACIJSA-N 2 1 393.535 3.418 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)C[C@@H]1CCC[NH+](C)C1 ZINC000246288127 1433590257 /nfs/dbraw/zinc/59/02/57/1433590257.db2.gz AQEPNOXGBZKVOV-KIZRIRGWSA-N 2 1 386.584 3.126 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000246288127 1433590261 /nfs/dbraw/zinc/59/02/61/1433590261.db2.gz AQEPNOXGBZKVOV-KIZRIRGWSA-N 2 1 386.584 3.126 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000246288127 1433590266 /nfs/dbraw/zinc/59/02/66/1433590266.db2.gz AQEPNOXGBZKVOV-KIZRIRGWSA-N 2 1 386.584 3.126 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000246294276 1433590862 /nfs/dbraw/zinc/59/08/62/1433590862.db2.gz DMTASGVFISCNFX-KCZVDYSFSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000246294276 1433590867 /nfs/dbraw/zinc/59/08/67/1433590867.db2.gz DMTASGVFISCNFX-KCZVDYSFSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000246294276 1433590870 /nfs/dbraw/zinc/59/08/70/1433590870.db2.gz DMTASGVFISCNFX-KCZVDYSFSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000246294276 1433590874 /nfs/dbraw/zinc/59/08/74/1433590874.db2.gz DMTASGVFISCNFX-KCZVDYSFSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000246294255 1433590984 /nfs/dbraw/zinc/59/09/84/1433590984.db2.gz DMTASGVFISCNFX-JAXLGGSGSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000246294255 1433590990 /nfs/dbraw/zinc/59/09/90/1433590990.db2.gz DMTASGVFISCNFX-JAXLGGSGSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000246294255 1433590993 /nfs/dbraw/zinc/59/09/93/1433590993.db2.gz DMTASGVFISCNFX-JAXLGGSGSA-N 2 1 390.568 3.159 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000246294255 1433590997 /nfs/dbraw/zinc/59/09/97/1433590997.db2.gz DMTASGVFISCNFX-JAXLGGSGSA-N 2 1 390.568 3.159 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000246316679 1433593902 /nfs/dbraw/zinc/59/39/02/1433593902.db2.gz NUZOLTJLQHXJII-RBUKOAKNSA-N 2 1 376.545 3.180 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000246320094 1433594619 /nfs/dbraw/zinc/59/46/19/1433594619.db2.gz FKSJXDWPRNUAJX-CZAYHTPWSA-N 2 1 398.595 3.411 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cnn(Cc2ccccc2)c1 ZINC000246324832 1433595234 /nfs/dbraw/zinc/59/52/34/1433595234.db2.gz FQULUJVGVVFZEL-CDNPAEQRSA-N 2 1 382.552 3.350 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H]([NH+]2CCCC2)C1 ZINC000246364769 1433601036 /nfs/dbraw/zinc/60/10/36/1433601036.db2.gz KRFLQFYEUQIGMW-KIZRIRGWSA-N 2 1 384.568 3.023 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246364015 1433601075 /nfs/dbraw/zinc/60/10/75/1433601075.db2.gz KNEUPJHIHQLRQB-KIZRIRGWSA-N 2 1 386.584 3.126 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)N[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246364015 1433601078 /nfs/dbraw/zinc/60/10/78/1433601078.db2.gz KNEUPJHIHQLRQB-KIZRIRGWSA-N 2 1 386.584 3.126 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246364015 1433601081 /nfs/dbraw/zinc/60/10/81/1433601081.db2.gz KNEUPJHIHQLRQB-KIZRIRGWSA-N 2 1 386.584 3.126 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+]([C@@H](C(=O)N(C)C)c3ccccc3)CC2)C[C@H](C)O1 ZINC000246372214 1433602434 /nfs/dbraw/zinc/60/24/34/1433602434.db2.gz OAXCMKBXDGOBTG-XQBPLPMBSA-N 2 1 387.568 3.027 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000246393130 1433605896 /nfs/dbraw/zinc/60/58/96/1433605896.db2.gz CLQPLYGOMNDZOB-ILWGZMRPSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000246393130 1433605900 /nfs/dbraw/zinc/60/59/00/1433605900.db2.gz CLQPLYGOMNDZOB-ILWGZMRPSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000246393130 1433605903 /nfs/dbraw/zinc/60/59/03/1433605903.db2.gz CLQPLYGOMNDZOB-ILWGZMRPSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000246393112 1433605986 /nfs/dbraw/zinc/60/59/86/1433605986.db2.gz CLQPLYGOMNDZOB-BVSLBCMMSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000246393112 1433605987 /nfs/dbraw/zinc/60/59/87/1433605987.db2.gz CLQPLYGOMNDZOB-BVSLBCMMSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000246393112 1433605988 /nfs/dbraw/zinc/60/59/88/1433605988.db2.gz CLQPLYGOMNDZOB-BVSLBCMMSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246408705 1433608321 /nfs/dbraw/zinc/60/83/21/1433608321.db2.gz BKNKEWBIGMYYQJ-KUDFPVQQSA-N 2 1 391.506 3.433 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1)c1cccc(OC)c1 ZINC000246409406 1433608638 /nfs/dbraw/zinc/60/86/38/1433608638.db2.gz LQPLMDLISNSCBR-HGHGUNKESA-N 2 1 388.556 3.003 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+]([C@@H](C(=O)NC3CC3)c3ccccc3)CC2)C[C@H](C)O1 ZINC000246438505 1433612827 /nfs/dbraw/zinc/61/28/27/1433612827.db2.gz UFUDIURMNQOZJN-SELNLUPBSA-N 2 1 399.579 3.218 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)C1 ZINC000246443639 1433613638 /nfs/dbraw/zinc/61/36/38/1433613638.db2.gz DQQHFSQPUUCFAV-HLAWJBBLSA-N 2 1 395.551 3.455 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000246443639 1433613641 /nfs/dbraw/zinc/61/36/41/1433613641.db2.gz DQQHFSQPUUCFAV-HLAWJBBLSA-N 2 1 395.551 3.455 20 0 GGADMP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1 ZINC000246471893 1433617865 /nfs/dbraw/zinc/61/78/65/1433617865.db2.gz QPBVDSQNBNTYHM-TWFHAPMSSA-N 2 1 375.557 3.361 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H]2C[NH+]2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000246477401 1433618774 /nfs/dbraw/zinc/61/87/74/1433618774.db2.gz LAWZJARWWBXULQ-HJNYFJLDSA-N 2 1 384.568 3.309 20 0 GGADMP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000246488802 1433620182 /nfs/dbraw/zinc/62/01/82/1433620182.db2.gz PFCNSZWVJZPIIO-WMQCIHAUSA-N 2 1 386.540 3.170 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000246488802 1433620183 /nfs/dbraw/zinc/62/01/83/1433620183.db2.gz PFCNSZWVJZPIIO-WMQCIHAUSA-N 2 1 386.540 3.170 20 0 GGADMP COc1cc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc(OC)c1OC ZINC000246496212 1433621015 /nfs/dbraw/zinc/62/10/15/1433621015.db2.gz SGDUUIYRVZSBCZ-KFKAGJAMSA-N 2 1 392.540 3.131 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000246493733 1433621082 /nfs/dbraw/zinc/62/10/82/1433621082.db2.gz RNPIBOJEKKRZER-OALUTQOASA-N 2 1 388.556 3.179 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000246493733 1433621083 /nfs/dbraw/zinc/62/10/83/1433621083.db2.gz RNPIBOJEKKRZER-OALUTQOASA-N 2 1 388.556 3.179 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C[N@H+]1Cc1ccccc1 ZINC000246510335 1433623228 /nfs/dbraw/zinc/62/32/28/1433623228.db2.gz UAGPMPAUDJHMIR-LCKKVJLRSA-N 2 1 396.579 3.308 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C[NH+]1Cc1ccccc1 ZINC000246510335 1433623231 /nfs/dbraw/zinc/62/32/31/1433623231.db2.gz UAGPMPAUDJHMIR-LCKKVJLRSA-N 2 1 396.579 3.308 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C[NH+]1Cc1ccccc1 ZINC000246510335 1433623235 /nfs/dbraw/zinc/62/32/35/1433623235.db2.gz UAGPMPAUDJHMIR-LCKKVJLRSA-N 2 1 396.579 3.308 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000246513808 1433623850 /nfs/dbraw/zinc/62/38/50/1433623850.db2.gz NYMWLGUDMUHPIF-LVCYWYKZSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000246513808 1433623853 /nfs/dbraw/zinc/62/38/53/1433623853.db2.gz NYMWLGUDMUHPIF-LVCYWYKZSA-N 2 1 383.540 3.180 20 0 GGADMP CCCCOc1cccc(CNC(=O)CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246528872 1433625873 /nfs/dbraw/zinc/62/58/73/1433625873.db2.gz JGIRZODATIUMOL-NZQKXSOJSA-N 2 1 399.579 3.430 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)[NH+]4C)cc2)C1 ZINC000246530129 1433626253 /nfs/dbraw/zinc/62/62/53/1433626253.db2.gz XTBBCHNIGMYNJP-BWAGFHJFSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@H]1CCC[NH+](Cc2ccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)[N@@H+]4C)cc2)C1 ZINC000246530129 1433626254 /nfs/dbraw/zinc/62/62/54/1433626254.db2.gz XTBBCHNIGMYNJP-BWAGFHJFSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@H]1CCC[NH+](Cc2ccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)C1 ZINC000246530129 1433626255 /nfs/dbraw/zinc/62/62/55/1433626255.db2.gz XTBBCHNIGMYNJP-BWAGFHJFSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)[NH+]4C)cc2)C1 ZINC000246530138 1433626262 /nfs/dbraw/zinc/62/62/62/1433626262.db2.gz XTBBCHNIGMYNJP-QIJUGHKUSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)[N@@H+]4C)cc2)C1 ZINC000246530138 1433626263 /nfs/dbraw/zinc/62/62/63/1433626263.db2.gz XTBBCHNIGMYNJP-QIJUGHKUSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)C1 ZINC000246530138 1433626264 /nfs/dbraw/zinc/62/62/64/1433626264.db2.gz XTBBCHNIGMYNJP-QIJUGHKUSA-N 2 1 384.568 3.297 20 0 GGADMP CNc1cc(N2CCC[C@@H]2CNC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)ncn1 ZINC000246553442 1433630363 /nfs/dbraw/zinc/63/03/63/1433630363.db2.gz WRQKAZWPFNHKON-DFQSSKMNSA-N 3 1 386.588 3.120 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246553255 1433630418 /nfs/dbraw/zinc/63/04/18/1433630418.db2.gz WEGSIBXAGAFVFP-IRFCIJBXSA-N 2 1 387.568 3.004 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246553255 1433630421 /nfs/dbraw/zinc/63/04/21/1433630421.db2.gz WEGSIBXAGAFVFP-IRFCIJBXSA-N 2 1 387.568 3.004 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2c(F)cccc2Cl)CCO1 ZINC000246557359 1433630922 /nfs/dbraw/zinc/63/09/22/1433630922.db2.gz LOSNKHCTFFLPBH-AXVVYFOYSA-N 2 1 395.950 3.457 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2c(F)cccc2Cl)CCO1 ZINC000246557359 1433630926 /nfs/dbraw/zinc/63/09/26/1433630926.db2.gz LOSNKHCTFFLPBH-AXVVYFOYSA-N 2 1 395.950 3.457 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NCC3CC[NH+](Cc4cccs4)CC3)CC[C@H]21 ZINC000246573153 1433633103 /nfs/dbraw/zinc/63/31/03/1433633103.db2.gz BYNWJMAGDQCLIR-UYAOXDASSA-N 2 1 390.597 3.086 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NC2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000246636639 1433643550 /nfs/dbraw/zinc/64/35/50/1433643550.db2.gz CHBNLKBFRFWMNK-SFHLNBCPSA-N 2 1 386.584 3.174 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000246649220 1433644941 /nfs/dbraw/zinc/64/49/41/1433644941.db2.gz ZHOLWKXXMCKVNG-SKWRMQMOSA-N 2 1 398.595 3.270 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NCC(C)(C)[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000246676155 1433648213 /nfs/dbraw/zinc/64/82/13/1433648213.db2.gz CPSGPRWWDOHIQM-MSOLQXFVSA-N 2 1 375.561 3.303 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)C1 ZINC000246676155 1433648214 /nfs/dbraw/zinc/64/82/14/1433648214.db2.gz CPSGPRWWDOHIQM-MSOLQXFVSA-N 2 1 375.561 3.303 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1[NH2+]CCc2ccccc21 ZINC000246707428 1433653261 /nfs/dbraw/zinc/65/32/61/1433653261.db2.gz WSBXJTPZILSLPT-NZQKXSOJSA-N 2 1 377.532 3.244 20 0 GGADMP CC[C@H](NC(=O)[C@H](C)[C@@H]([NH3+])c1ccccc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246714050 1433654003 /nfs/dbraw/zinc/65/40/03/1433654003.db2.gz XCUDSJFZCZNITH-HGSOSGBHSA-N 2 1 395.547 3.118 20 0 GGADMP CC[C@H](NC(=O)[C@H](C)[C@@H]([NH3+])c1ccccc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246714050 1433654007 /nfs/dbraw/zinc/65/40/07/1433654007.db2.gz XCUDSJFZCZNITH-HGSOSGBHSA-N 2 1 395.547 3.118 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1cccs1 ZINC000246721063 1433655106 /nfs/dbraw/zinc/65/51/06/1433655106.db2.gz VCNPGDCADNWOPN-CGTJXYLNSA-N 2 1 376.570 3.009 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H](C)C[NH+]2C[C@@H](C)C[C@H](C)C2)C1 ZINC000246721069 1433655124 /nfs/dbraw/zinc/65/51/24/1433655124.db2.gz IFFQHPGEDGPKHS-INDMIFKZSA-N 2 1 375.561 3.158 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246719508 1433655143 /nfs/dbraw/zinc/65/51/43/1433655143.db2.gz UZEYEZJZCSSYAY-HDAAZOAOSA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246719508 1433655147 /nfs/dbraw/zinc/65/51/47/1433655147.db2.gz UZEYEZJZCSSYAY-HDAAZOAOSA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246719508 1433655151 /nfs/dbraw/zinc/65/51/51/1433655151.db2.gz UZEYEZJZCSSYAY-HDAAZOAOSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000246724201 1433655367 /nfs/dbraw/zinc/65/53/67/1433655367.db2.gz VKIZAQFZIFQHRJ-RTBURBONSA-N 2 1 376.545 3.084 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246760697 1433661747 /nfs/dbraw/zinc/66/17/47/1433661747.db2.gz YCPNHNYCVPBRML-JTHBVZDNSA-N 2 1 396.579 3.093 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246760697 1433661748 /nfs/dbraw/zinc/66/17/48/1433661748.db2.gz YCPNHNYCVPBRML-JTHBVZDNSA-N 2 1 396.579 3.093 20 0 GGADMP C[N@@H+](CCCNC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)Cc1ccccc1 ZINC000246781032 1433665534 /nfs/dbraw/zinc/66/55/34/1433665534.db2.gz ZHMXOXPITRXBSA-UNMCSNQZSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)Cc1ccccc1 ZINC000246781032 1433665541 /nfs/dbraw/zinc/66/55/41/1433665541.db2.gz ZHMXOXPITRXBSA-UNMCSNQZSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)Cc1ccccc1 ZINC000246781032 1433665549 /nfs/dbraw/zinc/66/55/49/1433665549.db2.gz ZHMXOXPITRXBSA-UNMCSNQZSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)CC1 ZINC000246839473 1433676850 /nfs/dbraw/zinc/67/68/50/1433676850.db2.gz KJUMTHKMNDOHMU-KAGYGMCKSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[C@@H](C[NH+]4CCCCC4)C3)cc2)C[C@@H](C)O1 ZINC000246888365 1433683287 /nfs/dbraw/zinc/68/32/87/1433683287.db2.gz HASPWAMVIYRJLH-SJBKTWHCSA-N 2 1 399.579 3.244 20 0 GGADMP O=C([C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000246900150 1433684434 /nfs/dbraw/zinc/68/44/34/1433684434.db2.gz XPXNHSZBASBEJE-LEWJYISDSA-N 2 1 387.543 3.372 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1)c1ccsc1 ZINC000247260013 1433697376 /nfs/dbraw/zinc/69/73/76/1433697376.db2.gz RPIGETCCQNBPMJ-QXAKKESOSA-N 2 1 378.586 3.257 20 0 GGADMP Cc1cccc(NC[C@H]2CC[N@H+](C[C@@H](O)COc3ccccc3Cl)C2)[nH+]1 ZINC000247279974 1433699173 /nfs/dbraw/zinc/69/91/73/1433699173.db2.gz CWPSTMGSZPMVIP-IAGOWNOFSA-N 2 1 375.900 3.217 20 0 GGADMP Cc1cccc(NC[C@H]2CC[N@@H+](C[C@@H](O)COc3ccccc3Cl)C2)[nH+]1 ZINC000247279974 1433699179 /nfs/dbraw/zinc/69/91/79/1433699179.db2.gz CWPSTMGSZPMVIP-IAGOWNOFSA-N 2 1 375.900 3.217 20 0 GGADMP Cc1cccc(NC[C@@H]2CC[N@H+](C[C@@H](O)COc3ccccc3Cl)C2)[nH+]1 ZINC000247279961 1433699367 /nfs/dbraw/zinc/69/93/67/1433699367.db2.gz CWPSTMGSZPMVIP-DLBZAZTESA-N 2 1 375.900 3.217 20 0 GGADMP Cc1cccc(NC[C@@H]2CC[N@@H+](C[C@@H](O)COc3ccccc3Cl)C2)[nH+]1 ZINC000247279961 1433699368 /nfs/dbraw/zinc/69/93/68/1433699368.db2.gz CWPSTMGSZPMVIP-DLBZAZTESA-N 2 1 375.900 3.217 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000247292515 1433700931 /nfs/dbraw/zinc/70/09/31/1433700931.db2.gz UNAPDHMOCNOJBK-RBBKRZOGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000247292515 1433700937 /nfs/dbraw/zinc/70/09/37/1433700937.db2.gz UNAPDHMOCNOJBK-RBBKRZOGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000247292515 1433700942 /nfs/dbraw/zinc/70/09/42/1433700942.db2.gz UNAPDHMOCNOJBK-RBBKRZOGSA-N 2 1 386.584 3.413 20 0 GGADMP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+]([C@@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000247301781 1433702225 /nfs/dbraw/zinc/70/22/25/1433702225.db2.gz PDGZVPLXJFKYHP-DENIHFKCSA-N 2 1 380.536 3.428 20 0 GGADMP Cn1cc[nH+]c1C[C@H]1CCC[N@H+]([C@@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000247301781 1433702226 /nfs/dbraw/zinc/70/22/26/1433702226.db2.gz PDGZVPLXJFKYHP-DENIHFKCSA-N 2 1 380.536 3.428 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCC(C)CC2)C1 ZINC000247328379 1433707006 /nfs/dbraw/zinc/70/70/06/1433707006.db2.gz MFWNNXADTDSKAD-IFMALSPDSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)cc2)C[C@@H](C)O1 ZINC000247328217 1433707087 /nfs/dbraw/zinc/70/70/87/1433707087.db2.gz XZEHIQCVIJCZNF-DBXWQHBBSA-N 2 1 389.584 3.392 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)CC[N@H+]1Cc1ccccc1 ZINC000247329960 1433707806 /nfs/dbraw/zinc/70/78/06/1433707806.db2.gz WVKZTJXJFGKJTL-FVTFTPSCSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)CC[NH+]1Cc1ccccc1 ZINC000247329960 1433707809 /nfs/dbraw/zinc/70/78/09/1433707809.db2.gz WVKZTJXJFGKJTL-FVTFTPSCSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)CC[NH+]1Cc1ccccc1 ZINC000247329960 1433707813 /nfs/dbraw/zinc/70/78/13/1433707813.db2.gz WVKZTJXJFGKJTL-FVTFTPSCSA-N 2 1 384.568 3.165 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247332418 1433708526 /nfs/dbraw/zinc/70/85/26/1433708526.db2.gz JJWFOHCRAWSOQL-YADHBBJMSA-N 2 1 384.568 3.311 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000247346014 1433710928 /nfs/dbraw/zinc/71/09/28/1433710928.db2.gz XVFGTFDPJJYXAD-FUOIXIIKSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000247346014 1433710936 /nfs/dbraw/zinc/71/09/36/1433710936.db2.gz XVFGTFDPJJYXAD-FUOIXIIKSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000247346014 1433710943 /nfs/dbraw/zinc/71/09/43/1433710943.db2.gz XVFGTFDPJJYXAD-FUOIXIIKSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000247346035 1433710970 /nfs/dbraw/zinc/71/09/70/1433710970.db2.gz XVFGTFDPJJYXAD-GTWWNFFPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000247346035 1433710977 /nfs/dbraw/zinc/71/09/77/1433710977.db2.gz XVFGTFDPJJYXAD-GTWWNFFPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000247346035 1433710986 /nfs/dbraw/zinc/71/09/86/1433710986.db2.gz XVFGTFDPJJYXAD-GTWWNFFPSA-N 2 1 398.595 3.269 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247349635 1433711313 /nfs/dbraw/zinc/71/13/13/1433711313.db2.gz LDKQSGDSZNAVAM-XZOQPEGZSA-N 2 1 398.595 3.211 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000247374499 1433714479 /nfs/dbraw/zinc/71/44/79/1433714479.db2.gz SMJGFSLGEUNPIG-ZWKOTPCHSA-N 2 1 381.586 3.242 20 0 GGADMP COc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000247412417 1433719153 /nfs/dbraw/zinc/71/91/53/1433719153.db2.gz ZISMVNXFCKHMOM-LAUBAEHRSA-N 2 1 381.520 3.243 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)N(C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247412057 1433719203 /nfs/dbraw/zinc/71/92/03/1433719203.db2.gz STPXEFOSJUHGPP-SJBKTWHCSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247412057 1433719204 /nfs/dbraw/zinc/71/92/04/1433719204.db2.gz STPXEFOSJUHGPP-SJBKTWHCSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247412057 1433719205 /nfs/dbraw/zinc/71/92/05/1433719205.db2.gz STPXEFOSJUHGPP-SJBKTWHCSA-N 2 1 386.584 3.413 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)C1 ZINC000247411772 1433719277 /nfs/dbraw/zinc/71/92/77/1433719277.db2.gz ZFDURNYTEARICR-KNQAVFIVSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000247411772 1433719286 /nfs/dbraw/zinc/71/92/86/1433719286.db2.gz ZFDURNYTEARICR-KNQAVFIVSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000247411772 1433719292 /nfs/dbraw/zinc/71/92/92/1433719292.db2.gz ZFDURNYTEARICR-KNQAVFIVSA-N 2 1 386.584 3.402 20 0 GGADMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CCC[C@@H](Cc3nccn3C)C2)C1 ZINC000247425557 1433720822 /nfs/dbraw/zinc/72/08/22/1433720822.db2.gz ZKVSLUDPNOFFEX-OALUTQOASA-N 2 1 389.588 3.285 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000247463878 1433725766 /nfs/dbraw/zinc/72/57/66/1433725766.db2.gz RBZHXRRRLMQNIW-SJBKTWHCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000247463878 1433725778 /nfs/dbraw/zinc/72/57/78/1433725778.db2.gz RBZHXRRRLMQNIW-SJBKTWHCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000247463878 1433725791 /nfs/dbraw/zinc/72/57/91/1433725791.db2.gz RBZHXRRRLMQNIW-SJBKTWHCSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000247465449 1433725940 /nfs/dbraw/zinc/72/59/40/1433725940.db2.gz UTKGLNUPHDSTFQ-MOPGFXCFSA-N 2 1 392.613 3.237 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000247465449 1433725949 /nfs/dbraw/zinc/72/59/49/1433725949.db2.gz UTKGLNUPHDSTFQ-MOPGFXCFSA-N 2 1 392.613 3.237 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000247465449 1433725955 /nfs/dbraw/zinc/72/59/55/1433725955.db2.gz UTKGLNUPHDSTFQ-MOPGFXCFSA-N 2 1 392.613 3.237 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000247463863 1433726117 /nfs/dbraw/zinc/72/61/17/1433726117.db2.gz RBZHXRRRLMQNIW-KCZVDYSFSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000247463863 1433726122 /nfs/dbraw/zinc/72/61/22/1433726122.db2.gz RBZHXRRRLMQNIW-KCZVDYSFSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000247463863 1433726126 /nfs/dbraw/zinc/72/61/26/1433726126.db2.gz RBZHXRRRLMQNIW-KCZVDYSFSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC[C@H](c2ccccc2Cl)N(C)C)C1 ZINC000247485297 1433728168 /nfs/dbraw/zinc/72/81/68/1433728168.db2.gz WLPSHMXALNDAMV-VQIMIIECSA-N 2 1 380.964 3.220 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000247485297 1433728173 /nfs/dbraw/zinc/72/81/73/1433728173.db2.gz WLPSHMXALNDAMV-VQIMIIECSA-N 2 1 380.964 3.220 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000247485297 1433728177 /nfs/dbraw/zinc/72/81/77/1433728177.db2.gz WLPSHMXALNDAMV-VQIMIIECSA-N 2 1 380.964 3.220 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000247525821 1433733489 /nfs/dbraw/zinc/73/34/89/1433733489.db2.gz ZKOIXJCUXXMRDI-FGZHOGPDSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000247525821 1433733496 /nfs/dbraw/zinc/73/34/96/1433733496.db2.gz ZKOIXJCUXXMRDI-FGZHOGPDSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000247525821 1433733504 /nfs/dbraw/zinc/73/35/04/1433733504.db2.gz ZKOIXJCUXXMRDI-FGZHOGPDSA-N 2 1 386.584 3.128 20 0 GGADMP C[N@@H+](C[C@@H](O)COCc1ccccc1F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000247563272 1433737865 /nfs/dbraw/zinc/73/78/65/1433737865.db2.gz QZJURPLUMUGOTI-IFMALSPDSA-N 2 1 386.511 3.157 20 0 GGADMP C[NH+](C[C@@H](O)COCc1ccccc1F)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000247563272 1433737871 /nfs/dbraw/zinc/73/78/71/1433737871.db2.gz QZJURPLUMUGOTI-IFMALSPDSA-N 2 1 386.511 3.157 20 0 GGADMP C[NH+](C[C@@H](O)COCc1ccccc1F)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000247563272 1433737876 /nfs/dbraw/zinc/73/78/76/1433737876.db2.gz QZJURPLUMUGOTI-IFMALSPDSA-N 2 1 386.511 3.157 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](C[C@@H](O)COc3cccc4[nH]ccc43)C2)CC1 ZINC000247651940 1433743193 /nfs/dbraw/zinc/74/31/93/1433743193.db2.gz WOIKOUMDDYMDGP-VQTJNVASSA-N 2 1 385.552 3.352 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](C[C@@H](O)COc3cccc4[nH]ccc43)C2)CC1 ZINC000247651940 1433743194 /nfs/dbraw/zinc/74/31/94/1433743194.db2.gz WOIKOUMDDYMDGP-VQTJNVASSA-N 2 1 385.552 3.352 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)CN(C)[C@H](C)c3cccc(O)c3)CC2)cc1 ZINC000247727486 1433747940 /nfs/dbraw/zinc/74/79/40/1433747940.db2.gz TUCNYXJDNRUXBM-HXUWFJFHSA-N 2 1 395.547 3.428 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c(F)c1 ZINC000247926185 1433756605 /nfs/dbraw/zinc/75/66/05/1433756605.db2.gz BQQAUTDCGLHPLO-QFBILLFUSA-N 2 1 399.510 3.382 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c(F)c1 ZINC000247926185 1433756610 /nfs/dbraw/zinc/75/66/10/1433756610.db2.gz BQQAUTDCGLHPLO-QFBILLFUSA-N 2 1 399.510 3.382 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c(F)c1 ZINC000247926188 1433756620 /nfs/dbraw/zinc/75/66/20/1433756620.db2.gz BQQAUTDCGLHPLO-VQIMIIECSA-N 2 1 399.510 3.382 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c(F)c1 ZINC000247926188 1433756624 /nfs/dbraw/zinc/75/66/24/1433756624.db2.gz BQQAUTDCGLHPLO-VQIMIIECSA-N 2 1 399.510 3.382 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000247936518 1433756823 /nfs/dbraw/zinc/75/68/23/1433756823.db2.gz CNPAHJPERKAYOI-LAUBAEHRSA-N 2 1 381.520 3.243 20 0 GGADMP COc1ccccc1C[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000247937744 1433757472 /nfs/dbraw/zinc/75/74/72/1433757472.db2.gz CRXNRVSKESCNMP-XMSQKQJNSA-N 2 1 395.547 3.113 20 0 GGADMP Cc1ccccc1C[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000247956355 1433758868 /nfs/dbraw/zinc/75/88/68/1433758868.db2.gz FQOJYTPZADVCOU-WMZHIEFXSA-N 2 1 379.548 3.413 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3cccc(F)c3)C2=O)[C@@H](C)C1 ZINC000247963856 1433759543 /nfs/dbraw/zinc/75/95/43/1433759543.db2.gz GORMIXZGSLVEBF-DZFGPLHGSA-N 2 1 391.531 3.048 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3cccc(F)c3)C2=O)[C@@H](C)C1 ZINC000247963856 1433759546 /nfs/dbraw/zinc/75/95/46/1433759546.db2.gz GORMIXZGSLVEBF-DZFGPLHGSA-N 2 1 391.531 3.048 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC(CC[NH+]3CCCC[C@H]3C)CC2)C[N@H+]1C1CC1 ZINC000248035658 1433765048 /nfs/dbraw/zinc/76/50/48/1433765048.db2.gz RLRFSHKJOPMZBW-QWFCFKBJSA-N 2 1 376.589 3.298 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C[NH+]1C1CC1 ZINC000248035658 1433765056 /nfs/dbraw/zinc/76/50/56/1433765056.db2.gz RLRFSHKJOPMZBW-QWFCFKBJSA-N 2 1 376.589 3.298 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C[NH+]1C1CC1 ZINC000248035658 1433765063 /nfs/dbraw/zinc/76/50/63/1433765063.db2.gz RLRFSHKJOPMZBW-QWFCFKBJSA-N 2 1 376.589 3.298 20 0 GGADMP CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)N1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000248065396 1433767179 /nfs/dbraw/zinc/76/71/79/1433767179.db2.gz ZJPFYOWEFPCILA-KNQAVFIVSA-N 2 1 393.616 3.283 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1)N1CCOCC1 ZINC000248070072 1433767426 /nfs/dbraw/zinc/76/74/26/1433767426.db2.gz MNOUJGGDJIPXAH-SLYNCCJLSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000248070072 1433767430 /nfs/dbraw/zinc/76/74/30/1433767430.db2.gz MNOUJGGDJIPXAH-SLYNCCJLSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000248070072 1433767434 /nfs/dbraw/zinc/76/74/34/1433767434.db2.gz MNOUJGGDJIPXAH-SLYNCCJLSA-N 2 1 386.540 3.028 20 0 GGADMP CC[C@H](Cc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248123460 1433771464 /nfs/dbraw/zinc/77/14/64/1433771464.db2.gz NQPSGAFHRKGXFV-DHIUTWEWSA-N 2 1 379.548 3.495 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1F ZINC000248133508 1433772779 /nfs/dbraw/zinc/77/27/79/1433772779.db2.gz OTAHMXLMVZJFFK-OXQOHEQNSA-N 2 1 399.510 3.382 20 0 GGADMP O[C@H](COCc1ccco1)C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000248168639 1433776910 /nfs/dbraw/zinc/77/69/10/1433776910.db2.gz UHMDJGDCJXDRFC-FUPPJEDESA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000248168639 1433776913 /nfs/dbraw/zinc/77/69/13/1433776913.db2.gz UHMDJGDCJXDRFC-FUPPJEDESA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248168639 1433776919 /nfs/dbraw/zinc/77/69/19/1433776919.db2.gz UHMDJGDCJXDRFC-FUPPJEDESA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000248168639 1433776925 /nfs/dbraw/zinc/77/69/25/1433776925.db2.gz UHMDJGDCJXDRFC-FUPPJEDESA-N 2 1 384.520 3.144 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000248175069 1433777758 /nfs/dbraw/zinc/77/77/58/1433777758.db2.gz VLZGKGXVUUMCKF-VJBWXMMDSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000248175069 1433777762 /nfs/dbraw/zinc/77/77/62/1433777762.db2.gz VLZGKGXVUUMCKF-VJBWXMMDSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000248175069 1433777767 /nfs/dbraw/zinc/77/77/67/1433777767.db2.gz VLZGKGXVUUMCKF-VJBWXMMDSA-N 2 1 398.595 3.414 20 0 GGADMP C[C@H](CSC(C)(C)C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248185734 1433778678 /nfs/dbraw/zinc/77/86/78/1433778678.db2.gz XHWBOCZWMTVOED-VQIMIIECSA-N 2 1 377.598 3.394 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCc4cc(F)ccc43)c2)C1 ZINC000248216787 1433780129 /nfs/dbraw/zinc/78/01/29/1433780129.db2.gz ZTMLOSRVPVDAGI-KNQAVFIVSA-N 2 1 381.495 3.300 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCc4cc(F)ccc43)c2)C1 ZINC000248216788 1433780202 /nfs/dbraw/zinc/78/02/02/1433780202.db2.gz ZTMLOSRVPVDAGI-UGKGYDQZSA-N 2 1 381.495 3.300 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)CC(=O)Nc2cccnc2Cl)[C@@H](C)C1 ZINC000248215786 1433780345 /nfs/dbraw/zinc/78/03/45/1433780345.db2.gz ZPRDSNPHBZYELH-ULQDDVLXSA-N 2 1 396.963 3.179 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@H]1CC[NH+](C2CCCCC2)C1 ZINC000248344207 1433787576 /nfs/dbraw/zinc/78/75/76/1433787576.db2.gz LHCJAISWTGHNKE-YADHBBJMSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000248344207 1433787584 /nfs/dbraw/zinc/78/75/84/1433787584.db2.gz LHCJAISWTGHNKE-YADHBBJMSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000248344207 1433787594 /nfs/dbraw/zinc/78/75/94/1433787594.db2.gz LHCJAISWTGHNKE-YADHBBJMSA-N 2 1 383.580 3.322 20 0 GGADMP NC(=O)c1cccc(CC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000248388855 1433792898 /nfs/dbraw/zinc/79/28/98/1433792898.db2.gz AGICXKDLKSHTFQ-RJGXRXQPSA-N 2 1 377.532 3.218 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248390618 1433793762 /nfs/dbraw/zinc/79/37/62/1433793762.db2.gz BKKJYRKKZQBYKF-ZVVDCOBXSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248390618 1433793767 /nfs/dbraw/zinc/79/37/67/1433793767.db2.gz BKKJYRKKZQBYKF-ZVVDCOBXSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248390618 1433793771 /nfs/dbraw/zinc/79/37/71/1433793771.db2.gz BKKJYRKKZQBYKF-ZVVDCOBXSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@H](O)COc1ccc(F)cc1 ZINC000248393201 1433794568 /nfs/dbraw/zinc/79/45/68/1433794568.db2.gz GKUUVJRIYJBCDW-KXXHFCIOSA-N 2 1 386.511 3.312 20 0 GGADMP COc1cccc(CNC(=O)C[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000248395597 1433795053 /nfs/dbraw/zinc/79/50/53/1433795053.db2.gz JMELCSHWYJKMND-HROJSSOGSA-N 2 1 395.547 3.058 20 0 GGADMP COc1cccc(CNC(=O)C[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000248395597 1433795060 /nfs/dbraw/zinc/79/50/60/1433795060.db2.gz JMELCSHWYJKMND-HROJSSOGSA-N 2 1 395.547 3.058 20 0 GGADMP CN(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395116 1433795252 /nfs/dbraw/zinc/79/52/52/1433795252.db2.gz FYRTVKQEWXDYRP-ISJGIBHGSA-N 3 1 398.639 3.150 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395116 1433795258 /nfs/dbraw/zinc/79/52/58/1433795258.db2.gz FYRTVKQEWXDYRP-ISJGIBHGSA-N 3 1 398.639 3.150 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395116 1433795263 /nfs/dbraw/zinc/79/52/63/1433795263.db2.gz FYRTVKQEWXDYRP-ISJGIBHGSA-N 3 1 398.639 3.150 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248396085 1433795277 /nfs/dbraw/zinc/79/52/77/1433795277.db2.gz GVZHGFXDBFAOOF-ISJGIBHGSA-N 3 1 398.639 3.294 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248396085 1433795281 /nfs/dbraw/zinc/79/52/81/1433795281.db2.gz GVZHGFXDBFAOOF-ISJGIBHGSA-N 3 1 398.639 3.294 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248396085 1433795287 /nfs/dbraw/zinc/79/52/87/1433795287.db2.gz GVZHGFXDBFAOOF-ISJGIBHGSA-N 3 1 398.639 3.294 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N1CCc2ccccc2C1 ZINC000248399144 1433796589 /nfs/dbraw/zinc/79/65/89/1433796589.db2.gz OFMGWLICYLINIZ-FZWXVRBQSA-N 2 1 391.559 3.318 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N1CCc2ccccc2C1 ZINC000248399144 1433796594 /nfs/dbraw/zinc/79/65/94/1433796594.db2.gz OFMGWLICYLINIZ-FZWXVRBQSA-N 2 1 391.559 3.318 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N[C@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)C1 ZINC000248401336 1433797563 /nfs/dbraw/zinc/79/75/63/1433797563.db2.gz LVEAYGOMJKFIDV-VAMGGRTRSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)C1 ZINC000248401336 1433797569 /nfs/dbraw/zinc/79/75/69/1433797569.db2.gz LVEAYGOMJKFIDV-VAMGGRTRSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000248401336 1433797577 /nfs/dbraw/zinc/79/75/77/1433797577.db2.gz LVEAYGOMJKFIDV-VAMGGRTRSA-N 2 1 378.605 3.307 20 0 GGADMP COc1cccc(NC(=O)C[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000248402716 1433798474 /nfs/dbraw/zinc/79/84/74/1433798474.db2.gz WCEYEYKWQGCKQC-CYGODWOOSA-N 2 1 381.520 3.380 20 0 GGADMP COc1cccc(NC(=O)C[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000248402716 1433798479 /nfs/dbraw/zinc/79/84/79/1433798479.db2.gz WCEYEYKWQGCKQC-CYGODWOOSA-N 2 1 381.520 3.380 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000248402712 1433798563 /nfs/dbraw/zinc/79/85/63/1433798563.db2.gz WAJBUVMERHRDNB-CYGODWOOSA-N 2 1 397.588 3.379 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000248402712 1433798571 /nfs/dbraw/zinc/79/85/71/1433798571.db2.gz WAJBUVMERHRDNB-CYGODWOOSA-N 2 1 397.588 3.379 20 0 GGADMP Cc1ccsc1CNC(=O)C[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000248402731 1433798726 /nfs/dbraw/zinc/79/87/26/1433798726.db2.gz WDRPKXAZABQPKV-OEWRPIJISA-N 2 1 385.577 3.419 20 0 GGADMP Cc1ccsc1CNC(=O)C[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000248402731 1433798733 /nfs/dbraw/zinc/79/87/33/1433798733.db2.gz WDRPKXAZABQPKV-OEWRPIJISA-N 2 1 385.577 3.419 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1cccs1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248403770 1433798777 /nfs/dbraw/zinc/79/87/77/1433798777.db2.gz PBOFXCAOTYIFIU-LZLYRXPVSA-N 2 1 378.586 3.303 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H](Cc2nccn2C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248405318 1433799122 /nfs/dbraw/zinc/79/91/22/1433799122.db2.gz REIHWWJLOSJMLJ-FHWLQOOXSA-N 2 1 387.572 3.037 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccc(F)cc1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248404055 1433799353 /nfs/dbraw/zinc/79/93/53/1433799353.db2.gz PORBOAVREVCTPW-YRISNDGFSA-N 2 1 390.547 3.381 20 0 GGADMP C[C@@H](NC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248408212 1433800095 /nfs/dbraw/zinc/80/00/95/1433800095.db2.gz VFWBKDQIBHXUGR-GUDVDZBRSA-N 2 1 378.605 3.449 20 0 GGADMP C[C@@H](NC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248408212 1433800096 /nfs/dbraw/zinc/80/00/96/1433800096.db2.gz VFWBKDQIBHXUGR-GUDVDZBRSA-N 2 1 378.605 3.449 20 0 GGADMP C[C@@H](NC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248408212 1433800097 /nfs/dbraw/zinc/80/00/97/1433800097.db2.gz VFWBKDQIBHXUGR-GUDVDZBRSA-N 2 1 378.605 3.449 20 0 GGADMP O=C(NCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccccc1F ZINC000248409068 1433800140 /nfs/dbraw/zinc/80/01/40/1433800140.db2.gz WHOLOVCTEIMLEQ-KJXAQDMKSA-N 2 1 395.522 3.446 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)C1 ZINC000248408515 1433800185 /nfs/dbraw/zinc/80/01/85/1433800185.db2.gz VNZMGUVQIQXCQJ-CMKODMSKSA-N 2 1 387.572 3.445 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000248408515 1433800186 /nfs/dbraw/zinc/80/01/86/1433800186.db2.gz VNZMGUVQIQXCQJ-CMKODMSKSA-N 2 1 387.572 3.445 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)[NH+](C)Cc1ccccc1 ZINC000248411954 1433800601 /nfs/dbraw/zinc/80/06/01/1433800601.db2.gz ZTWGYCJPLGLTCT-ZJOUEHCJSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1)[N@H+](C)Cc1ccccc1 ZINC000248411954 1433800603 /nfs/dbraw/zinc/80/06/03/1433800603.db2.gz ZTWGYCJPLGLTCT-ZJOUEHCJSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000248411954 1433800604 /nfs/dbraw/zinc/80/06/04/1433800604.db2.gz ZTWGYCJPLGLTCT-ZJOUEHCJSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248411737 1433800652 /nfs/dbraw/zinc/80/06/52/1433800652.db2.gz ZOHDXCWBFUEBFA-CMKODMSKSA-N 2 1 388.556 3.369 20 0 GGADMP O=C1[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)CCCN1CC(F)(F)F ZINC000248418841 1433801319 /nfs/dbraw/zinc/80/13/19/1433801319.db2.gz UDNCHHBTVGUCIL-FCGDIQPGSA-N 2 1 395.469 3.040 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)c1ccc([S@](C)=O)cc1 ZINC000248430385 1433801961 /nfs/dbraw/zinc/80/19/61/1433801961.db2.gz BRWLWVHTOQOPDS-WNLMNSNFSA-N 2 1 386.561 3.232 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000248434747 1433802354 /nfs/dbraw/zinc/80/23/54/1433802354.db2.gz FABYBWMPPPVITK-WMZHIEFXSA-N 3 1 397.563 3.044 20 0 GGADMP CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)c1 ZINC000248439324 1433802757 /nfs/dbraw/zinc/80/27/57/1433802757.db2.gz ILJKVACNWLROTC-SBUREZEXSA-N 2 1 381.520 3.453 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)c(F)c1 ZINC000248447756 1433803497 /nfs/dbraw/zinc/80/34/97/1433803497.db2.gz NPKICKCZRZXCPO-SIKLNZKXSA-N 2 1 390.474 3.399 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)c1ccc(F)c(F)c1 ZINC000248447756 1433803499 /nfs/dbraw/zinc/80/34/99/1433803499.db2.gz NPKICKCZRZXCPO-SIKLNZKXSA-N 2 1 390.474 3.399 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)c1ccc(-n2cncn2)cc1 ZINC000248452570 1433803879 /nfs/dbraw/zinc/80/38/79/1433803879.db2.gz QAPAYXJMDIJOIR-MBSDFSHPSA-N 2 1 391.519 3.075 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)c(F)c1 ZINC000248454558 1433804042 /nfs/dbraw/zinc/80/40/42/1433804042.db2.gz RAAVDASMDYQWIW-WIYYLYMNSA-N 2 1 376.447 3.009 20 0 GGADMP COC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(F)c(F)c1 ZINC000248454558 1433804043 /nfs/dbraw/zinc/80/40/43/1433804043.db2.gz RAAVDASMDYQWIW-WIYYLYMNSA-N 2 1 376.447 3.009 20 0 GGADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc2c(c1)OCCO2 ZINC000248455550 1433804095 /nfs/dbraw/zinc/80/40/95/1433804095.db2.gz RNVLDLPOAWARMS-RTWAWAEBSA-N 2 1 382.504 3.265 20 0 GGADMP COCCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000248456327 1433804291 /nfs/dbraw/zinc/80/42/91/1433804291.db2.gz SEVAGGNIWKBGGE-XMSQKQJNSA-N 2 1 384.520 3.129 20 0 GGADMP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000248528529 1433806980 /nfs/dbraw/zinc/80/69/80/1433806980.db2.gz WDXOMUGOLJWYKR-YLJYHZDGSA-N 2 1 381.520 3.249 20 0 GGADMP Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000248528526 1433807026 /nfs/dbraw/zinc/80/70/26/1433807026.db2.gz WDXOMUGOLJWYKR-FXAWDEMLSA-N 2 1 381.520 3.249 20 0 GGADMP Cc1cc2ncn(C[C@H](O)C[NH2+][C@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)c2cc1C ZINC000248549406 1433807875 /nfs/dbraw/zinc/80/78/75/1433807875.db2.gz FYDFOTOHFTWOOG-SVFBPWRDSA-N 2 1 384.568 3.257 20 0 GGADMP CCN(CCC[NH+](C)C)C(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000248679936 1433814855 /nfs/dbraw/zinc/81/48/55/1433814855.db2.gz CKFHPULDSZDPJH-LPHOPBHVSA-N 2 1 398.954 3.455 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000248724529 1433817869 /nfs/dbraw/zinc/81/78/69/1433817869.db2.gz HQCKYHKWGKADQV-QNWVGRARSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000248724529 1433817871 /nfs/dbraw/zinc/81/78/71/1433817871.db2.gz HQCKYHKWGKADQV-QNWVGRARSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000248724529 1433817872 /nfs/dbraw/zinc/81/78/72/1433817872.db2.gz HQCKYHKWGKADQV-QNWVGRARSA-N 2 1 396.579 3.167 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC[C@H]21 ZINC000248735180 1433818466 /nfs/dbraw/zinc/81/84/66/1433818466.db2.gz QPYVFGDBPOMXSA-KYJSFNMBSA-N 2 1 381.442 3.227 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)[C@H](C)C1 ZINC000248734411 1433818498 /nfs/dbraw/zinc/81/84/98/1433818498.db2.gz PLONXNJIZJWFJR-HFTRVMKXSA-N 2 1 383.458 3.126 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000248737398 1433818814 /nfs/dbraw/zinc/81/88/14/1433818814.db2.gz LDBFMVQHRPPRIH-IFMALSPDSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000248737398 1433818816 /nfs/dbraw/zinc/81/88/16/1433818816.db2.gz LDBFMVQHRPPRIH-IFMALSPDSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248737398 1433818817 /nfs/dbraw/zinc/81/88/17/1433818817.db2.gz LDBFMVQHRPPRIH-IFMALSPDSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000248737402 1433818874 /nfs/dbraw/zinc/81/88/74/1433818874.db2.gz LDBFMVQHRPPRIH-RBBKRZOGSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCCNC(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000248737402 1433818875 /nfs/dbraw/zinc/81/88/75/1433818875.db2.gz LDBFMVQHRPPRIH-RBBKRZOGSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCCNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248737402 1433818876 /nfs/dbraw/zinc/81/88/76/1433818876.db2.gz LDBFMVQHRPPRIH-RBBKRZOGSA-N 2 1 386.584 3.462 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000248760350 1433820754 /nfs/dbraw/zinc/82/07/54/1433820754.db2.gz GNAJJGFSYZZJHX-HMXCVIKNSA-N 2 1 395.551 3.313 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000248760350 1433820755 /nfs/dbraw/zinc/82/07/55/1433820755.db2.gz GNAJJGFSYZZJHX-HMXCVIKNSA-N 2 1 395.551 3.313 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248826572 1433824336 /nfs/dbraw/zinc/82/43/36/1433824336.db2.gz MAMXYBSDHDYKRR-ZNTQHIFFSA-N 2 1 398.595 3.459 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1C[NH+](Cc2ccccc2)C[C@H]1C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248826572 1433824338 /nfs/dbraw/zinc/82/43/38/1433824338.db2.gz MAMXYBSDHDYKRR-ZNTQHIFFSA-N 2 1 398.595 3.459 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)N[C@H]1CCOc2ccccc21 ZINC000248861971 1433826365 /nfs/dbraw/zinc/82/63/65/1433826365.db2.gz XNJANLIABBWWDS-HKUYNNGSSA-N 2 1 384.524 3.186 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)N[C@H]1CCOc2ccccc21 ZINC000248861971 1433826367 /nfs/dbraw/zinc/82/63/67/1433826367.db2.gz XNJANLIABBWWDS-HKUYNNGSSA-N 2 1 384.524 3.186 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC[C@H](c2cccc(C(F)(F)F)c2)[NH+](C)C)C[N@H+]1C1CC1 ZINC000248917274 1433829561 /nfs/dbraw/zinc/82/95/61/1433829561.db2.gz DLJUUKRZLHKFIN-RPVQJOFSSA-N 2 1 398.473 3.233 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C(F)(F)F)c1 ZINC000249001135 1433831897 /nfs/dbraw/zinc/83/18/97/1433831897.db2.gz NAGNQFLFKKSRBH-SQNIBIBYSA-N 2 1 398.473 3.186 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CCC[C@H]2C[NH+](C)CC[C@H]21 ZINC000249061806 1433833507 /nfs/dbraw/zinc/83/35/07/1433833507.db2.gz YQYZZBNBCSXWNB-FDFHNCONSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21 ZINC000249061806 1433833509 /nfs/dbraw/zinc/83/35/09/1433833509.db2.gz YQYZZBNBCSXWNB-FDFHNCONSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21 ZINC000249061806 1433833510 /nfs/dbraw/zinc/83/35/10/1433833510.db2.gz YQYZZBNBCSXWNB-FDFHNCONSA-N 2 1 386.584 3.269 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)[C@@H](C)C1 ZINC000249127196 1433836606 /nfs/dbraw/zinc/83/66/06/1433836606.db2.gz RHYIRWGVSJGZGW-AVRDEDQJSA-N 2 1 388.531 3.297 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)[C@@H](C)C1 ZINC000249127196 1433836608 /nfs/dbraw/zinc/83/66/08/1433836608.db2.gz RHYIRWGVSJGZGW-AVRDEDQJSA-N 2 1 388.531 3.297 20 0 GGADMP C[C@H](Cc1ccccc1F)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000249197368 1433838754 /nfs/dbraw/zinc/83/87/54/1433838754.db2.gz RMBXLPSOIMJHSB-DYESRHJHSA-N 2 1 383.511 3.244 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN([C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1 ZINC000249273496 1433840023 /nfs/dbraw/zinc/84/00/23/1433840023.db2.gz JLWKIEGXVYNMBR-JXFKEZNVSA-N 2 1 379.495 3.120 20 0 GGADMP CCN(C(=O)NC[C@H]1CC[NH+](CC(C)C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249271839 1433840043 /nfs/dbraw/zinc/84/00/43/1433840043.db2.gz BLWNSAZSPCUKOL-FGZHOGPDSA-N 2 1 386.584 3.270 20 0 GGADMP CCN(C(=O)NC[C@H]1CCC[NH+](C(C)C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249373829 1433841915 /nfs/dbraw/zinc/84/19/15/1433841915.db2.gz XLPVVYYVVUICMS-YADHBBJMSA-N 2 1 386.584 3.413 20 0 GGADMP CCN(C(=O)NC[C@H]1CCC[N@@H+](C(C)C)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000249373829 1433841916 /nfs/dbraw/zinc/84/19/16/1433841916.db2.gz XLPVVYYVVUICMS-YADHBBJMSA-N 2 1 386.584 3.413 20 0 GGADMP CCN(C(=O)NC[C@H]1CCC[N@H+](C(C)C)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000249373829 1433841918 /nfs/dbraw/zinc/84/19/18/1433841918.db2.gz XLPVVYYVVUICMS-YADHBBJMSA-N 2 1 386.584 3.413 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2c(C)cccc2C)[C@@H](C)C1 ZINC000249419142 1433843484 /nfs/dbraw/zinc/84/34/84/1433843484.db2.gz HFOZFFUSFLZDPF-UFYCRDLUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2c(C)cccc2C)[C@@H](C)C1 ZINC000249419142 1433843486 /nfs/dbraw/zinc/84/34/86/1433843486.db2.gz HFOZFFUSFLZDPF-UFYCRDLUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2CCCc3ccccc32)[C@@H](C)C1 ZINC000249447063 1433844051 /nfs/dbraw/zinc/84/40/51/1433844051.db2.gz NLFDYSMPYNDBCQ-ZVDOUQERSA-N 2 1 387.568 3.081 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2CCCc3ccccc32)[C@@H](C)C1 ZINC000249447063 1433844053 /nfs/dbraw/zinc/84/40/53/1433844053.db2.gz NLFDYSMPYNDBCQ-ZVDOUQERSA-N 2 1 387.568 3.081 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)[C@H](C)C1 ZINC000249461962 1433844416 /nfs/dbraw/zinc/84/44/16/1433844416.db2.gz QZQMFDUXDLLVRI-AUYGFBLUSA-N 2 1 381.605 3.042 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)[C@H](C)C1 ZINC000249461962 1433844417 /nfs/dbraw/zinc/84/44/17/1433844417.db2.gz QZQMFDUXDLLVRI-AUYGFBLUSA-N 2 1 381.605 3.042 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(SC)cc2)[C@@H](C)C1 ZINC000249490520 1433845031 /nfs/dbraw/zinc/84/50/31/1433845031.db2.gz VCZXWKNVEMSBBS-ZWOKBUDYSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(SC)cc2)[C@@H](C)C1 ZINC000249490520 1433845032 /nfs/dbraw/zinc/84/50/32/1433845032.db2.gz VCZXWKNVEMSBBS-ZWOKBUDYSA-N 2 1 393.597 3.462 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)NC[C@H]1CC[NH+](C2CC2)C1 ZINC000249512802 1433845664 /nfs/dbraw/zinc/84/56/64/1433845664.db2.gz VQCGEVWDGYDSED-RTBURBONSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000249512802 1433845665 /nfs/dbraw/zinc/84/56/65/1433845665.db2.gz VQCGEVWDGYDSED-RTBURBONSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000249512802 1433845666 /nfs/dbraw/zinc/84/56/66/1433845666.db2.gz VQCGEVWDGYDSED-RTBURBONSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)NC[C@H]2CC[NH+](C3CC3)C2)C1 ZINC000249528023 1433846462 /nfs/dbraw/zinc/84/64/62/1433846462.db2.gz VTWOGZJGXKVXGQ-HSALFYBXSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000249528023 1433846463 /nfs/dbraw/zinc/84/64/63/1433846463.db2.gz VTWOGZJGXKVXGQ-HSALFYBXSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)C1 ZINC000249528023 1433846465 /nfs/dbraw/zinc/84/64/65/1433846465.db2.gz VTWOGZJGXKVXGQ-HSALFYBXSA-N 2 1 398.595 3.448 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@H+]2CCC[C@H]2c2cccn2C)CC1 ZINC000249714074 1433849689 /nfs/dbraw/zinc/84/96/89/1433849689.db2.gz HBBOAUQCXLCEEE-QHCPKHFHSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@@H+]2CCC[C@H]2c2cccn2C)CC1 ZINC000249714074 1433849690 /nfs/dbraw/zinc/84/96/90/1433849690.db2.gz HBBOAUQCXLCEEE-QHCPKHFHSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)C[NH+]2CCC[C@H]2c2cccn2C)CC1 ZINC000249714074 1433849691 /nfs/dbraw/zinc/84/96/91/1433849691.db2.gz HBBOAUQCXLCEEE-QHCPKHFHSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH+]2CCC[C@H]2c2cccn2C)CC1 ZINC000249714074 1433849692 /nfs/dbraw/zinc/84/96/92/1433849692.db2.gz HBBOAUQCXLCEEE-QHCPKHFHSA-N 2 1 394.563 3.205 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)C1 ZINC000249746551 1433850808 /nfs/dbraw/zinc/85/08/08/1433850808.db2.gz MWYCOEUZXJHUOX-KNQAVFIVSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000249746551 1433850809 /nfs/dbraw/zinc/85/08/09/1433850809.db2.gz MWYCOEUZXJHUOX-KNQAVFIVSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000249746551 1433850810 /nfs/dbraw/zinc/85/08/10/1433850810.db2.gz MWYCOEUZXJHUOX-KNQAVFIVSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000249772839 1433851837 /nfs/dbraw/zinc/85/18/37/1433851837.db2.gz LREGFCSPOAFMCE-LEWJYISDSA-N 2 1 381.520 3.445 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000249790764 1433852112 /nfs/dbraw/zinc/85/21/12/1433852112.db2.gz USUHZAOFXMDFOV-ROUUACIJSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)C1CCS(=O)(=O)CC1 ZINC000249784982 1433852129 /nfs/dbraw/zinc/85/21/29/1433852129.db2.gz DIIQLTRNTISGQI-ZWKOTPCHSA-N 2 1 378.582 3.221 20 0 GGADMP COc1ccccc1COC[C@H](O)C[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000250282140 1433855430 /nfs/dbraw/zinc/85/54/30/1433855430.db2.gz GNXLLESVOBTQCL-RBBKRZOGSA-N 2 1 390.568 3.017 20 0 GGADMP COc1cccc(COC[C@H](O)C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000250286165 1433855719 /nfs/dbraw/zinc/85/57/19/1433855719.db2.gz KZJOGOLZKWKSDQ-FCHUYYIVSA-N 2 1 390.568 3.017 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)[NH+](C)C)cc1 ZINC000251506499 1433858562 /nfs/dbraw/zinc/85/85/62/1433858562.db2.gz YCVHFEZESHIABU-YADHBBJMSA-N 2 1 380.536 3.296 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)[NH+](C)C)cc1 ZINC000251506499 1433858563 /nfs/dbraw/zinc/85/85/63/1433858563.db2.gz YCVHFEZESHIABU-YADHBBJMSA-N 2 1 380.536 3.296 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000251573955 1433859060 /nfs/dbraw/zinc/85/90/60/1433859060.db2.gz VDWVQZYKVMACDS-OIBXWCBGSA-N 2 1 392.547 3.396 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000251573955 1433859061 /nfs/dbraw/zinc/85/90/61/1433859061.db2.gz VDWVQZYKVMACDS-OIBXWCBGSA-N 2 1 392.547 3.396 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000251573955 1433859063 /nfs/dbraw/zinc/85/90/63/1433859063.db2.gz VDWVQZYKVMACDS-OIBXWCBGSA-N 2 1 392.547 3.396 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cccc(C)c2C)[C@@H](C)C1 ZINC000253296058 1433865527 /nfs/dbraw/zinc/86/55/27/1433865527.db2.gz NXLTYZDSJUQFTR-IHPCNDPISA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cccc(C)c2C)[C@@H](C)C1 ZINC000253296058 1433865528 /nfs/dbraw/zinc/86/55/28/1433865528.db2.gz NXLTYZDSJUQFTR-IHPCNDPISA-N 2 1 375.557 3.357 20 0 GGADMP CCN(C)c1ccc(C[NH2+]CCCN2CC[N@@H+](C)C[C@H]2c2ccccc2)cn1 ZINC000253351787 1433865795 /nfs/dbraw/zinc/86/57/95/1433865795.db2.gz LNGLKYPBRDHTOE-QFIPXVFZSA-N 2 1 381.568 3.006 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c(OC)c1 ZINC000255123193 1433876953 /nfs/dbraw/zinc/87/69/53/1433876953.db2.gz GBAPHEUPCMUMAK-AMAHLLERSA-N 2 1 388.552 3.418 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c(OC)c1 ZINC000255123193 1433876955 /nfs/dbraw/zinc/87/69/55/1433876955.db2.gz GBAPHEUPCMUMAK-AMAHLLERSA-N 2 1 388.552 3.418 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[N@@H+](C)C/C=C\C[NH+](C)[C@H]1CCCc2c1cnn2C ZINC000255207396 1433878468 /nfs/dbraw/zinc/87/84/68/1433878468.db2.gz WGQRGNZXPRNQHK-GGJLBNBESA-N 2 1 382.556 3.028 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[NH+](C)C/C=C\C[N@H+](C)[C@H]1CCCc2c1cnn2C ZINC000255207396 1433878469 /nfs/dbraw/zinc/87/84/69/1433878469.db2.gz WGQRGNZXPRNQHK-GGJLBNBESA-N 2 1 382.556 3.028 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[NH+](C)C/C=C\C[N@@H+](C)[C@H]1CCCc2c1cnn2C ZINC000255207396 1433878470 /nfs/dbraw/zinc/87/84/70/1433878470.db2.gz WGQRGNZXPRNQHK-GGJLBNBESA-N 2 1 382.556 3.028 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)/C=C\c1nc2ccccc2s1 ZINC000255734912 1433888857 /nfs/dbraw/zinc/88/88/57/1433888857.db2.gz HKXFJHMECMVVMJ-CPFIRTDXSA-N 2 1 386.565 3.184 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000255770437 1433889217 /nfs/dbraw/zinc/88/92/17/1433889217.db2.gz JUSCBGLZEUGMNO-RBUKOAKNSA-N 2 1 376.545 3.370 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1cc(C)nc2cc(F)ccc21 ZINC000261398879 1433895670 /nfs/dbraw/zinc/89/56/70/1433895670.db2.gz ZISGPDNLWKQQSX-SFHVURJKSA-N 2 1 386.515 3.170 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1cc(C)nc2cc(F)ccc21 ZINC000261398875 1433895726 /nfs/dbraw/zinc/89/57/26/1433895726.db2.gz ZISGPDNLWKQQSX-GOSISDBHSA-N 2 1 386.515 3.170 20 0 GGADMP C[NH2+]CCC1CC[NH+](Cc2nc(-c3cccc(Br)c3)no2)CC1 ZINC000261663618 1433898538 /nfs/dbraw/zinc/89/85/38/1433898538.db2.gz GLDJKSFWWGUBKD-UHFFFAOYSA-N 2 1 379.302 3.321 20 0 GGADMP CC[NH2+]CC1CC[NH+](Cc2nc(-c3cccc(Br)c3)no2)CC1 ZINC000261682063 1433899005 /nfs/dbraw/zinc/89/90/05/1433899005.db2.gz IHWNUBHRUSFLBD-UHFFFAOYSA-N 2 1 379.302 3.321 20 0 GGADMP O=C(CC[C@H]1CC[NH2+]C1)NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000261778992 1433903210 /nfs/dbraw/zinc/90/32/10/1433903210.db2.gz AUYOGRGMPQZZDP-PXNSSMCTSA-N 2 1 383.561 3.353 20 0 GGADMP O=C(CC[C@H]1CC[NH2+]C1)NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000261778992 1433903214 /nfs/dbraw/zinc/90/32/14/1433903214.db2.gz AUYOGRGMPQZZDP-PXNSSMCTSA-N 2 1 383.561 3.353 20 0 GGADMP O=C(CC[C@@H]1CC[NH2+]C1)NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000261778997 1433903431 /nfs/dbraw/zinc/90/34/31/1433903431.db2.gz AUYOGRGMPQZZDP-XLIONFOSSA-N 2 1 383.561 3.353 20 0 GGADMP O=C(CC[C@@H]1CC[NH2+]C1)NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000261778997 1433903435 /nfs/dbraw/zinc/90/34/35/1433903435.db2.gz AUYOGRGMPQZZDP-XLIONFOSSA-N 2 1 383.561 3.353 20 0 GGADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000261820215 1433905390 /nfs/dbraw/zinc/90/53/90/1433905390.db2.gz KGLRBUDMGUPJTC-IIDMSEBBSA-N 2 1 399.457 3.226 20 0 GGADMP O=C(N1CCC2(CC[NH2+]C2)CC1)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000261876998 1433908864 /nfs/dbraw/zinc/90/88/64/1433908864.db2.gz SXGSGSSCBSOJAO-FQEVSTJZSA-N 2 1 395.469 3.043 20 0 GGADMP O=C(N1CCC2(CC[NH2+]C2)CC1)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000261877000 1433908885 /nfs/dbraw/zinc/90/88/85/1433908885.db2.gz SXGSGSSCBSOJAO-HXUWFJFHSA-N 2 1 395.469 3.043 20 0 GGADMP CN(c1ccccc1C[N@H+]1C[C@@H](c2ccccc2)[C@H](N)C1)C1CC[NH+](C)CC1 ZINC000261904771 1433911450 /nfs/dbraw/zinc/91/14/50/1433911450.db2.gz XBQZFXAZYIQINZ-XZOQPEGZSA-N 2 1 378.564 3.144 20 0 GGADMP CN(c1ccccc1C[N@@H+]1C[C@@H](c2ccccc2)[C@H](N)C1)C1CC[NH+](C)CC1 ZINC000261904771 1433911456 /nfs/dbraw/zinc/91/14/56/1433911456.db2.gz XBQZFXAZYIQINZ-XZOQPEGZSA-N 2 1 378.564 3.144 20 0 GGADMP Clc1ccc(C[N@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)c(-n2cncn2)c1 ZINC000261941752 1433914572 /nfs/dbraw/zinc/91/45/72/1433914572.db2.gz MTOZQWNTAJDAEB-FQEVSTJZSA-N 2 1 396.926 3.460 20 0 GGADMP Clc1ccc(C[N@@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)c(-n2cncn2)c1 ZINC000261941752 1433914582 /nfs/dbraw/zinc/91/45/82/1433914582.db2.gz MTOZQWNTAJDAEB-FQEVSTJZSA-N 2 1 396.926 3.460 20 0 GGADMP Brc1cc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)cc2c1OCCCO2 ZINC000261959465 1433916406 /nfs/dbraw/zinc/91/64/06/1433916406.db2.gz HCVBXMPUCSWJRK-UHFFFAOYSA-N 2 1 381.314 3.186 20 0 GGADMP CCCOc1c(Cl)cc(C[N@@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)cc1OCC ZINC000262108645 1433927242 /nfs/dbraw/zinc/92/72/42/1433927242.db2.gz JYXRTCXPKONGLH-QGZVFWFLSA-N 2 1 381.948 3.007 20 0 GGADMP CCCOc1c(Cl)cc(C[N@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)cc1OCC ZINC000262108645 1433927246 /nfs/dbraw/zinc/92/72/46/1433927246.db2.gz JYXRTCXPKONGLH-QGZVFWFLSA-N 2 1 381.948 3.007 20 0 GGADMP CCCOc1c(Cl)cc(C[N@@H+]2CC[C@H](N3CC[NH2+]CC3)C2)cc1OCC ZINC000262108644 1433927385 /nfs/dbraw/zinc/92/73/85/1433927385.db2.gz JYXRTCXPKONGLH-KRWDZBQOSA-N 2 1 381.948 3.007 20 0 GGADMP CCCOc1c(Cl)cc(C[N@H+]2CC[C@H](N3CC[NH2+]CC3)C2)cc1OCC ZINC000262108644 1433927387 /nfs/dbraw/zinc/92/73/87/1433927387.db2.gz JYXRTCXPKONGLH-KRWDZBQOSA-N 2 1 381.948 3.007 20 0 GGADMP COc1ccccc1-c1ccc(C[N@H+]2CCCC[C@H]2CNC(=O)CC[NH3+])cc1 ZINC000262120312 1433927572 /nfs/dbraw/zinc/92/75/72/1433927572.db2.gz XEWWFBFUTKAGSY-FQEVSTJZSA-N 2 1 381.520 3.182 20 0 GGADMP [NH3+][C@@H]1CN(C(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000262223711 1433931508 /nfs/dbraw/zinc/93/15/08/1433931508.db2.gz MZEAXKRUKOSRAZ-BDTNDASRSA-N 2 1 381.495 3.134 20 0 GGADMP [NH3+][C@@H]1CN(C(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000262223711 1433931513 /nfs/dbraw/zinc/93/15/13/1433931513.db2.gz MZEAXKRUKOSRAZ-BDTNDASRSA-N 2 1 381.495 3.134 20 0 GGADMP Cc1ccc(NC(=O)[C@]23C[NH2+]C[C@@H]2CCCC3)cc1NC(=O)C[NH+]1CCCCC1 ZINC000262303630 1433934404 /nfs/dbraw/zinc/93/44/04/1433934404.db2.gz BXVNWVNWGKTGMJ-FDDCHVKYSA-N 2 1 398.551 3.138 20 0 GGADMP C[C@H]1C[C@@H](C(=O)NC[C@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CC[NH2+]1 ZINC000262311765 1433934732 /nfs/dbraw/zinc/93/47/32/1433934732.db2.gz BMZNRQLOOMGEFO-XKGZKEIXSA-N 2 1 383.561 3.352 20 0 GGADMP C[C@H]1C[C@@H](C(=O)NC[C@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CC[NH2+]1 ZINC000262311765 1433934736 /nfs/dbraw/zinc/93/47/36/1433934736.db2.gz BMZNRQLOOMGEFO-XKGZKEIXSA-N 2 1 383.561 3.352 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)c3csc(CC[NH3+])n3)cc2)C1 ZINC000262409043 1433938177 /nfs/dbraw/zinc/93/81/77/1433938177.db2.gz SESRCFINVVKUMT-IYBDPMFKSA-N 2 1 386.565 3.052 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[C@H]([NH3+])c1ccccc1 ZINC000262658143 1433948333 /nfs/dbraw/zinc/94/83/33/1433948333.db2.gz DPVMVMJZLJENBY-KCESLBEFSA-N 2 1 395.547 3.248 20 0 GGADMP CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2ccn([C@@H]3CCC[NH2+]C3)n2)c1 ZINC000262698284 1433950557 /nfs/dbraw/zinc/95/05/57/1433950557.db2.gz BQOSYHHQSNZFCI-LJQANCHMSA-N 2 1 392.507 3.428 20 0 GGADMP CCC[C@](C)([NH3+])C(=O)Nc1ccc(C[NH+]2CCN(Cc3ccccc3)CC2)cc1 ZINC000262705738 1433951350 /nfs/dbraw/zinc/95/13/50/1433951350.db2.gz LXLQMADGAFKYDX-DEOSSOPVSA-N 2 1 394.563 3.460 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1(C)C ZINC000262761800 1433954236 /nfs/dbraw/zinc/95/42/36/1433954236.db2.gz DNEIPCUEABEYTG-CLWLKPMESA-N 2 1 387.568 3.030 20 0 GGADMP CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2ccn([C@@H]3CCC[NH2+]C3)n2)c1 ZINC000262767076 1433954805 /nfs/dbraw/zinc/95/48/05/1433954805.db2.gz LZEWNVNKMGEXOX-OAQYLSRUSA-N 2 1 397.567 3.360 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)NCc2ccccc2C[N@H+]2CCCC[C@H]2C)C1(C)C ZINC000262818690 1433958458 /nfs/dbraw/zinc/95/84/58/1433958458.db2.gz XNWDYUHYYWOLLE-HCLVMJGWSA-N 2 1 387.568 3.210 20 0 GGADMP Cc1ccc(NC(=O)[C@@H]2CCCC[C@]2(C)[NH3+])cc1NC(=O)C[NH+]1CCCCC1 ZINC000263246693 1433998129 /nfs/dbraw/zinc/99/81/29/1433998129.db2.gz PJZDXAUYRBBELI-AVRDEDQJSA-N 2 1 386.540 3.266 20 0 GGADMP Cc1ccc(NC(=O)C[C@H]([NH3+])c2ccccc2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000263315346 1434001687 /nfs/dbraw/zinc/00/16/87/1434001687.db2.gz HMQXCTLOWUQHRI-FQEVSTJZSA-N 2 1 394.519 3.448 20 0 GGADMP Cc1ccc(NC(=O)C[C@@H]([NH3+])c2ccccc2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000263315349 1434001733 /nfs/dbraw/zinc/00/17/33/1434001733.db2.gz HMQXCTLOWUQHRI-HXUWFJFHSA-N 2 1 394.519 3.448 20 0 GGADMP C[C@H]1C[NH+](CC2CC[NH+](Cc3cc(F)cc4c3OCOC4)CC2)C[C@H](C)O1 ZINC000263770850 1434031648 /nfs/dbraw/zinc/03/16/48/1434031648.db2.gz STWXGWXJNJFXCP-HOTGVXAUSA-N 2 1 378.488 3.013 20 0 GGADMP C[N@H+](CCOc1cccc(CNc2[nH+]cnc3[nH]ccc32)c1)C1CCOCC1 ZINC000263971218 1434055668 /nfs/dbraw/zinc/05/56/68/1434055668.db2.gz VBORMRZJLAEVOR-UHFFFAOYSA-N 2 1 381.480 3.060 20 0 GGADMP C[N@@H+](CCOc1cccc(CNc2[nH+]cnc3[nH]ccc32)c1)C1CCOCC1 ZINC000263971218 1434055671 /nfs/dbraw/zinc/05/56/71/1434055671.db2.gz VBORMRZJLAEVOR-UHFFFAOYSA-N 2 1 381.480 3.060 20 0 GGADMP C[C@@H]1C[N@H+](CC2CCN(C(=O)c3ccc(C[NH+]4CCCC4)cc3)CC2)C[C@H](C)O1 ZINC000264155336 1434076416 /nfs/dbraw/zinc/07/64/16/1434076416.db2.gz HKKJJZIDBKHFLN-BGYRXZFFSA-N 2 1 399.579 3.244 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NCC2([NH+]3CCCC3)CCOCC2)cc1)C(C)C ZINC000264323160 1434097129 /nfs/dbraw/zinc/09/71/29/1434097129.db2.gz VSCQXCLSTNQPOZ-UHFFFAOYSA-N 2 1 387.568 3.292 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[C@H]([NH+]3CCCCC3)C2)cc1F ZINC000264623421 1434135935 /nfs/dbraw/zinc/13/59/35/1434135935.db2.gz SASAWQCMQMVJEY-SFHVURJKSA-N 2 1 385.487 3.090 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2OCC(=O)NCC2CC2)c1 ZINC000265243686 1434206135 /nfs/dbraw/zinc/20/61/35/1434206135.db2.gz MFSGUJWNJSCJKN-UHFFFAOYSA-N 2 1 395.547 3.333 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000265771570 1434263883 /nfs/dbraw/zinc/26/38/83/1434263883.db2.gz SSLBRUQSATWIGB-WIYYLYMNSA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000265771570 1434263885 /nfs/dbraw/zinc/26/38/85/1434263885.db2.gz SSLBRUQSATWIGB-WIYYLYMNSA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000265771567 1434263908 /nfs/dbraw/zinc/26/39/08/1434263908.db2.gz SSLBRUQSATWIGB-RXVVDRJESA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000265771567 1434263910 /nfs/dbraw/zinc/26/39/10/1434263910.db2.gz SSLBRUQSATWIGB-RXVVDRJESA-N 2 1 383.540 3.276 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)C1 ZINC000266426784 1434334774 /nfs/dbraw/zinc/33/47/74/1434334774.db2.gz RFVVGWWUFMPIMS-ICSRJNTNSA-N 2 1 397.485 3.241 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)[C@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)C1 ZINC000266426784 1434334775 /nfs/dbraw/zinc/33/47/75/1434334775.db2.gz RFVVGWWUFMPIMS-ICSRJNTNSA-N 2 1 397.485 3.241 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000266426784 1434334776 /nfs/dbraw/zinc/33/47/76/1434334776.db2.gz RFVVGWWUFMPIMS-ICSRJNTNSA-N 2 1 397.485 3.241 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NC(=O)C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000266607325 1434353834 /nfs/dbraw/zinc/35/38/34/1434353834.db2.gz AAXQGOHLGVUBNH-UHFFFAOYSA-N 2 1 394.519 3.037 20 0 GGADMP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCn1cc[nH+]c1C ZINC000266611173 1434354188 /nfs/dbraw/zinc/35/41/88/1434354188.db2.gz WAMMZMZQMQWBQA-NRFANRHFSA-N 2 1 383.540 3.135 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCCCn1cc[nH+]c1C ZINC000266611173 1434354193 /nfs/dbraw/zinc/35/41/93/1434354193.db2.gz WAMMZMZQMQWBQA-NRFANRHFSA-N 2 1 383.540 3.135 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCc4c3cccc4F)c2)C1 ZINC000267078587 1434406013 /nfs/dbraw/zinc/40/60/13/1434406013.db2.gz UNPPQRIRBSDWRF-AVRDEDQJSA-N 2 1 381.495 3.300 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)[C@@H](c2ccccc2)N2CCOCC2)cn1 ZINC000267285589 1434419187 /nfs/dbraw/zinc/41/91/87/1434419187.db2.gz WJXBILSLBIWAKL-JPYJTQIMSA-N 2 1 391.519 3.127 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000267323142 1434422794 /nfs/dbraw/zinc/42/27/94/1434422794.db2.gz KPIVWLPEPUQRHS-OPYAIIAOSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000267323142 1434422798 /nfs/dbraw/zinc/42/27/98/1434422798.db2.gz KPIVWLPEPUQRHS-OPYAIIAOSA-N 2 1 383.540 3.037 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000267325203 1434423021 /nfs/dbraw/zinc/42/30/21/1434423021.db2.gz DYQVKHSDNHDAIO-SIKLNZKXSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000267333826 1434423443 /nfs/dbraw/zinc/42/34/43/1434423443.db2.gz MLQVKQXWRPFNSK-GHTZIAJQSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000267333830 1434423742 /nfs/dbraw/zinc/42/37/42/1434423742.db2.gz MLQVKQXWRPFNSK-RXVVDRJESA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000267333828 1434423789 /nfs/dbraw/zinc/42/37/89/1434423789.db2.gz MLQVKQXWRPFNSK-NQIIRXRSSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000267359279 1434425546 /nfs/dbraw/zinc/42/55/46/1434425546.db2.gz IYMWDTFGONLGOZ-SIKLNZKXSA-N 2 1 386.584 3.270 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)NC1CC[NH+](C2CCCC2)CC1 ZINC000267378716 1434427482 /nfs/dbraw/zinc/42/74/82/1434427482.db2.gz VBVZCYLGGROWLU-OAQYLSRUSA-N 2 1 398.595 3.257 20 0 GGADMP COc1ccc(C[NH+](C)CCCC[N@H+](C)Cc2ccc(OC)c(O)c2)cc1O ZINC000267422984 1434431259 /nfs/dbraw/zinc/43/12/59/1434431259.db2.gz WTNHTJCCEWEJRX-UHFFFAOYSA-N 2 1 388.508 3.459 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000267426055 1434431448 /nfs/dbraw/zinc/43/14/48/1434431448.db2.gz QLPOHZMHMXLVGP-HJNYFJLDSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000267426055 1434431450 /nfs/dbraw/zinc/43/14/50/1434431450.db2.gz QLPOHZMHMXLVGP-HJNYFJLDSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000267426055 1434431452 /nfs/dbraw/zinc/43/14/52/1434431452.db2.gz QLPOHZMHMXLVGP-HJNYFJLDSA-N 2 1 386.584 3.270 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(NS(C)(=O)=O)cc2)cc1 ZINC000267965990 1434481932 /nfs/dbraw/zinc/48/19/32/1434481932.db2.gz YVBGXKAFDKMSIN-OAHLLOKOSA-N 2 1 384.505 3.403 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1cccc(N2CCOCC2)c1 ZINC000268701388 1434548703 /nfs/dbraw/zinc/54/87/03/1434548703.db2.gz AHYYHPVDSQBGGR-FQEVSTJZSA-N 2 1 395.547 3.206 20 0 GGADMP C[C@@H]1C[C@H](NCc2ccc(N3CCOCC3)nc2)CC[N@H+]1Cc1ccccc1 ZINC000268741799 1434551959 /nfs/dbraw/zinc/55/19/59/1434551959.db2.gz GDNKEDOUDWWDJW-DENIHFKCSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CCN1Cc1ccccc1 ZINC000268741799 1434551963 /nfs/dbraw/zinc/55/19/63/1434551963.db2.gz GDNKEDOUDWWDJW-DENIHFKCSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CC[N@@H+]1Cc1ccccc1 ZINC000268741799 1434551965 /nfs/dbraw/zinc/55/19/65/1434551965.db2.gz GDNKEDOUDWWDJW-DENIHFKCSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CC[N@H+]1Cc1ccccc1 ZINC000268741799 1434551968 /nfs/dbraw/zinc/55/19/68/1434551968.db2.gz GDNKEDOUDWWDJW-DENIHFKCSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2Cn2cncn2)CC[N@@H+]1Cc1ccccc1 ZINC000268760184 1434553797 /nfs/dbraw/zinc/55/37/97/1434553797.db2.gz LAXSMLHOXQQMMD-CVDCTZTESA-N 2 1 375.520 3.469 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2Cn2cncn2)CC[N@H+]1Cc1ccccc1 ZINC000268760184 1434553800 /nfs/dbraw/zinc/55/38/00/1434553800.db2.gz LAXSMLHOXQQMMD-CVDCTZTESA-N 2 1 375.520 3.469 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2cccnc2N2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000268761823 1434554089 /nfs/dbraw/zinc/55/40/89/1434554089.db2.gz LUOXWWZUSFWLBH-SIKLNZKXSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2cccnc2N2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000268761823 1434554091 /nfs/dbraw/zinc/55/40/91/1434554091.db2.gz LUOXWWZUSFWLBH-SIKLNZKXSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCC(=O)N(C)C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000268766859 1434554664 /nfs/dbraw/zinc/55/46/64/1434554664.db2.gz JPKLLPMSRNUPSG-KNQAVFIVSA-N 2 1 395.547 3.296 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCC(=O)N(C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000268766859 1434554666 /nfs/dbraw/zinc/55/46/66/1434554666.db2.gz JPKLLPMSRNUPSG-KNQAVFIVSA-N 2 1 395.547 3.296 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000268770893 1434555172 /nfs/dbraw/zinc/55/51/72/1434555172.db2.gz SLCGIONEMPONKH-MTNREXPMSA-N 2 1 384.520 3.237 20 0 GGADMP CC[C@H]([NH2+]Cc1ccc(C(=O)N2CC[NH+](C)CC2)cc1)c1ccc(OC)cc1 ZINC000268797671 1434558275 /nfs/dbraw/zinc/55/82/75/1434558275.db2.gz GSBSQGRGFYHKCR-QFIPXVFZSA-N 2 1 381.520 3.324 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000268808443 1434559771 /nfs/dbraw/zinc/55/97/71/1434559771.db2.gz LMMSHKOKQOVHQC-REWPJTCUSA-N 3 1 384.612 3.188 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000268808443 1434559772 /nfs/dbraw/zinc/55/97/72/1434559772.db2.gz LMMSHKOKQOVHQC-REWPJTCUSA-N 3 1 384.612 3.188 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000268808785 1434559777 /nfs/dbraw/zinc/55/97/77/1434559777.db2.gz CMHUCFOZAFLPIK-FGZHOGPDSA-N 2 1 395.551 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000268808785 1434559779 /nfs/dbraw/zinc/55/97/79/1434559779.db2.gz CMHUCFOZAFLPIK-FGZHOGPDSA-N 2 1 395.551 3.278 20 0 GGADMP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C(=O)N3CC[NH+](C)CC3)cc1)CCC2 ZINC000268829578 1434562088 /nfs/dbraw/zinc/56/20/88/1434562088.db2.gz QNOHKTWEFXAYGS-QHCPKHFHSA-N 2 1 393.531 3.250 20 0 GGADMP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C(=O)N3CC[NH+](C)CC3)cc1)CCC2 ZINC000268829574 1434562236 /nfs/dbraw/zinc/56/22/36/1434562236.db2.gz QNOHKTWEFXAYGS-HSZRJFAPSA-N 2 1 393.531 3.250 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc(CS(C)(=O)=O)c2)CC[N@@H+]1Cc1ccccc1 ZINC000268850754 1434564584 /nfs/dbraw/zinc/56/45/84/1434564584.db2.gz XVWGBTCKFZSICC-AVRDEDQJSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc(CS(C)(=O)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000268850754 1434564586 /nfs/dbraw/zinc/56/45/86/1434564586.db2.gz XVWGBTCKFZSICC-AVRDEDQJSA-N 2 1 386.561 3.374 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NC2CC[NH+](CCc3ccccc3)CC2)[C@@H](C)C1 ZINC000268859377 1434565318 /nfs/dbraw/zinc/56/53/18/1434565318.db2.gz YIHXAJVLCSATDH-XUZZJYLKSA-N 2 1 387.612 3.420 20 0 GGADMP COc1cccc2c1CC[C@H]2[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000268875020 1434566904 /nfs/dbraw/zinc/56/69/04/1434566904.db2.gz GTWFUXVZLQCRDP-DENIHFKCSA-N 2 1 393.531 3.170 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000268883563 1434567557 /nfs/dbraw/zinc/56/75/57/1434567557.db2.gz IMZZYYPGNYOAQV-DHJUGAMNSA-N 2 1 384.520 3.380 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000268883563 1434567560 /nfs/dbraw/zinc/56/75/60/1434567560.db2.gz IMZZYYPGNYOAQV-DHJUGAMNSA-N 2 1 384.520 3.380 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000268883565 1434567700 /nfs/dbraw/zinc/56/77/00/1434567700.db2.gz IMZZYYPGNYOAQV-KPDCDPCYSA-N 2 1 384.520 3.380 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000268883565 1434567704 /nfs/dbraw/zinc/56/77/04/1434567704.db2.gz IMZZYYPGNYOAQV-KPDCDPCYSA-N 2 1 384.520 3.380 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000268903215 1434569361 /nfs/dbraw/zinc/56/93/61/1434569361.db2.gz WZZNWQMBULBXBF-CYBMUJFWSA-N 2 1 384.402 3.487 20 0 GGADMP O[C@H]1CCC[C@H]1[NH+]1CCC([NH2+]Cc2ccccc2OCc2cccnc2)CC1 ZINC000268995137 1434579661 /nfs/dbraw/zinc/57/96/61/1434579661.db2.gz XHRAPYUADWKTJW-YADHBBJMSA-N 2 1 381.520 3.128 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000268997137 1434579683 /nfs/dbraw/zinc/57/96/83/1434579683.db2.gz KTIZEMKIOPLXFU-QGZVFWFLSA-N 2 1 393.597 3.385 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H](C)c3cccc(N4CCOCC4)c3)CC2)nc(C)[nH+]1 ZINC000269064711 1434587101 /nfs/dbraw/zinc/58/71/01/1434587101.db2.gz LAZAWAPKZATWJC-SFHVURJKSA-N 2 1 395.551 3.250 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccsc1 ZINC000269482136 1434652230 /nfs/dbraw/zinc/65/22/30/1434652230.db2.gz GESFITAMOROOIS-ATZDWAIDSA-N 2 1 376.570 3.009 20 0 GGADMP CC(C)n1ncc2cc(C[NH+]3CCN(C4CC[NH+](C(C)C)CC4)CC3)cnc21 ZINC000269701777 1434670557 /nfs/dbraw/zinc/67/05/57/1434670557.db2.gz YSKIPQNYHIUKIE-UHFFFAOYSA-N 2 1 384.572 3.003 20 0 GGADMP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C1 ZINC000269716127 1434671326 /nfs/dbraw/zinc/67/13/26/1434671326.db2.gz SFFBYFCHSRDCIQ-PKOBYXMFSA-N 2 1 381.520 3.200 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1 ZINC000269713536 1434671367 /nfs/dbraw/zinc/67/13/67/1434671367.db2.gz QXLJFEKEILEKTH-QZTJIDSGSA-N 2 1 380.492 3.169 20 0 GGADMP CC[N@@H+](CCCC1CC[NH+](CCn2ccnc2C)CC1)CCn1ccnc1C ZINC000270810108 1434777389 /nfs/dbraw/zinc/77/73/89/1434777389.db2.gz CZVUEHLLNPOBOR-UHFFFAOYSA-N 2 1 386.588 3.211 20 0 GGADMP CC(C)[NH+]1CCN(C2CC[NH+](C[C@H](O)c3ccccc3C(F)(F)F)CC2)CC1 ZINC000270830887 1434779315 /nfs/dbraw/zinc/77/93/15/1434779315.db2.gz CQVNYOXHNLEOFO-FQEVSTJZSA-N 2 1 399.501 3.229 20 0 GGADMP CC(C)[NH+]1CCN(C2CC[NH+](C[C@@H](O)c3ccccc3C(F)(F)F)CC2)CC1 ZINC000270830890 1434779359 /nfs/dbraw/zinc/77/93/59/1434779359.db2.gz CQVNYOXHNLEOFO-HXUWFJFHSA-N 2 1 399.501 3.229 20 0 GGADMP CC[N@H+](Cc1ccncc1)[C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000270963652 1434791540 /nfs/dbraw/zinc/79/15/40/1434791540.db2.gz ARVDPWBUFLLGLT-IBGZPJMESA-N 2 1 380.536 3.073 20 0 GGADMP CC[N@@H+](Cc1ccncc1)[C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000270963652 1434791542 /nfs/dbraw/zinc/79/15/42/1434791542.db2.gz ARVDPWBUFLLGLT-IBGZPJMESA-N 2 1 380.536 3.073 20 0 GGADMP CC(C)[NH+]1CCC(N2CC[NH+](Cc3ccc(Oc4cnccn4)cc3)CC2)CC1 ZINC000271237018 1434810066 /nfs/dbraw/zinc/81/00/66/1434810066.db2.gz WXGVXNZNTMQOCS-UHFFFAOYSA-N 2 1 395.551 3.259 20 0 GGADMP C[NH+](CCCCCCCC[N@H+](C)CCc1cnccn1)CCc1cnccn1 ZINC000271288623 1434813325 /nfs/dbraw/zinc/81/33/25/1434813325.db2.gz BRYZFQPUQMGJSR-UHFFFAOYSA-N 2 1 384.572 3.256 20 0 GGADMP C[C@@H](C[NH+]1CC[C@H](C)[C@H](n2ccnc2)C1)C[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000271288631 1434813439 /nfs/dbraw/zinc/81/34/39/1434813439.db2.gz MDPNOPJLMFCCMR-KGWSWXIGSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@H](C[NH+]1CC[C@H](C)[C@@H](n2ccnc2)C1)C[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271288631 1434813441 /nfs/dbraw/zinc/81/34/41/1434813441.db2.gz MDPNOPJLMFCCMR-KGWSWXIGSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@H](C[NH+]1CC[C@H](C)[C@@H](n2ccnc2)C1)C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271288631 1434813442 /nfs/dbraw/zinc/81/34/42/1434813442.db2.gz MDPNOPJLMFCCMR-KGWSWXIGSA-N 2 1 384.572 3.182 20 0 GGADMP CC(C)[NH+]1CCN(C2CC[NH+](CCOc3ccc(F)cc3Cl)CC2)CC1 ZINC000271438765 1434824756 /nfs/dbraw/zinc/82/47/56/1434824756.db2.gz UZLKXCREVZVSCC-UHFFFAOYSA-N 2 1 383.939 3.348 20 0 GGADMP C[C@H]1C[C@H]([NH2+]CCNC(=O)c2c(F)cccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000271470501 1434827365 /nfs/dbraw/zinc/82/73/65/1434827365.db2.gz LUYKONXWGUVUIK-FUHWJXTLSA-N 2 1 387.474 3.337 20 0 GGADMP C[C@H]1C[C@H]([NH2+]CCNC(=O)c2c(F)cccc2F)CC[N@H+]1Cc1ccccc1 ZINC000271470501 1434827367 /nfs/dbraw/zinc/82/73/67/1434827367.db2.gz LUYKONXWGUVUIK-FUHWJXTLSA-N 2 1 387.474 3.337 20 0 GGADMP Cc1c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cnn1-c1ccc(F)cc1 ZINC000271503969 1434830014 /nfs/dbraw/zinc/83/00/14/1434830014.db2.gz MKTZCFZZOZPMFY-RXYZOABWSA-N 2 1 386.515 3.348 20 0 GGADMP COc1cc(OC)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc1Cl ZINC000271515236 1434831017 /nfs/dbraw/zinc/83/10/17/1434831017.db2.gz OLYQTYLWKFSFPR-DOPJRALCSA-N 2 1 382.932 3.386 20 0 GGADMP C[NH+]1CCN(C(=O)c2ccc(C[NH2+][C@@H]3CCCc4cc(F)ccc43)cc2)CC1 ZINC000271758399 1434848410 /nfs/dbraw/zinc/84/84/10/1434848410.db2.gz ZBVKHUMXNQYQPF-JOCHJYFZSA-N 2 1 381.495 3.381 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc(S(N)(=O)=O)c2)c1 ZINC000271866130 1434855757 /nfs/dbraw/zinc/85/57/57/1434855757.db2.gz PCBPMZOCROYTOJ-INIZCTEOSA-N 2 1 375.538 3.025 20 0 GGADMP COc1ccc(C[N@H+](C)C2CCN(Cc3[nH+]cc(C)c(OC)c3C)CC2)nc1 ZINC000272031362 1434867518 /nfs/dbraw/zinc/86/75/18/1434867518.db2.gz NAGBJVNOWLIOQW-UHFFFAOYSA-N 2 1 384.524 3.207 20 0 GGADMP COc1ccc(C[N@@H+](C)C2CCN(Cc3[nH+]cc(C)c(OC)c3C)CC2)nc1 ZINC000272031362 1434867519 /nfs/dbraw/zinc/86/75/19/1434867519.db2.gz NAGBJVNOWLIOQW-UHFFFAOYSA-N 2 1 384.524 3.207 20 0 GGADMP C[C@H]([NH2+][C@@H]1CCCN(CC(F)(F)F)C1=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272160664 1434875481 /nfs/dbraw/zinc/87/54/81/1434875481.db2.gz DMBSQJVDVIMLFY-CGTJXYLNSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@H]([NH2+][C@H]1CCCN(CC(F)(F)F)C1=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272160671 1434875563 /nfs/dbraw/zinc/87/55/63/1434875563.db2.gz DMBSQJVDVIMLFY-SZMVWBNQSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@@H](NC(=O)NC1CC[NH+](CC2CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272207994 1434878225 /nfs/dbraw/zinc/87/82/25/1434878225.db2.gz PRRMXHIEDQYANJ-NQIIRXRSSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@H](NC(=O)NC1CC[NH+](C(C)(C)C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272212415 1434878360 /nfs/dbraw/zinc/87/83/60/1434878360.db2.gz QJJNJXTXVZUVQT-ICSRJNTNSA-N 2 1 386.584 3.459 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000272277144 1434883626 /nfs/dbraw/zinc/88/36/26/1434883626.db2.gz FBFGRKNXFGFLGI-BAGYTPMASA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000272277144 1434883627 /nfs/dbraw/zinc/88/36/27/1434883627.db2.gz FBFGRKNXFGFLGI-BAGYTPMASA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000272277144 1434883628 /nfs/dbraw/zinc/88/36/28/1434883628.db2.gz FBFGRKNXFGFLGI-BAGYTPMASA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H]([NH2+]C1CCN(C(=O)c2ccoc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272307544 1434885906 /nfs/dbraw/zinc/88/59/06/1434885906.db2.gz IDQGIOIDJWCVLW-AZUAARDMSA-N 2 1 381.520 3.384 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(-n2cnnn2)cc1 ZINC000272307456 1434886008 /nfs/dbraw/zinc/88/60/08/1434886008.db2.gz IBIIUPNVMYUCCE-WFXMLNOXSA-N 2 1 376.508 3.224 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H]([NH+]2CCCCC2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272305638 1434886034 /nfs/dbraw/zinc/88/60/34/1434886034.db2.gz JTFAGWACWDNWID-NNWRFLSQSA-N 2 1 384.568 3.167 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272394424 1434893468 /nfs/dbraw/zinc/89/34/68/1434893468.db2.gz WMELEKPTZBBDGO-LVCYWYKZSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272394424 1434893469 /nfs/dbraw/zinc/89/34/69/1434893469.db2.gz WMELEKPTZBBDGO-LVCYWYKZSA-N 2 1 383.540 3.037 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272400182 1434893898 /nfs/dbraw/zinc/89/38/98/1434893898.db2.gz YSPHCUZGOQVKFJ-PMOQBDJRSA-N 2 1 398.595 3.270 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000272447868 1434897099 /nfs/dbraw/zinc/89/70/99/1434897099.db2.gz PENYTFWLAHGNQF-OAQYLSRUSA-N 2 1 383.517 3.283 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272470376 1434898507 /nfs/dbraw/zinc/89/85/07/1434898507.db2.gz IFPXLWIKYIOWKK-ILWGZMRPSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272470386 1434898511 /nfs/dbraw/zinc/89/85/11/1434898511.db2.gz IFPXLWIKYIOWKK-NNWRFLSQSA-N 2 1 384.568 3.024 20 0 GGADMP C[N@H+]1CC[C@H]2CCN(C(=O)NC3CC[NH+](Cc4ccc(Cl)cc4)CC3)[C@H]2C1 ZINC000272472532 1434898721 /nfs/dbraw/zinc/89/87/21/1434898721.db2.gz QKWHTNRMAPFDQS-PXNSSMCTSA-N 2 1 390.959 3.040 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H]2C[C@H](NC(=O)OC(C)(C)C)c3ccccc32)CC1 ZINC000272508457 1434901831 /nfs/dbraw/zinc/90/18/31/1434901831.db2.gz FWEYALOVFFIKFP-UXHICEINSA-N 2 1 389.540 3.398 20 0 GGADMP C[C@@H](NC(=O)N1CCC(CC[NH+](C)C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272543428 1434906081 /nfs/dbraw/zinc/90/60/81/1434906081.db2.gz QDTYTHULIFLKAY-KNQAVFIVSA-N 2 1 386.584 3.270 20 0 GGADMP C[N@H+]1CC=C(C[NH2+][C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000272557434 1434907592 /nfs/dbraw/zinc/90/75/92/1434907592.db2.gz DPVIQJFHKLLOTD-NRFANRHFSA-N 2 1 388.508 3.170 20 0 GGADMP C[N@@H+]1CC=C(C[NH2+][C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000272557434 1434907594 /nfs/dbraw/zinc/90/75/94/1434907594.db2.gz DPVIQJFHKLLOTD-NRFANRHFSA-N 2 1 388.508 3.170 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)cc1)[NH+]1CCOCC1 ZINC000272564739 1434908372 /nfs/dbraw/zinc/90/83/72/1434908372.db2.gz KHBGWIYSMHSEGE-ROUUACIJSA-N 2 1 388.556 3.274 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000272569581 1434908752 /nfs/dbraw/zinc/90/87/52/1434908752.db2.gz SWJJUWZIMRMVHY-CTNGQTDRSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000272569590 1434908852 /nfs/dbraw/zinc/90/88/52/1434908852.db2.gz SWJJUWZIMRMVHY-PZJWPPBQSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@H]2C[NH+](C)CC[C@H]21 ZINC000272579356 1434910444 /nfs/dbraw/zinc/91/04/44/1434910444.db2.gz MGKNYCNIVWVGLJ-RYFAJOAYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21 ZINC000272579356 1434910446 /nfs/dbraw/zinc/91/04/46/1434910446.db2.gz MGKNYCNIVWVGLJ-RYFAJOAYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21 ZINC000272579356 1434910448 /nfs/dbraw/zinc/91/04/48/1434910448.db2.gz MGKNYCNIVWVGLJ-RYFAJOAYSA-N 2 1 384.568 3.023 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[NH+](C)C[C@H]21 ZINC000272610116 1434914631 /nfs/dbraw/zinc/91/46/31/1434914631.db2.gz RPDDLYXGGRGKBJ-PGRDOPGGSA-N 2 1 396.535 3.147 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[NH+](C)C[C@H]21 ZINC000272610116 1434914635 /nfs/dbraw/zinc/91/46/35/1434914635.db2.gz RPDDLYXGGRGKBJ-PGRDOPGGSA-N 2 1 396.535 3.147 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[N@H+](C)C[C@H]21 ZINC000272610116 1434914637 /nfs/dbraw/zinc/91/46/37/1434914637.db2.gz RPDDLYXGGRGKBJ-PGRDOPGGSA-N 2 1 396.535 3.147 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[N@@H+](C)C[C@H]21 ZINC000272610116 1434914640 /nfs/dbraw/zinc/91/46/40/1434914640.db2.gz RPDDLYXGGRGKBJ-PGRDOPGGSA-N 2 1 396.535 3.147 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(Cn2cncn2)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272668509 1434921136 /nfs/dbraw/zinc/92/11/36/1434921136.db2.gz OSHQSZFYVHHGTR-WMZHIEFXSA-N 2 1 375.520 3.327 20 0 GGADMP C[C@H](NC(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1)C1=CC[NH+](C)CC1 ZINC000272707860 1434924754 /nfs/dbraw/zinc/92/47/54/1434924754.db2.gz HBYRIDGYAKIMMT-SFHVURJKSA-N 2 1 396.535 3.361 20 0 GGADMP C[C@H](NC(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1)C1=CC[NH+](C)CC1 ZINC000272707860 1434924756 /nfs/dbraw/zinc/92/47/56/1434924756.db2.gz HBYRIDGYAKIMMT-SFHVURJKSA-N 2 1 396.535 3.361 20 0 GGADMP C[C@H](NC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1)C1=CC[N@H+](C)CC1 ZINC000272707860 1434924758 /nfs/dbraw/zinc/92/47/58/1434924758.db2.gz HBYRIDGYAKIMMT-SFHVURJKSA-N 2 1 396.535 3.361 20 0 GGADMP C[C@H](NC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1)C1=CC[N@@H+](C)CC1 ZINC000272707860 1434924761 /nfs/dbraw/zinc/92/47/61/1434924761.db2.gz HBYRIDGYAKIMMT-SFHVURJKSA-N 2 1 396.535 3.361 20 0 GGADMP C[C@@H](NC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)C1=CC[N@@H+](C)CC1 ZINC000272708750 1434924998 /nfs/dbraw/zinc/92/49/98/1434924998.db2.gz JZZFGPSPDYORDP-QGZVFWFLSA-N 2 1 388.581 3.050 20 0 GGADMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]C1CCN(c2ccccc2)CC1 ZINC000272794230 1434931494 /nfs/dbraw/zinc/93/14/94/1434931494.db2.gz YICIHTWMAIFITJ-DEOSSOPVSA-N 2 1 379.548 3.402 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccsc1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000272889601 1434938986 /nfs/dbraw/zinc/93/89/86/1434938986.db2.gz YZWBOGPJGQKCOS-FRQCXROJSA-N 2 1 378.586 3.303 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1)C1=CC[NH+](C)CC1 ZINC000272963374 1434944704 /nfs/dbraw/zinc/94/47/04/1434944704.db2.gz NRGXXKXVEKXJSB-VJBMBRPKSA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)C1=CC[N@H+](C)CC1 ZINC000272963374 1434944707 /nfs/dbraw/zinc/94/47/07/1434944707.db2.gz NRGXXKXVEKXJSB-VJBMBRPKSA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)C1=CC[N@@H+](C)CC1 ZINC000272963374 1434944709 /nfs/dbraw/zinc/94/47/09/1434944709.db2.gz NRGXXKXVEKXJSB-VJBMBRPKSA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1=CC[NH+](C)CC1 ZINC000272986310 1434946859 /nfs/dbraw/zinc/94/68/59/1434946859.db2.gz PONFUFSWKIAYQC-IPJJNNNSSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1)C1=CC[N@H+](C)CC1 ZINC000272986310 1434946861 /nfs/dbraw/zinc/94/68/61/1434946861.db2.gz PONFUFSWKIAYQC-IPJJNNNSSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1)C1=CC[N@@H+](C)CC1 ZINC000272986310 1434946865 /nfs/dbraw/zinc/94/68/65/1434946865.db2.gz PONFUFSWKIAYQC-IPJJNNNSSA-N 2 1 384.568 3.331 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)N[C@H](C)C1=CC[NH+](C)CC1 ZINC000272994100 1434947875 /nfs/dbraw/zinc/94/78/75/1434947875.db2.gz QKBKVZATCHXSDA-CTNGQTDRSA-N 2 1 384.568 3.190 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@H](C)C1=CC[N@H+](C)CC1 ZINC000272994100 1434947878 /nfs/dbraw/zinc/94/78/78/1434947878.db2.gz QKBKVZATCHXSDA-CTNGQTDRSA-N 2 1 384.568 3.190 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@H](C)C1=CC[N@@H+](C)CC1 ZINC000272994100 1434947883 /nfs/dbraw/zinc/94/78/83/1434947883.db2.gz QKBKVZATCHXSDA-CTNGQTDRSA-N 2 1 384.568 3.190 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2OCC(=O)OC)[C@H](C)C1 ZINC000273128608 1434964659 /nfs/dbraw/zinc/96/46/59/1434964659.db2.gz ARYMEJSUXQHBOL-HBFSDRIKSA-N 2 1 392.540 3.026 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2OCC(=O)OC)[C@H](C)C1 ZINC000273128608 1434964663 /nfs/dbraw/zinc/96/46/63/1434964663.db2.gz ARYMEJSUXQHBOL-HBFSDRIKSA-N 2 1 392.540 3.026 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCC[C@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000273368899 1434983735 /nfs/dbraw/zinc/98/37/35/1434983735.db2.gz FROOIUXNJQMSLJ-VQTJNVASSA-N 2 1 375.538 3.265 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCC[C@@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000273368896 1434983858 /nfs/dbraw/zinc/98/38/58/1434983858.db2.gz FROOIUXNJQMSLJ-UXHICEINSA-N 2 1 375.538 3.265 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H](Cc1ccccc1)C(N)=O ZINC000273371396 1434984065 /nfs/dbraw/zinc/98/40/65/1434984065.db2.gz FETKFOXOXZEFDU-JOCHJYFZSA-N 2 1 377.488 3.098 20 0 GGADMP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000273410915 1434987100 /nfs/dbraw/zinc/98/71/00/1434987100.db2.gz ISRSMJDSHAIJKZ-KNKQGSTJSA-N 2 1 386.584 3.411 20 0 GGADMP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000273410927 1434987112 /nfs/dbraw/zinc/98/71/12/1434987112.db2.gz ISRSMJDSHAIJKZ-XQBPLPMBSA-N 2 1 386.584 3.411 20 0 GGADMP CC(=O)c1cccc(OC[C@H](O)C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000274784945 1435092326 /nfs/dbraw/zinc/09/23/26/1435092326.db2.gz AQUHYMPEIDBYHM-KUWBRRTOSA-N 2 1 396.531 3.129 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NC[C@H](C)c2ccccc2)[C@H](C)C1 ZINC000274821176 1435095445 /nfs/dbraw/zinc/09/54/45/1435095445.db2.gz GXTBTBKFUKNMCY-HIUFNZKISA-N 2 1 389.584 3.021 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NC[C@H](C)c2ccccc2)[C@H](C)C1 ZINC000274821176 1435095447 /nfs/dbraw/zinc/09/54/47/1435095447.db2.gz GXTBTBKFUKNMCY-HIUFNZKISA-N 2 1 389.584 3.021 20 0 GGADMP CC(C)[NH+]1CCN(C2CC[NH+](C[C@@H](O)c3ccc(F)cc3Cl)CC2)CC1 ZINC000274844523 1435097445 /nfs/dbraw/zinc/09/74/45/1435097445.db2.gz PHFIGSGNXHYCPV-HXUWFJFHSA-N 2 1 383.939 3.003 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000274854451 1435098074 /nfs/dbraw/zinc/09/80/74/1435098074.db2.gz RXDVFZRFYRWGEQ-PTUXOGIPSA-N 2 1 398.547 3.073 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N(C)[C@@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000274865924 1435099184 /nfs/dbraw/zinc/09/91/84/1435099184.db2.gz UFWWNZNNOQZOQK-LQWHRVPQSA-N 2 1 393.547 3.072 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N(C)[C@@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000274865924 1435099186 /nfs/dbraw/zinc/09/91/86/1435099186.db2.gz UFWWNZNNOQZOQK-LQWHRVPQSA-N 2 1 393.547 3.072 20 0 GGADMP COc1cc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1OCCO ZINC000274872521 1435100030 /nfs/dbraw/zinc/10/00/30/1435100030.db2.gz FXUYMQCAJHIJRE-NQIIRXRSSA-N 2 1 384.520 3.067 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1Cn1cncn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274894721 1435101487 /nfs/dbraw/zinc/10/14/87/1435101487.db2.gz JZQIFEHTJSAMRW-DENIHFKCSA-N 2 1 375.520 3.327 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1Cn1cncn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274894722 1435101552 /nfs/dbraw/zinc/10/15/52/1435101552.db2.gz JZQIFEHTJSAMRW-KNQAVFIVSA-N 2 1 375.520 3.327 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(CS(C)(=O)=O)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274903692 1435102566 /nfs/dbraw/zinc/10/25/66/1435102566.db2.gz LSBYODIMVDCEFO-XMSQKQJNSA-N 2 1 386.561 3.231 20 0 GGADMP Cn1cncc1[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CCO1 ZINC000275399690 1435136631 /nfs/dbraw/zinc/13/66/31/1435136631.db2.gz CJSMYNBCYKSRNQ-FPQOSCNCSA-N 2 1 380.536 3.140 20 0 GGADMP CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000275532391 1435146204 /nfs/dbraw/zinc/14/62/04/1435146204.db2.gz LYUIFJZCXPHMQF-XIFQGDJWSA-N 2 1 394.563 3.481 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](CCn2cncn2)c2ccc(C)cc2)cn1 ZINC000275662981 1435157710 /nfs/dbraw/zinc/15/77/10/1435157710.db2.gz BPNWUGHGJXTERZ-NRFANRHFSA-N 2 1 387.491 3.397 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](CCn2cncn2)c2ccc(C)cc2)cn1 ZINC000275662984 1435157775 /nfs/dbraw/zinc/15/77/75/1435157775.db2.gz BPNWUGHGJXTERZ-OAQYLSRUSA-N 2 1 387.491 3.397 20 0 GGADMP C[NH+]1CCN(C(=O)c2ccc(C[NH2+][C@@H]3CCC[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000275685679 1435159560 /nfs/dbraw/zinc/15/95/60/1435159560.db2.gz ZVMMFHNVBDOWKU-QZTJIDSGSA-N 2 1 383.458 3.285 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N(CC)c2ccccc2)[C@@H](C)C1 ZINC000276288446 1435202269 /nfs/dbraw/zinc/20/22/69/1435202269.db2.gz VEWMDPBOWWCEPK-ZJOUEHCJSA-N 2 1 375.557 3.155 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N(CC)c2ccccc2)[C@@H](C)C1 ZINC000276288446 1435202273 /nfs/dbraw/zinc/20/22/73/1435202273.db2.gz VEWMDPBOWWCEPK-ZJOUEHCJSA-N 2 1 375.557 3.155 20 0 GGADMP C[C@@H](c1ccc(NC(=O)c2ccc3c(c2)CC[NH2+]CC3)cc1)[NH+]1CCOCC1 ZINC000276671656 1435224202 /nfs/dbraw/zinc/22/42/02/1435224202.db2.gz RUPTZXWLJWNBHM-KRWDZBQOSA-N 2 1 379.504 3.020 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[N@@H+]2CCC[C@H]2C(N)=O)no1)[NH+]1CCCCCC1 ZINC000276917687 1435242940 /nfs/dbraw/zinc/24/29/40/1435242940.db2.gz LWABTHBLUYUGQB-LPHOPBHVSA-N 2 1 397.523 3.123 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[N@H+]2CCC[C@H]2C(N)=O)no1)[NH+]1CCCCCC1 ZINC000276917687 1435242943 /nfs/dbraw/zinc/24/29/43/1435242943.db2.gz LWABTHBLUYUGQB-LPHOPBHVSA-N 2 1 397.523 3.123 20 0 GGADMP C[C@@H](c1nc(-c2ccc(N3CCC[N@@H+](C)CC3)nc2)no1)[NH+]1CCCCCC1 ZINC000276925865 1435243525 /nfs/dbraw/zinc/24/35/25/1435243525.db2.gz NGZDWMBVODQFOU-KRWDZBQOSA-N 2 1 384.528 3.211 20 0 GGADMP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C4CCN(c5cccnn5)CC4)[C@H]3C2)cc1 ZINC000277032551 1435254233 /nfs/dbraw/zinc/25/42/33/1435254233.db2.gz FKSKHDDEQRLMQU-PMVMPFDFSA-N 2 1 391.563 3.336 20 0 GGADMP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]C4CCN(c5cccnn5)CC4)[C@H]3C2)cc1 ZINC000277032546 1435254267 /nfs/dbraw/zinc/25/42/67/1435254267.db2.gz FKSKHDDEQRLMQU-ACIOBRDBSA-N 2 1 391.563 3.336 20 0 GGADMP COc1cc(NC(=O)CC[N@H+]2CCC[C@@H]([NH+](C)C)CC2)c(OC)cc1Cl ZINC000277036060 1435254826 /nfs/dbraw/zinc/25/48/26/1435254826.db2.gz BMRTXGODVROUNO-CQSZACIVSA-N 2 1 383.920 3.102 20 0 GGADMP COc1cc2c(cc1OC)C[N@H+](Cc1ccccc1NC(=O)[C@@H](C)[C@@H](C)[NH3+])CC2 ZINC000277111758 1435263000 /nfs/dbraw/zinc/26/30/00/1435263000.db2.gz VOEIVRAJZKPRTA-JKSUJKDBSA-N 2 1 397.519 3.184 20 0 GGADMP COc1cc2c(cc1OC)C[N@@H+](Cc1ccccc1NC(=O)[C@@H](C)[C@@H](C)[NH3+])CC2 ZINC000277111758 1435263002 /nfs/dbraw/zinc/26/30/02/1435263002.db2.gz VOEIVRAJZKPRTA-JKSUJKDBSA-N 2 1 397.519 3.184 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)NCc1ccccc1COCC ZINC000277266362 1435286810 /nfs/dbraw/zinc/28/68/10/1435286810.db2.gz RIDUGFIASAECFE-UHFFFAOYSA-N 2 1 386.540 3.010 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)NCc1ccccc1COCC ZINC000277266362 1435286813 /nfs/dbraw/zinc/28/68/13/1435286813.db2.gz RIDUGFIASAECFE-UHFFFAOYSA-N 2 1 386.540 3.010 20 0 GGADMP COc1ccc(CC[C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)cc1O ZINC000277288978 1435289912 /nfs/dbraw/zinc/28/99/12/1435289912.db2.gz TYHVTLGXCHPJQI-OAHLLOKOSA-N 2 1 384.524 3.387 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000277364740 1435298988 /nfs/dbraw/zinc/29/89/88/1435298988.db2.gz UZOKOXUAUXVUAV-UYAOXDASSA-N 2 1 397.485 3.384 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc(-c3nnc(C[NH3+])[nH]3)cc2)cc1 ZINC000277550541 1435312264 /nfs/dbraw/zinc/31/22/64/1435312264.db2.gz YRHJIIJMPULXKW-UHFFFAOYSA-N 2 1 392.507 3.415 20 0 GGADMP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C[NH3+])n3)cc2)cc1 ZINC000277550541 1435312268 /nfs/dbraw/zinc/31/22/68/1435312268.db2.gz YRHJIIJMPULXKW-UHFFFAOYSA-N 2 1 392.507 3.415 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C[NH3+])n3)cc2)cc1 ZINC000277550541 1435312270 /nfs/dbraw/zinc/31/22/70/1435312270.db2.gz YRHJIIJMPULXKW-UHFFFAOYSA-N 2 1 392.507 3.415 20 0 GGADMP O=C(NCC1CC[NH+](C2CC2)CC1)Nc1ccccc1C[NH+]1CCSCC1 ZINC000277694973 1435322457 /nfs/dbraw/zinc/32/24/57/1435322457.db2.gz KGCYUZLARMETAB-UHFFFAOYSA-N 2 1 388.581 3.231 20 0 GGADMP COc1cc(C[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)ccc1OCc1ccncc1 ZINC000278059260 1435354923 /nfs/dbraw/zinc/35/49/23/1435354923.db2.gz YQFAAZHSIKSQOS-LJQANCHMSA-N 2 1 399.535 3.260 20 0 GGADMP C[C@@H](NC(=O)NCC1CC[NH+](C2CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000278289477 1435376770 /nfs/dbraw/zinc/37/67/70/1435376770.db2.gz ZPGQHJCAFXBHFZ-NQIIRXRSSA-N 2 1 384.568 3.071 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1Cn1cccn1 ZINC000278371591 1435384709 /nfs/dbraw/zinc/38/47/09/1435384709.db2.gz BZGHCNPNMKHCLI-RBUKOAKNSA-N 2 1 386.540 3.092 20 0 GGADMP Cn1nccc1N1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000278506207 1435395789 /nfs/dbraw/zinc/39/57/89/1435395789.db2.gz QXSGYZRRQOKWSR-YUMYIRISSA-N 2 1 379.552 3.174 20 0 GGADMP C[C@@H](C(=O)N1CCc2ccccc2C1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278806669 1435425614 /nfs/dbraw/zinc/42/56/14/1435425614.db2.gz GGNYJXRVFDYWNX-SFHVURJKSA-N 2 1 392.547 3.372 20 0 GGADMP CC[N@@H+](CCCC1CC[NH+](Cc2ccnc(N)c2)CC1)Cc1ccnc(N)c1 ZINC000278819127 1435426673 /nfs/dbraw/zinc/42/66/73/1435426673.db2.gz IDWDGCRHRRKFNY-UHFFFAOYSA-N 2 1 382.556 3.155 20 0 GGADMP C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000278896647 1435437100 /nfs/dbraw/zinc/43/71/00/1435437100.db2.gz RAHXPGDBXICRQO-HXUWFJFHSA-N 2 1 399.579 3.000 20 0 GGADMP Cc1c(-c2cc(C[NH+]3CCC(c4[nH+]cc5n4CCCC5)CC3)on2)cnn1C ZINC000278937782 1435442049 /nfs/dbraw/zinc/44/20/49/1435442049.db2.gz UCUQRKZRJILCMN-UHFFFAOYSA-N 2 1 380.496 3.296 20 0 GGADMP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2CCc3[nH+]ccn3C2)cc1 ZINC000278943229 1435443057 /nfs/dbraw/zinc/44/30/57/1435443057.db2.gz KLTZIXKTILLHEV-DFQSSKMNSA-N 2 1 387.549 3.129 20 0 GGADMP CCCN(C(=O)c1cc([C@@H]2CC[NH2+]C2)n[nH]1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000279104959 1435460957 /nfs/dbraw/zinc/46/09/57/1435460957.db2.gz XRIXHNPNOULYBH-UXHICEINSA-N 2 1 395.551 3.003 20 0 GGADMP Cc1nc[nH]c1CC(=O)N(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000279426838 1435498136 /nfs/dbraw/zinc/49/81/36/1435498136.db2.gz LYRYLNFKMGMQDS-QGZVFWFLSA-N 2 1 394.441 3.174 20 0 GGADMP COc1cc2c(cc1OC)[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)CC2 ZINC000279961699 1435570016 /nfs/dbraw/zinc/57/00/16/1435570016.db2.gz CIDRXHOIBVXLHC-IRLDBZIGSA-N 2 1 396.531 3.438 20 0 GGADMP COc1cc2c(cc1OC)[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)CC2 ZINC000280256104 1435619446 /nfs/dbraw/zinc/61/94/46/1435619446.db2.gz WWDDCNIXYVUAHP-NRFANRHFSA-N 2 1 382.504 3.313 20 0 GGADMP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cn1 ZINC000280542972 1435676782 /nfs/dbraw/zinc/67/67/82/1435676782.db2.gz DBDHXBCVGCWWOV-FCHUYYIVSA-N 2 1 380.536 3.317 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(N(C)c4ccccc4)nc3)C2)CC1 ZINC000280619230 1435690919 /nfs/dbraw/zinc/69/09/19/1435690919.db2.gz BKYLDNHMYMRQJV-QFIPXVFZSA-N 2 1 379.552 3.061 20 0 GGADMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280908494 1435740347 /nfs/dbraw/zinc/74/03/47/1435740347.db2.gz QGEHWCQEBPGVPY-SUMWQHHRSA-N 2 1 398.960 3.130 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H](c3cccnc3)C3CCC3)c2)C1 ZINC000280923680 1435742312 /nfs/dbraw/zinc/74/23/12/1435742312.db2.gz RFTQNJXVYLGTLR-DHIUTWEWSA-N 2 1 392.547 3.410 20 0 GGADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280945196 1435745719 /nfs/dbraw/zinc/74/57/19/1435745719.db2.gz SSUNPAAMTDHDGU-QGZVFWFLSA-N 2 1 398.960 3.274 20 0 GGADMP COCCC(=O)N1CCC([NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000281021645 1435757905 /nfs/dbraw/zinc/75/79/05/1435757905.db2.gz OJGYQXCANYMSEY-UHFFFAOYSA-N 2 1 387.568 3.047 20 0 GGADMP C[NH+](C)Cc1ccc(NC(=O)C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)cc1 ZINC000281453335 1435809557 /nfs/dbraw/zinc/80/95/57/1435809557.db2.gz NFHVKWYCTFJWRS-UHFFFAOYSA-N 2 1 388.899 3.040 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000281782401 1435821840 /nfs/dbraw/zinc/82/18/40/1435821840.db2.gz MPKCAMLWKUYROY-QFIPXVFZSA-N 2 1 399.583 3.142 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000281782399 1435821847 /nfs/dbraw/zinc/82/18/47/1435821847.db2.gz MPKCAMLWKUYROY-JOCHJYFZSA-N 2 1 399.583 3.142 20 0 GGADMP COCC[C@H]1CCC[C@H]1[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000282149930 1435836501 /nfs/dbraw/zinc/83/65/01/1435836501.db2.gz LBWQBPHGTAXGJZ-NFBKMPQASA-N 2 1 390.568 3.471 20 0 GGADMP Cn1cc(-c2ccc(C[NH2+]Cc3ccccc3C[N@H+]3CCC[C@@H]3CO)s2)cn1 ZINC000282156135 1435836670 /nfs/dbraw/zinc/83/66/70/1435836670.db2.gz CJVAJDMQVBCFQK-HXUWFJFHSA-N 2 1 396.560 3.395 20 0 GGADMP O=C(c1ccccc1)N1CC[C@@H](C[N@@H+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC000282411999 1435846277 /nfs/dbraw/zinc/84/62/77/1435846277.db2.gz GALFJZPBXDDOBN-OEMFJLHTSA-N 2 1 389.543 3.213 20 0 GGADMP O=C(c1ccccc1)N1CC[C@@H](C[NH+]2C[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC000282411999 1435846278 /nfs/dbraw/zinc/84/62/78/1435846278.db2.gz GALFJZPBXDDOBN-OEMFJLHTSA-N 2 1 389.543 3.213 20 0 GGADMP O=C(c1ccccc1)N1CC[C@@H](C[NH+]2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC000282411999 1435846279 /nfs/dbraw/zinc/84/62/79/1435846279.db2.gz GALFJZPBXDDOBN-OEMFJLHTSA-N 2 1 389.543 3.213 20 0 GGADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1CC[NH+](C2CC2)C1 ZINC000282668548 1435855746 /nfs/dbraw/zinc/85/57/46/1435855746.db2.gz GTWPNJIBLSFGQE-TZIWHRDSSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[NH+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000282668548 1435855747 /nfs/dbraw/zinc/85/57/47/1435855747.db2.gz GTWPNJIBLSFGQE-TZIWHRDSSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[NH+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000282668548 1435855748 /nfs/dbraw/zinc/85/57/48/1435855748.db2.gz GTWPNJIBLSFGQE-TZIWHRDSSA-N 2 1 384.568 3.071 20 0 GGADMP COCCCn1nccc1C[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000282675101 1435856110 /nfs/dbraw/zinc/85/61/10/1435856110.db2.gz NWICTVGGPUKAPS-UHFFFAOYSA-N 2 1 382.508 3.434 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)N2CCC[C@H](C[NH+]3CCOCC3)C2)cc1 ZINC000282740660 1435858600 /nfs/dbraw/zinc/85/86/00/1435858600.db2.gz LWGGXMJACHCKCN-OAQYLSRUSA-N 2 1 387.568 3.103 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)CC1(C)C ZINC000282998253 1435869675 /nfs/dbraw/zinc/86/96/75/1435869675.db2.gz QWYVNRFNBRMGNW-HMXCVIKNSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@H]1N(C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000282998253 1435869676 /nfs/dbraw/zinc/86/96/76/1435869676.db2.gz QWYVNRFNBRMGNW-HMXCVIKNSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@H]1N(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282998253 1435869677 /nfs/dbraw/zinc/86/96/77/1435869677.db2.gz QWYVNRFNBRMGNW-HMXCVIKNSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[NH2+]C1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000283098700 1435874381 /nfs/dbraw/zinc/87/43/81/1435874381.db2.gz ZQUPLZOCMSVFDS-OAQYLSRUSA-N 2 1 386.584 3.459 20 0 GGADMP CCOC(=O)[C@H]1CC[C@H]([NH2+]CCCCN2CC[NH+](CC)CC2)c2ccccc21 ZINC000283167098 1435877619 /nfs/dbraw/zinc/87/76/19/1435877619.db2.gz IXNXUQPMDIGDBX-VXKWHMMOSA-N 2 1 387.568 3.176 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)c2ccccc21 ZINC000283189473 1435878472 /nfs/dbraw/zinc/87/84/72/1435878472.db2.gz KLKHDXBMGSRYEZ-RTWAWAEBSA-N 2 1 386.536 3.403 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 ZINC000283320070 1435884224 /nfs/dbraw/zinc/88/42/24/1435884224.db2.gz OQRBHNNLEYGGCX-FCHUYYIVSA-N 2 1 377.548 3.394 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 ZINC000283320080 1435884239 /nfs/dbraw/zinc/88/42/39/1435884239.db2.gz OQRBHNNLEYGGCX-VXKWHMMOSA-N 2 1 377.548 3.394 20 0 GGADMP O[C@@H]1[C@H](C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)CCC12CCOCC2 ZINC000283468542 1435891195 /nfs/dbraw/zinc/89/11/95/1435891195.db2.gz WAVSNMQABCCXSI-VJFDXUIRSA-N 2 1 384.564 3.054 20 0 GGADMP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H](C(=O)NC3CC3)c3ccccc3)cc2)CC1 ZINC000283924353 1435953890 /nfs/dbraw/zinc/95/38/90/1435953890.db2.gz DWHDSZBBVHUGNF-QHCPKHFHSA-N 2 1 393.531 3.269 20 0 GGADMP CC(C)[C@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)N1CC[NH+](C)CC1 ZINC000284076472 1435985785 /nfs/dbraw/zinc/98/57/85/1435985785.db2.gz LOOBLYRTJANVJM-VHYCJAOWSA-N 3 1 386.628 3.291 20 0 GGADMP CC(C)[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)N1CCN(C)CC1 ZINC000284076472 1435985800 /nfs/dbraw/zinc/98/58/00/1435985800.db2.gz LOOBLYRTJANVJM-VHYCJAOWSA-N 2 1 386.628 3.291 20 0 GGADMP CC(C)[C@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)N1CCN(C)CC1 ZINC000284076472 1435985809 /nfs/dbraw/zinc/98/58/09/1435985809.db2.gz LOOBLYRTJANVJM-VHYCJAOWSA-N 2 1 386.628 3.291 20 0 GGADMP CC(C)[C@@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)N1CC[NH+](C)CC1 ZINC000284076467 1435986135 /nfs/dbraw/zinc/98/61/35/1435986135.db2.gz LOOBLYRTJANVJM-KXTRFFEISA-N 3 1 386.628 3.291 20 0 GGADMP CC(C)[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)N1CCN(C)CC1 ZINC000284076467 1435986147 /nfs/dbraw/zinc/98/61/47/1435986147.db2.gz LOOBLYRTJANVJM-KXTRFFEISA-N 2 1 386.628 3.291 20 0 GGADMP CC(C)[C@@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)N1CCN(C)CC1 ZINC000284076467 1435986160 /nfs/dbraw/zinc/98/61/60/1435986160.db2.gz LOOBLYRTJANVJM-KXTRFFEISA-N 2 1 386.628 3.291 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@@H]4[NH2+]CC[C@@H]42)n1)CCCC3)[NH+]1CCCCC1 ZINC001164411261 718875639 /nfs/dbraw/zinc/87/56/39/718875639.db2.gz OZBJAJFHJOTZCQ-IRXDYDNUSA-N 2 1 397.592 3.497 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CC[C@@H]5[NH2+]CC[C@@H]53)n2)CCC4)CC1 ZINC001164410547 718876108 /nfs/dbraw/zinc/87/61/08/718876108.db2.gz CUFDJTBQABQYQK-IRXDYDNUSA-N 2 1 397.592 3.353 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CC[C@@H]5[NH2+]CC[C@H]53)n2)CCC4)CC1 ZINC001164410545 718876142 /nfs/dbraw/zinc/87/61/42/718876142.db2.gz CUFDJTBQABQYQK-DLBZAZTESA-N 2 1 397.592 3.353 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@@H]4[NH2+]CC[C@@H]42)n1)CCCC3)[NH+]1CCCC1 ZINC001164412818 718876164 /nfs/dbraw/zinc/87/61/64/718876164.db2.gz ZSFUZWRSXZDVOD-HOTGVXAUSA-N 2 1 383.565 3.107 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CC[C@H]5[NH2+]CC[C@H]53)n2)CCC4)CC1 ZINC001164410546 718876212 /nfs/dbraw/zinc/87/62/12/718876212.db2.gz CUFDJTBQABQYQK-IAGOWNOFSA-N 2 1 397.592 3.353 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CC[C@@H]5C[C@]5([NH3+])C3)n2)CCC4)CC1 ZINC001164418237 718896262 /nfs/dbraw/zinc/89/62/62/718896262.db2.gz CJEYAHAKAQOOCU-QRQCRPRQSA-N 2 1 397.592 3.339 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CC[C@@H]3C[C@]3([NH3+])C2)n1 ZINC001164422430 718896735 /nfs/dbraw/zinc/89/67/35/718896735.db2.gz VDCXGQDKKBDERP-VFNWGFHPSA-N 2 1 379.533 3.347 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@@H]4[NH2+]C[C@@H]42)n1)CCCC3)[NH+]1CCCC1 ZINC001164447143 719000656 /nfs/dbraw/zinc/00/06/56/719000656.db2.gz AWWIGJJSUCBVLK-HOTGVXAUSA-N 2 1 383.565 3.107 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@H]4[NH2+]C[C@@H]42)n1)CCCC3)[NH+]1CCCCC1 ZINC001164450316 719000797 /nfs/dbraw/zinc/00/07/97/719000797.db2.gz UPOZJMJHLJBVCK-SJORKVTESA-N 2 1 397.592 3.497 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CCC[C@@H]3[NH2+]C[C@@H]32)n1 ZINC001164448266 719001835 /nfs/dbraw/zinc/00/18/35/719001835.db2.gz GQNTVUHDTUNOQP-IRXDYDNUSA-N 2 1 379.533 3.361 20 0 GGADMP Cc1nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc(N2CCCC2)[nH+]1 ZINC001164629169 719058062 /nfs/dbraw/zinc/05/80/62/719058062.db2.gz WHKLCWHORMEUSB-LEWJYISDSA-N 2 1 377.536 3.486 20 0 GGADMP Clc1cc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c2c(n1)C[NH2+]CC2 ZINC001164629899 719093983 /nfs/dbraw/zinc/09/39/83/719093983.db2.gz UCNHHZGWWCFZSM-UWJYYQICSA-N 2 1 382.939 3.482 20 0 GGADMP CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ccc(C[N@H+](C)C3CC3)cn1)CC2 ZINC001164650407 719315933 /nfs/dbraw/zinc/31/59/33/719315933.db2.gz DBFILZCJGVMEJL-UHFFFAOYSA-N 2 1 382.556 3.078 20 0 GGADMP CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ccc(C[N@@H+](C)C3CC3)cn1)CC2 ZINC001164650407 719315936 /nfs/dbraw/zinc/31/59/36/719315936.db2.gz DBFILZCJGVMEJL-UHFFFAOYSA-N 2 1 382.556 3.078 20 0 GGADMP CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncccc1C[NH+]1CCCC1)CC2 ZINC001164655252 719317493 /nfs/dbraw/zinc/31/74/93/719317493.db2.gz VJOXSSQWLKLXAJ-UHFFFAOYSA-N 2 1 382.556 3.079 20 0 GGADMP CC(C)c1cc2c(ncnc2-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)s1 ZINC001164684196 719603375 /nfs/dbraw/zinc/60/33/75/719603375.db2.gz MYUGRXCDFYVNTJ-UHFFFAOYSA-N 2 1 384.553 3.486 20 0 GGADMP CC(C)c1cc2c(ncnc2-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)s1 ZINC001164684196 719603385 /nfs/dbraw/zinc/60/33/85/719603385.db2.gz MYUGRXCDFYVNTJ-UHFFFAOYSA-N 2 1 384.553 3.486 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)Oc2cccnc2Cl)c2c1CC[NH2+]C2 ZINC001164685011 719611912 /nfs/dbraw/zinc/61/19/12/719611912.db2.gz QCNVGPALAJJYFU-UHFFFAOYSA-N 2 1 385.846 3.003 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)Oc2cccnc2Cl)c2c1CC[NH2+]C2 ZINC001164685011 719611917 /nfs/dbraw/zinc/61/19/17/719611917.db2.gz QCNVGPALAJJYFU-UHFFFAOYSA-N 2 1 385.846 3.003 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)c2cnc(Cl)c(F)c2)c2c1CC[NH2+]C2 ZINC001164684848 719619013 /nfs/dbraw/zinc/61/90/13/719619013.db2.gz YAWXDHXCWRTZHE-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)c2cnc(Cl)c(F)c2)c2c1CC[NH2+]C2 ZINC001164684848 719619028 /nfs/dbraw/zinc/61/90/28/719619028.db2.gz YAWXDHXCWRTZHE-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP Cc1sc2nc(C)nc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)c2c1C ZINC001164681230 719621382 /nfs/dbraw/zinc/62/13/82/719621382.db2.gz DRMQFPPADNLVPV-UHFFFAOYSA-N 2 1 384.553 3.288 20 0 GGADMP Cc1sc2nc(C)nc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)c2c1C ZINC001164681230 719621385 /nfs/dbraw/zinc/62/13/85/719621385.db2.gz DRMQFPPADNLVPV-UHFFFAOYSA-N 2 1 384.553 3.288 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nc(Cl)ncc2-c2ccccc2)c2c1CC[NH2+]C2 ZINC001164681652 719622755 /nfs/dbraw/zinc/62/27/55/719622755.db2.gz KNOLHEWZBGIWTK-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nc(Cl)ncc2-c2ccccc2)c2c1CC[NH2+]C2 ZINC001164681652 719622761 /nfs/dbraw/zinc/62/27/61/719622761.db2.gz KNOLHEWZBGIWTK-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2cccc(-c3cccc(Cl)n3)n2)c2c1CC[NH2+]C2 ZINC001164682040 719622784 /nfs/dbraw/zinc/62/27/84/719622784.db2.gz LHAWIWLQXSMIDN-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2cccc(-c3cccc(Cl)n3)n2)c2c1CC[NH2+]C2 ZINC001164682040 719622786 /nfs/dbraw/zinc/62/27/86/719622786.db2.gz LHAWIWLQXSMIDN-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP Cc1cc(Cl)nc(C(F)(F)n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)c1 ZINC001164684821 719627748 /nfs/dbraw/zinc/62/77/48/719627748.db2.gz XVKPANXVUGWCIH-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP Cc1cc(Cl)nc(C(F)(F)n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)c1 ZINC001164684821 719627753 /nfs/dbraw/zinc/62/77/53/719627753.db2.gz XVKPANXVUGWCIH-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP Cc1ccc(-c2ccc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)nn2)cc1 ZINC001164680162 719636442 /nfs/dbraw/zinc/63/64/42/719636442.db2.gz QSHSODXLBLUELD-UHFFFAOYSA-N 2 1 376.508 3.124 20 0 GGADMP Cc1ccc(-c2ccc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)nn2)cc1 ZINC001164680162 719636444 /nfs/dbraw/zinc/63/64/44/719636444.db2.gz QSHSODXLBLUELD-UHFFFAOYSA-N 2 1 376.508 3.124 20 0 GGADMP CC(C)c1ccc2ncnc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)c2c1 ZINC001164680522 719640119 /nfs/dbraw/zinc/64/01/19/719640119.db2.gz UEGQYJNMBOJTGO-UHFFFAOYSA-N 2 1 378.524 3.425 20 0 GGADMP CC(C)c1ccc2ncnc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)c2c1 ZINC001164680522 719640124 /nfs/dbraw/zinc/64/01/24/719640124.db2.gz UEGQYJNMBOJTGO-UHFFFAOYSA-N 2 1 378.524 3.425 20 0 GGADMP COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc3[nH]ccc3c[nH+]1)CC2 ZINC001164710619 720098857 /nfs/dbraw/zinc/09/88/57/720098857.db2.gz KEBJXKBSSDKFBV-FQEVSTJZSA-N 2 1 391.519 3.465 20 0 GGADMP COC[C@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1cc(OC)c3ccccc3[nH+]1)C2 ZINC001164809050 720145749 /nfs/dbraw/zinc/14/57/49/720145749.db2.gz GJBGCZITGCVECV-JPYJTQIMSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(OC)c3ccccc3[nH+]1)C2 ZINC001164809050 720145753 /nfs/dbraw/zinc/14/57/53/720145753.db2.gz GJBGCZITGCVECV-JPYJTQIMSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1cc(OC)c3ccccc3[nH+]1)C2 ZINC001164809051 720146486 /nfs/dbraw/zinc/14/64/86/720146486.db2.gz GJBGCZITGCVECV-MBSDFSHPSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(OC)c3ccccc3[nH+]1)C2 ZINC001164809051 720146502 /nfs/dbraw/zinc/14/65/02/720146502.db2.gz GJBGCZITGCVECV-MBSDFSHPSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1cc3cc(OC)ccc3c[nH+]1)C2 ZINC001164810548 720146987 /nfs/dbraw/zinc/14/69/87/720146987.db2.gz KBVRVWAVVKPXCU-NFBKMPQASA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc3cc(OC)ccc3c[nH+]1)C2 ZINC001164810548 720147001 /nfs/dbraw/zinc/14/70/01/720147001.db2.gz KBVRVWAVVKPXCU-NFBKMPQASA-N 2 1 381.520 3.428 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3nccn3C[C@H](C[NH+](C)C)C2)nc1 ZINC001164735012 720532400 /nfs/dbraw/zinc/53/24/00/720532400.db2.gz MPBGMTOURNUCEH-FPOVZHCZSA-N 2 1 396.583 3.413 20 0 GGADMP Cc1cc2[nH]ccc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)[nH+]1 ZINC001164835521 720555698 /nfs/dbraw/zinc/55/56/98/720555698.db2.gz HQRIIIUGGKJJHI-LVCYWYKZSA-N 2 1 378.524 3.446 20 0 GGADMP CC(C)Oc1cc[nH+]c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164834289 720556260 /nfs/dbraw/zinc/55/62/60/720556260.db2.gz DGZCJYOUKGRDOO-SVFBPWRDSA-N 2 1 383.540 3.443 20 0 GGADMP Cc1nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)cc(N(C)C)[nH+]1 ZINC001164841003 720665812 /nfs/dbraw/zinc/66/58/12/720665812.db2.gz OOWYEBXACKGQNB-HXUWFJFHSA-N 2 1 395.551 3.111 20 0 GGADMP Cc1nc(N(C)C)cc(N2CCC3(C[C@@H]([N@H+](C)Cc4ccccc4)CO3)CC2)[nH+]1 ZINC001164841003 720665818 /nfs/dbraw/zinc/66/58/18/720665818.db2.gz OOWYEBXACKGQNB-HXUWFJFHSA-N 2 1 395.551 3.111 20 0 GGADMP Cc1nc(N(C)C)cc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)[nH+]1 ZINC001164841003 720665827 /nfs/dbraw/zinc/66/58/27/720665827.db2.gz OOWYEBXACKGQNB-HXUWFJFHSA-N 2 1 395.551 3.111 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC2(C[C@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164843226 720669871 /nfs/dbraw/zinc/66/98/71/720669871.db2.gz VPNMVMJAMDVYIA-IBGZPJMESA-N 2 1 391.519 3.228 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164843226 720669880 /nfs/dbraw/zinc/66/98/80/720669880.db2.gz VPNMVMJAMDVYIA-IBGZPJMESA-N 2 1 391.519 3.228 20 0 GGADMP Cc1cc(N2CCCC2)nc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@@H]2C)[nH+]1 ZINC001164858324 720917118 /nfs/dbraw/zinc/91/71/18/720917118.db2.gz MQHSGLUEVKCZPT-KRWDZBQOSA-N 2 1 383.544 3.003 20 0 GGADMP CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ccc(C[NH+]3CCCC3)cn1)[C@H]2C ZINC001164857227 720998494 /nfs/dbraw/zinc/99/84/94/720998494.db2.gz DSSQXJRMYFAOQJ-SFHVURJKSA-N 2 1 382.556 3.295 20 0 GGADMP Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(C)cc(C)[nH+]3)C2)C1 ZINC001164778037 721333517 /nfs/dbraw/zinc/33/35/17/721333517.db2.gz TUKCBSKBBVTQDF-JOCHJYFZSA-N 2 1 384.524 3.422 20 0 GGADMP Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3[nH+]ccc4[nH]ccc43)C2)C1 ZINC001164778562 721335995 /nfs/dbraw/zinc/33/59/95/721335995.db2.gz XKQRGGGYYAJMCK-QFIPXVFZSA-N 2 1 395.507 3.287 20 0 GGADMP Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3[nH+]ccc4[nH]ccc43)C2)C1 ZINC001164778478 721336144 /nfs/dbraw/zinc/33/61/44/721336144.db2.gz XKQRGGGYYAJMCK-JOCHJYFZSA-N 2 1 395.507 3.287 20 0 GGADMP COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1[nH+]ccc3[nH]ccc31)CC2 ZINC001164783516 721451313 /nfs/dbraw/zinc/45/13/13/721451313.db2.gz CEDGIOZBVZKZEB-LJQANCHMSA-N 2 1 398.551 3.297 20 0 GGADMP COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1[nH+]ccc3[nH]ccc31)CC2 ZINC001164783512 721451358 /nfs/dbraw/zinc/45/13/58/721451358.db2.gz CEDGIOZBVZKZEB-IBGZPJMESA-N 2 1 398.551 3.297 20 0 GGADMP COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc3[nH]ccc3c[nH+]1)CC2 ZINC001164790241 721452772 /nfs/dbraw/zinc/45/27/72/721452772.db2.gz XNMJPFDBYVBOQB-HXUWFJFHSA-N 2 1 398.551 3.297 20 0 GGADMP COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(C)c(C)c[nH+]1)CC2 ZINC001164791243 721468709 /nfs/dbraw/zinc/46/87/09/721468709.db2.gz VYKFUTLJBMRKNK-NRFANRHFSA-N 2 1 387.568 3.432 20 0 GGADMP Fc1cccc(O[C@H]2C[C@H]3CN(c4cc(N5CCCC5)cc[nH+]4)CC[N@H+]3C2)c1 ZINC001164906772 721544098 /nfs/dbraw/zinc/54/40/98/721544098.db2.gz LHOVFLXVXYIMRQ-FPOVZHCZSA-N 2 1 382.483 3.163 20 0 GGADMP Fc1cccc(O[C@@H]2C[C@@H]3CN(c4ncccc4C[NH+]4CCCC4)CC[N@H+]3C2)c1 ZINC001164906424 721565255 /nfs/dbraw/zinc/56/52/55/721565255.db2.gz IZZBNKQOBLGPQE-IFMALSPDSA-N 2 1 396.510 3.158 20 0 GGADMP Fc1cccc(O[C@@H]2C[C@H]3CN(c4ncccc4C[NH+]4CCCC4)CC[N@H+]3C2)c1 ZINC001164906426 721565413 /nfs/dbraw/zinc/56/54/13/721565413.db2.gz IZZBNKQOBLGPQE-RBBKRZOGSA-N 2 1 396.510 3.158 20 0 GGADMP Cc1[nH+]c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)cc2[nH]ccc21 ZINC001164805378 721572111 /nfs/dbraw/zinc/57/21/11/721572111.db2.gz NDKGDDVXSYNOCU-ONTIZHBOSA-N 2 1 377.492 3.135 20 0 GGADMP CN(C)c1cc[nH+]c(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164910110 721753430 /nfs/dbraw/zinc/75/34/30/721753430.db2.gz MODMTJSMCJVTAL-UHFFFAOYSA-N 2 1 377.492 3.330 20 0 GGADMP CN(C)c1cc[nH+]c(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164910110 721753434 /nfs/dbraw/zinc/75/34/34/721753434.db2.gz MODMTJSMCJVTAL-UHFFFAOYSA-N 2 1 377.492 3.330 20 0 GGADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(NC4CC4)cc[nH+]3)C[C@@H]21 ZINC001165028004 721797985 /nfs/dbraw/zinc/79/79/85/721797985.db2.gz XVNOMXKFNOLLTE-FFZOFVMBSA-N 2 1 378.524 3.183 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(NC4CC4)cc[nH+]3)C[C@@H]21 ZINC001165028004 721797989 /nfs/dbraw/zinc/79/79/89/721797989.db2.gz XVNOMXKFNOLLTE-FFZOFVMBSA-N 2 1 378.524 3.183 20 0 GGADMP CCN(C)c1cc(C)[nH+]c(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165020415 721798081 /nfs/dbraw/zinc/79/80/81/721798081.db2.gz FRPKDGPQBVYFMU-CEWLAPEOSA-N 2 1 394.567 3.373 20 0 GGADMP Cc1c[nH]c2nc[nH+]c(N3C[C@@H]4CCC[C@H]([N@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165021363 721798840 /nfs/dbraw/zinc/79/88/40/721798840.db2.gz GNCILNQNCXEMOM-UHOSZYNNSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1c[nH]c2nc[nH+]c(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165021363 721798841 /nfs/dbraw/zinc/79/88/41/721798841.db2.gz GNCILNQNCXEMOM-UHOSZYNNSA-N 2 1 376.508 3.398 20 0 GGADMP C[NH+](C)Cc1ccnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1 ZINC001165027561 721827539 /nfs/dbraw/zinc/82/75/39/721827539.db2.gz SQTJEPJGKZLPJF-BVSLBCMMSA-N 2 1 379.552 3.275 20 0 GGADMP CC[NH+](CC)C1CCN(c2[nH+]cnc3c2ccn3COC(=O)C(C)(C)C)CC1 ZINC001165053826 722002834 /nfs/dbraw/zinc/00/28/34/722002834.db2.gz POIFNPPPTCYAMA-UHFFFAOYSA-N 2 1 387.528 3.289 20 0 GGADMP c1cc2c[nH+]c(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)cc2[nH]1 ZINC001164959510 722052752 /nfs/dbraw/zinc/05/27/52/722052752.db2.gz LOIZNTQNFUTKPW-UHFFFAOYSA-N 2 1 377.492 3.077 20 0 GGADMP Cn1ccc2c1cc[nH+]c2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164958806 722054009 /nfs/dbraw/zinc/05/40/09/722054009.db2.gz GNMSHRYSKGUILQ-UHFFFAOYSA-N 2 1 391.519 3.087 20 0 GGADMP Cc1cc2[nH]ccc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)[nH+]1 ZINC001164963877 722056536 /nfs/dbraw/zinc/05/65/36/722056536.db2.gz PKLANOGYCMMTRK-UHFFFAOYSA-N 2 1 391.519 3.385 20 0 GGADMP c1cncc(C[N@@H+]2CCO[C@H]3CN(c4ccc5c([nH+]4)CCCC5)CC[C@@H]3C2)c1 ZINC001164981507 722111511 /nfs/dbraw/zinc/11/15/11/722111511.db2.gz UHEPKSULNJXMOS-IRLDBZIGSA-N 2 1 378.520 3.083 20 0 GGADMP c1cncc(C[N@H+]2CCO[C@H]3CN(c4ccc5c([nH+]4)CCCC5)CC[C@@H]3C2)c1 ZINC001164981507 722111513 /nfs/dbraw/zinc/11/15/13/722111513.db2.gz UHEPKSULNJXMOS-IRLDBZIGSA-N 2 1 378.520 3.083 20 0 GGADMP c1cncc(C[N@@H+]2CCO[C@H]3CN(c4ccc5c([nH+]4)CCCC5)CC[C@H]3C2)c1 ZINC001164981513 722111560 /nfs/dbraw/zinc/11/15/60/722111560.db2.gz UHEPKSULNJXMOS-UNMCSNQZSA-N 2 1 378.520 3.083 20 0 GGADMP c1cncc(C[N@H+]2CCO[C@H]3CN(c4ccc5c([nH+]4)CCCC5)CC[C@H]3C2)c1 ZINC001164981513 722111561 /nfs/dbraw/zinc/11/15/61/722111561.db2.gz UHEPKSULNJXMOS-UNMCSNQZSA-N 2 1 378.520 3.083 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCOc2ccccc2-c2nn[nH]n2)CC1 ZINC001576163960 949545903 /nfs/dbraw/zinc/54/59/03/949545903.db2.gz DPBRWZRWQYPMKL-GOSISDBHSA-N 2 1 398.555 3.222 20 0 GGADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)Cc1ccc(C(=O)[O-])c(F)c1 ZINC000830923668 979023714 /nfs/dbraw/zinc/02/37/14/979023714.db2.gz PHTQMNXQKAINNW-UHFFFAOYSA-N 2 1 391.531 3.152 20 0 GGADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)Cc1ccc(C(=O)[O-])c(F)c1 ZINC000830923668 979023719 /nfs/dbraw/zinc/02/37/19/979023719.db2.gz PHTQMNXQKAINNW-UHFFFAOYSA-N 2 1 391.531 3.152 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@H](C(C)C)[NH+]1CCCCCC1 ZINC000054606374 205139525 /nfs/dbraw/zinc/13/95/25/205139525.db2.gz VVFCEAMQWGMHBI-HXUWFJFHSA-N 2 1 398.555 3.276 20 0 GGADMP CC(C)(CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[NH+]1CCCCC1 ZINC000058179450 205167083 /nfs/dbraw/zinc/16/70/83/205167083.db2.gz GFAWXQCMADHDMW-NRFANRHFSA-N 2 1 386.584 3.462 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000058326817 205171903 /nfs/dbraw/zinc/17/19/03/205171903.db2.gz HQUNBMLYNZYJSQ-GOSISDBHSA-N 2 1 386.565 3.325 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)cc1Br ZINC000124319610 564478780 /nfs/dbraw/zinc/47/87/80/564478780.db2.gz SQUKJKPALNUECH-HNNXBMFYSA-N 2 1 398.389 3.382 20 0 GGADMP CSCC[C@H](C)[N@@H+](C)CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000126365844 564546636 /nfs/dbraw/zinc/54/66/36/564546636.db2.gz NOYSJPOHWQYOAK-INIZCTEOSA-N 2 1 381.611 3.247 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)C(=O)Nc1cccc(Br)c1 ZINC000130472803 564683017 /nfs/dbraw/zinc/68/30/17/564683017.db2.gz HKNCPGAGCKHTGZ-CYBMUJFWSA-N 2 1 379.302 3.303 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)C(=O)Nc1cccc(Br)c1 ZINC000130472803 564683018 /nfs/dbraw/zinc/68/30/18/564683018.db2.gz HKNCPGAGCKHTGZ-CYBMUJFWSA-N 2 1 379.302 3.303 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)Nc1ccc(C)cc1Br ZINC000130515652 564684920 /nfs/dbraw/zinc/68/49/20/564684920.db2.gz FEJYTERIGUODRB-UHFFFAOYSA-N 2 1 379.302 3.223 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)Nc1ccc(C)cc1Br ZINC000130515652 564684922 /nfs/dbraw/zinc/68/49/22/564684922.db2.gz FEJYTERIGUODRB-UHFFFAOYSA-N 2 1 379.302 3.223 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)N(C)Cc1cc(Cl)cc(Cl)c1 ZINC000130527894 564684937 /nfs/dbraw/zinc/68/49/37/564684937.db2.gz QODWVOGOAMGMLP-UHFFFAOYSA-N 2 1 383.323 3.479 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)N(C)Cc1cc(Cl)cc(Cl)c1 ZINC000130527894 564684938 /nfs/dbraw/zinc/68/49/38/564684938.db2.gz QODWVOGOAMGMLP-UHFFFAOYSA-N 2 1 383.323 3.479 20 0 GGADMP C[N@H+](Cc1cc(Br)c2c(c1)OCCCO2)CC1CC[NH+](C)CC1 ZINC000093088626 564883693 /nfs/dbraw/zinc/88/36/93/564883693.db2.gz HVLNXQOZYJTKSW-UHFFFAOYSA-N 2 1 383.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1)Nc1ccc(Br)cc1 ZINC000150788154 564891339 /nfs/dbraw/zinc/89/13/39/564891339.db2.gz NIPFYLYUFMSRFO-HNNXBMFYSA-N 2 1 380.330 3.195 20 0 GGADMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cn3cc(Cl)cc(Cl)c3n2)CC1 ZINC000106124487 564977918 /nfs/dbraw/zinc/97/79/18/564977918.db2.gz USKWCOAYBSQUFN-CYBMUJFWSA-N 2 1 385.339 3.166 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(Cl)s3)c2)C1 ZINC000108421037 565011177 /nfs/dbraw/zinc/01/11/77/565011177.db2.gz AISHOTLKZDPDES-MRXNPFEDSA-N 2 1 377.941 3.389 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]CC1=Cc2cc(Br)ccc2OC1 ZINC000111386574 565054057 /nfs/dbraw/zinc/05/40/57/565054057.db2.gz FWIUQRTWVJXOHI-GOSISDBHSA-N 2 1 395.341 3.051 20 0 GGADMP O=C(CC[C@@H]1CCC[NH2+]1)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000292015314 565092299 /nfs/dbraw/zinc/09/22/99/565092299.db2.gz DSIQVVZQSXFJJL-KRWDZBQOSA-N 2 1 394.357 3.062 20 0 GGADMP C[C@H](C(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1)c1cccc(Br)c1 ZINC000292388073 565113946 /nfs/dbraw/zinc/11/39/46/565113946.db2.gz RIMBSNNDTQFNOE-HNNXBMFYSA-N 2 1 396.373 3.037 20 0 GGADMP C[C@H](C(=O)N(C)CCN(C)C1CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000292388073 565113950 /nfs/dbraw/zinc/11/39/50/565113950.db2.gz RIMBSNNDTQFNOE-HNNXBMFYSA-N 2 1 396.373 3.037 20 0 GGADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCC(=O)Nc3ccc(Br)cc3F)C2)C1 ZINC000293112791 565150893 /nfs/dbraw/zinc/15/08/93/565150893.db2.gz YOXKSMRQRWDUCV-GOSISDBHSA-N 2 1 398.320 3.335 20 0 GGADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCC(=O)Nc3ccc(Br)cc3F)C2)C1 ZINC000293112791 565150899 /nfs/dbraw/zinc/15/08/99/565150899.db2.gz YOXKSMRQRWDUCV-GOSISDBHSA-N 2 1 398.320 3.335 20 0 GGADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCC(=O)Nc3ccc(Br)cc3F)C2)C1 ZINC000293112791 565150905 /nfs/dbraw/zinc/15/09/05/565150905.db2.gz YOXKSMRQRWDUCV-GOSISDBHSA-N 2 1 398.320 3.335 20 0 GGADMP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](Cc3cnc(-c4cccs4)s3)C2)CC1 ZINC000371331826 565187033 /nfs/dbraw/zinc/18/70/33/565187033.db2.gz KYJRTDHTEPDABI-INIZCTEOSA-N 2 1 376.595 3.472 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000371437064 565193918 /nfs/dbraw/zinc/19/39/18/565193918.db2.gz ARODPEXNZIBZQB-XOKHGSTOSA-N 2 1 380.330 3.383 20 0 GGADMP C[C@H]1C[N@H+](CCCc2ccccc2Br)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000371697394 565205686 /nfs/dbraw/zinc/20/56/86/565205686.db2.gz VWOREGZSTATGFK-PXNSSMCTSA-N 2 1 394.401 3.340 20 0 GGADMP C[C@H]1C[N@@H+](CCCc2ccccc2Br)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000371697394 565205693 /nfs/dbraw/zinc/20/56/93/565205693.db2.gz VWOREGZSTATGFK-PXNSSMCTSA-N 2 1 394.401 3.340 20 0 GGADMP C[C@@H](N[C@@H]1CC[N@@H+](CCN2CCOCC2)C1)c1cc(Cl)sc1Cl ZINC000372780000 565253907 /nfs/dbraw/zinc/25/39/07/565253907.db2.gz JCDHGJICXANCBV-CHWSQXEVSA-N 2 1 378.369 3.112 20 0 GGADMP C[C@H](N[C@H]1CC[N@@H+](CCN2CCOCC2)C1)c1cc(Cl)sc1Cl ZINC000372780003 565254227 /nfs/dbraw/zinc/25/42/27/565254227.db2.gz JCDHGJICXANCBV-STQMWFEESA-N 2 1 378.369 3.112 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000372916844 565260458 /nfs/dbraw/zinc/26/04/58/565260458.db2.gz KXGVDKPVUTXPEU-UHFFFAOYSA-N 2 1 380.374 3.312 20 0 GGADMP COc1c(Br)cccc1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000186888752 565292941 /nfs/dbraw/zinc/29/29/41/565292941.db2.gz XNEADGWUCNIEET-UHFFFAOYSA-N 2 1 383.330 3.002 20 0 GGADMP C[NH+](C)CC(C)(C)C[NH2+]Cc1cc(Br)cc(Br)c1N ZINC000187018156 565302493 /nfs/dbraw/zinc/30/24/93/565302493.db2.gz RXZBOMVXGMHNSX-UHFFFAOYSA-N 2 1 393.167 3.471 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCSCCOc1cccc(Br)c1 ZINC000162157201 565307633 /nfs/dbraw/zinc/30/76/33/565307633.db2.gz ZGEXFCJLSJTZQM-YOEHRIQHSA-N 2 1 387.387 3.491 20 0 GGADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(Br)cc(Br)c2N)C1 ZINC000187351571 565325644 /nfs/dbraw/zinc/32/56/44/565325644.db2.gz MQPYHRNETJUPDX-SNVBAGLBSA-N 2 1 391.151 3.225 20 0 GGADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Br)cc(Br)c2N)C1 ZINC000187351571 565325649 /nfs/dbraw/zinc/32/56/49/565325649.db2.gz MQPYHRNETJUPDX-SNVBAGLBSA-N 2 1 391.151 3.225 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3ccc(Br)cc3)CC[C@@H]21 ZINC000162804316 565329331 /nfs/dbraw/zinc/32/93/31/565329331.db2.gz KFCYWEPURLXUAS-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CCC(=O)Nc3ccc(Br)cc3)CC[C@@H]21 ZINC000162804316 565329335 /nfs/dbraw/zinc/32/93/35/565329335.db2.gz KFCYWEPURLXUAS-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CCC(=O)Nc3ccc(Br)cc3)CC[C@@H]21 ZINC000162804316 565329337 /nfs/dbraw/zinc/32/93/37/565329337.db2.gz KFCYWEPURLXUAS-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP Brc1cccc(N2CC[C@H](C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000166297783 565374602 /nfs/dbraw/zinc/37/46/02/565374602.db2.gz HZMMWLWQRMXBMY-SZVBFZGTSA-N 2 1 378.358 3.492 20 0 GGADMP CN(Cc1ccccc1Br)C(=O)CC[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166565581 565375971 /nfs/dbraw/zinc/37/59/71/565375971.db2.gz YRHWXTBSSPJATF-IAGOWNOFSA-N 2 1 394.357 3.014 20 0 GGADMP C[C@H]([NH2+]CCCCN1CC[NH+](CCO)CC1)c1cc(Cl)sc1Cl ZINC000168918247 565382330 /nfs/dbraw/zinc/38/23/30/565382330.db2.gz MMNJDZXLCHPXPG-ZDUSSCGKSA-N 2 1 380.385 3.096 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc(Br)cc1F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000375756396 565403511 /nfs/dbraw/zinc/40/35/11/565403511.db2.gz VQSDEMSMCUJLGJ-YIONKMFJSA-N 2 1 398.320 3.474 20 0 GGADMP Brc1ccc(N2CC[C@@H](C[NH2+]C3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000298491212 565416496 /nfs/dbraw/zinc/41/64/96/565416496.db2.gz PZRXPPWECJHVLK-HNNXBMFYSA-N 2 1 378.358 3.492 20 0 GGADMP Brc1ccc(N2CC[C@H](C[NH2+]C3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000298491219 565417235 /nfs/dbraw/zinc/41/72/35/565417235.db2.gz PZRXPPWECJHVLK-OAHLLOKOSA-N 2 1 378.358 3.492 20 0 GGADMP Brc1ccc(C[NH2+]C2CC[NH+](C3CC3)CC2)c(N2CCOCC2)c1 ZINC000188691690 565417527 /nfs/dbraw/zinc/41/75/27/565417527.db2.gz KPIHGRICKWAHGW-UHFFFAOYSA-N 2 1 394.357 3.002 20 0 GGADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000188749647 565422024 /nfs/dbraw/zinc/42/20/24/565422024.db2.gz FNVNFHDMPQVIKF-QZTJIDSGSA-N 2 1 396.373 3.248 20 0 GGADMP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000188749625 565422206 /nfs/dbraw/zinc/42/22/06/565422206.db2.gz FNVNFHDMPQVIKF-ROUUACIJSA-N 2 1 396.373 3.248 20 0 GGADMP C[C@H](NC1CC[NH+](CCN2CCOCC2)CC1)c1cc(Cl)ccc1Cl ZINC000376339996 565432349 /nfs/dbraw/zinc/43/23/49/565432349.db2.gz JEVXCPNDMATCOY-HNNXBMFYSA-N 2 1 386.367 3.441 20 0 GGADMP C[N@@H+]1CCC[C@H](N2CCN(c3cc[nH+]c4ccc(Br)cc43)CC2)C1 ZINC000301245145 565474220 /nfs/dbraw/zinc/47/42/20/565474220.db2.gz ALUUHLNGLNVGFQ-INIZCTEOSA-N 2 1 389.341 3.214 20 0 GGADMP C[N@H+]1CCC[C@H](N2CCN(c3cc[nH+]c4ccc(Br)cc43)CC2)C1 ZINC000301245145 565474223 /nfs/dbraw/zinc/47/42/23/565474223.db2.gz ALUUHLNGLNVGFQ-INIZCTEOSA-N 2 1 389.341 3.214 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3cnc([C@H](C)O)s3)CC2)cs1 ZINC000377660717 565491531 /nfs/dbraw/zinc/49/15/31/565491531.db2.gz ZEWZLVZIVYETAU-ZDUSSCGKSA-N 2 1 380.583 3.217 20 0 GGADMP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(Br)o3)cc2)CC1 ZINC000190968061 565573539 /nfs/dbraw/zinc/57/35/39/565573539.db2.gz XHBQOEMXPBDFPF-UHFFFAOYSA-N 2 1 379.298 3.289 20 0 GGADMP CC[N@@H+](C)C[C@H]1CC[NH+](CCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000173883791 565597046 /nfs/dbraw/zinc/59/70/46/565597046.db2.gz OUWHOJUACNIJPM-CYBMUJFWSA-N 2 1 386.309 3.190 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@H+](CCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000173883791 565597053 /nfs/dbraw/zinc/59/70/53/565597053.db2.gz OUWHOJUACNIJPM-CYBMUJFWSA-N 2 1 386.309 3.190 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000173883791 565597057 /nfs/dbraw/zinc/59/70/57/565597057.db2.gz OUWHOJUACNIJPM-CYBMUJFWSA-N 2 1 386.309 3.190 20 0 GGADMP O[C@H](C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1cccc(Br)c1 ZINC000173955946 565601819 /nfs/dbraw/zinc/60/18/19/565601819.db2.gz ZDONJZOOBLDBIP-LJQANCHMSA-N 2 1 397.357 3.059 20 0 GGADMP O[C@@H](C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1cccc(Br)c1 ZINC000173955959 565602014 /nfs/dbraw/zinc/60/20/14/565602014.db2.gz ZDONJZOOBLDBIP-IBGZPJMESA-N 2 1 397.357 3.059 20 0 GGADMP CCCn1ccnc1CCC[N@@H+](C)[C@H](C(N)=O)c1ccc(Br)cc1 ZINC000191490453 565607766 /nfs/dbraw/zinc/60/77/66/565607766.db2.gz IQCAUPCYKRGJQH-KRWDZBQOSA-N 2 1 393.329 3.147 20 0 GGADMP COCC[N@@H+](C)CCC[NH2+][C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000191494934 565608193 /nfs/dbraw/zinc/60/81/93/565608193.db2.gz VEIWUVZIUYNYND-LJQANCHMSA-N 2 1 399.373 3.475 20 0 GGADMP C[N@@H+](Cc1ccc(Br)cc1N1CCOCC1)C[C@H]1CCC[NH+](C)C1 ZINC000191615251 565616600 /nfs/dbraw/zinc/61/66/00/565616600.db2.gz RBIHRODTFYCTGG-INIZCTEOSA-N 2 1 396.373 3.059 20 0 GGADMP C[N@H+](Cc1ccc(Br)cc1N1CCOCC1)C[C@H]1CCC[NH+](C)C1 ZINC000191615251 565616604 /nfs/dbraw/zinc/61/66/04/565616604.db2.gz RBIHRODTFYCTGG-INIZCTEOSA-N 2 1 396.373 3.059 20 0 GGADMP C[NH+](Cc1ccc(Br)cc1N1CCOCC1)C[C@H]1CCC[N@H+](C)C1 ZINC000191615251 565616609 /nfs/dbraw/zinc/61/66/09/565616609.db2.gz RBIHRODTFYCTGG-INIZCTEOSA-N 2 1 396.373 3.059 20 0 GGADMP C[NH+](Cc1ccc(Br)cc1N1CCOCC1)C[C@H]1CCC[N@@H+](C)C1 ZINC000191615251 565616616 /nfs/dbraw/zinc/61/66/16/565616616.db2.gz RBIHRODTFYCTGG-INIZCTEOSA-N 2 1 396.373 3.059 20 0 GGADMP C[N@@H+](Cc1ccc(Br)cc1N1CCOCC1)C[C@@H]1CCC[NH+](C)C1 ZINC000191615270 565617169 /nfs/dbraw/zinc/61/71/69/565617169.db2.gz RBIHRODTFYCTGG-MRXNPFEDSA-N 2 1 396.373 3.059 20 0 GGADMP C[N@H+](Cc1ccc(Br)cc1N1CCOCC1)C[C@@H]1CCC[NH+](C)C1 ZINC000191615270 565617171 /nfs/dbraw/zinc/61/71/71/565617171.db2.gz RBIHRODTFYCTGG-MRXNPFEDSA-N 2 1 396.373 3.059 20 0 GGADMP C[NH+](Cc1ccc(Br)cc1N1CCOCC1)C[C@@H]1CCC[N@H+](C)C1 ZINC000191615270 565617174 /nfs/dbraw/zinc/61/71/74/565617174.db2.gz RBIHRODTFYCTGG-MRXNPFEDSA-N 2 1 396.373 3.059 20 0 GGADMP C[NH+](Cc1ccc(Br)cc1N1CCOCC1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000191615270 565617176 /nfs/dbraw/zinc/61/71/76/565617176.db2.gz RBIHRODTFYCTGG-MRXNPFEDSA-N 2 1 396.373 3.059 20 0 GGADMP C[C@H](c1cccc(Br)c1)[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000325295714 565620115 /nfs/dbraw/zinc/62/01/15/565620115.db2.gz YJRABDRJXVIMNZ-RKVPGOIHSA-N 2 1 394.357 3.090 20 0 GGADMP C[C@H](c1cccc(Br)c1)[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000325295716 565620273 /nfs/dbraw/zinc/62/02/73/565620273.db2.gz YJRABDRJXVIMNZ-RVKKMQEKSA-N 2 1 394.357 3.090 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000174224217 565621033 /nfs/dbraw/zinc/62/10/33/565621033.db2.gz FYRMOFDCULUHCC-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCC(=O)Nc2ccccc2Br)C1 ZINC000174970926 565669961 /nfs/dbraw/zinc/66/99/61/565669961.db2.gz FWOVEBZNTUDLMN-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000174970926 565669966 /nfs/dbraw/zinc/66/99/66/565669966.db2.gz FWOVEBZNTUDLMN-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000174970926 565669968 /nfs/dbraw/zinc/66/99/68/565669968.db2.gz FWOVEBZNTUDLMN-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP COC(=O)CC[N@@H+](CCCn1ccnc1)Cc1cccc(Br)c1 ZINC000192330969 565680685 /nfs/dbraw/zinc/68/06/85/565680685.db2.gz RWOBFQUGTKJAPE-UHFFFAOYSA-N 2 1 380.286 3.101 20 0 GGADMP O=C1[C@@H](N2CCC(c3ncc[nH]3)CC2)CCN1c1cccc(Br)c1 ZINC000330337921 565701662 /nfs/dbraw/zinc/70/16/62/565701662.db2.gz UQSVLNSBOLBOAV-INIZCTEOSA-N 2 1 389.297 3.157 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](CCO)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000192782690 565710124 /nfs/dbraw/zinc/71/01/24/565710124.db2.gz VPXIZPPFTAKNGY-UHFFFAOYSA-N 2 1 388.383 3.204 20 0 GGADMP C[N@@H+]1CCCC12CC[NH+](CCC(=O)Nc1ccc(Br)cc1F)CC2 ZINC000411453856 565731111 /nfs/dbraw/zinc/73/11/11/565731111.db2.gz XDPNTRUKNPZIJW-UHFFFAOYSA-N 2 1 398.320 3.477 20 0 GGADMP C[N@H+]1CCCC12CC[NH+](CCC(=O)Nc1ccc(Br)cc1F)CC2 ZINC000411453856 565731115 /nfs/dbraw/zinc/73/11/15/565731115.db2.gz XDPNTRUKNPZIJW-UHFFFAOYSA-N 2 1 398.320 3.477 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000176275217 565762022 /nfs/dbraw/zinc/76/20/22/565762022.db2.gz IOMNVVMVBAVMOJ-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000176275217 565762030 /nfs/dbraw/zinc/76/20/30/565762030.db2.gz IOMNVVMVBAVMOJ-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000176275217 565762037 /nfs/dbraw/zinc/76/20/37/565762037.db2.gz IOMNVVMVBAVMOJ-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+]Cc2c(F)ccc(Br)c2F)CC1 ZINC000282126996 565765654 /nfs/dbraw/zinc/76/56/54/565765654.db2.gz VFBQSRODFCZVMA-UHFFFAOYSA-N 2 1 390.316 3.235 20 0 GGADMP C[C@@H](Cn1cc(Br)cn1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000177969336 565884547 /nfs/dbraw/zinc/88/45/47/565884547.db2.gz IRNMXUUSBJCZPE-INIZCTEOSA-N 2 1 391.357 3.331 20 0 GGADMP C[C@H](Cn1cc(Br)cn1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000177969346 565884809 /nfs/dbraw/zinc/88/48/09/565884809.db2.gz IRNMXUUSBJCZPE-MRXNPFEDSA-N 2 1 391.357 3.331 20 0 GGADMP Cc1ccc(NC(=O)CN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(Br)c1 ZINC000285596989 565915832 /nfs/dbraw/zinc/91/58/32/565915832.db2.gz UWWITSGWMCPINA-YIONKMFJSA-N 2 1 380.330 3.253 20 0 GGADMP C[C@@H](NC(=O)CN(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Br)cc1 ZINC000285665280 565920877 /nfs/dbraw/zinc/92/08/77/565920877.db2.gz ZICZHFXPPFIVTD-DTWYCDNDSA-N 2 1 394.357 3.183 20 0 GGADMP COC(=O)CC[N@H+](Cc1cccc(Br)c1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414751703 565959145 /nfs/dbraw/zinc/95/91/45/565959145.db2.gz AXSXRKKVXMCGQT-GOEBONIOSA-N 2 1 383.330 3.202 20 0 GGADMP CCOc1cc(C[NH2+]C2CC[NH2+]CC2)cc(Br)c1OC(F)F ZINC000414791925 565961448 /nfs/dbraw/zinc/96/14/48/565961448.db2.gz RMLAGSRQEREVKA-UHFFFAOYSA-N 2 1 379.245 3.291 20 0 GGADMP Cc1cc(Br)ccc1C(=O)N1CCC([NH2+][C@@H](C[NH3+])CC(C)C)CC1 ZINC000414831220 565962806 /nfs/dbraw/zinc/96/28/06/565962806.db2.gz CDBBBWVMWZEVSS-QGZVFWFLSA-N 2 1 396.373 3.325 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414849627 565963433 /nfs/dbraw/zinc/96/34/33/565963433.db2.gz HKIIDALVTLUUAY-HIFRSBDPSA-N 2 1 377.330 3.421 20 0 GGADMP COc1cc(C[NH2+]CC[C@H]2CCC[NH2+]2)cc(Br)c1OC(F)F ZINC000414911565 565965773 /nfs/dbraw/zinc/96/57/73/565965773.db2.gz WKXPRMQFXQDACC-LLVKDONJSA-N 2 1 379.245 3.291 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414915224 565965831 /nfs/dbraw/zinc/96/58/31/565965831.db2.gz ZEDNBCINZBDBCE-SFHVURJKSA-N 2 1 377.330 3.423 20 0 GGADMP COc1cc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc(Br)c1OC(F)F ZINC000414946388 565966461 /nfs/dbraw/zinc/96/64/61/565966461.db2.gz JMJKCTPVRHDFRA-KOLCDFICSA-N 2 1 379.245 3.289 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000414955450 565967195 /nfs/dbraw/zinc/96/71/95/565967195.db2.gz UHSRUNHMJLAHLC-WBMJQRKESA-N 2 1 377.330 3.482 20 0 GGADMP [NH3+][C@@H]1CCC[C@H](C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)C1 ZINC000237894885 565974147 /nfs/dbraw/zinc/97/41/47/565974147.db2.gz GLNJOCLLFYULJD-DOTOQJQBSA-N 2 1 394.357 3.047 20 0 GGADMP COc1sc(C[NH+]2CCC([C@@H]3C[C@@H]([NH3+])CCO3)CC2)cc1Br ZINC000415121259 565974985 /nfs/dbraw/zinc/97/49/85/565974985.db2.gz HWWHOPXSQWCOSA-WFASDCNBSA-N 2 1 389.359 3.238 20 0 GGADMP C[C@@H](C[N@H+]1CC2(CC[NH2+]CC2)[C@@H]2COC[C@@H]21)c1cccc(Br)c1 ZINC000415141517 565976349 /nfs/dbraw/zinc/97/63/49/565976349.db2.gz PNXXZSGZQBXKRO-QGTPRVQTSA-N 2 1 379.342 3.253 20 0 GGADMP [NH3+][C@H]1CCC[C@@H](C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)C1 ZINC000238011773 565977661 /nfs/dbraw/zinc/97/76/61/565977661.db2.gz GLNJOCLLFYULJD-WBVHZDCISA-N 2 1 394.357 3.047 20 0 GGADMP Brc1cnn(CCC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000287483339 566021616 /nfs/dbraw/zinc/02/16/16/566021616.db2.gz XFVBEZKIARFAGX-UHFFFAOYSA-N 2 1 377.330 3.290 20 0 GGADMP Brc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c(N2CCOCC2)c1 ZINC000246378466 566026772 /nfs/dbraw/zinc/02/67/72/566026772.db2.gz JURVEHIWXFKLIR-ROUUACIJSA-N 2 1 394.357 3.002 20 0 GGADMP Brc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c(N2CCOCC2)c1 ZINC000246378466 566026778 /nfs/dbraw/zinc/02/67/78/566026778.db2.gz JURVEHIWXFKLIR-ROUUACIJSA-N 2 1 394.357 3.002 20 0 GGADMP O=C(CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)Nc1ccc(Br)cc1 ZINC000246441442 566029944 /nfs/dbraw/zinc/02/99/44/566029944.db2.gz DFEUTLOUCABHDQ-KSSFIOAISA-N 2 1 392.341 3.336 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3ccc(Br)cc3)CC[C@H]21 ZINC000247973891 566069732 /nfs/dbraw/zinc/06/97/32/566069732.db2.gz KFCYWEPURLXUAS-WMLDXEAASA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CCC(=O)Nc3ccc(Br)cc3)CC[C@H]21 ZINC000247973891 566069735 /nfs/dbraw/zinc/06/97/35/566069735.db2.gz KFCYWEPURLXUAS-WMLDXEAASA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CCC(=O)Nc3ccc(Br)cc3)CC[C@H]21 ZINC000247973891 566069740 /nfs/dbraw/zinc/06/97/40/566069740.db2.gz KFCYWEPURLXUAS-WMLDXEAASA-N 2 1 380.330 3.194 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]CCC(=O)Nc2cc(Br)ccc2C)[C@H](C)C1 ZINC000180829165 566092763 /nfs/dbraw/zinc/09/27/63/566092763.db2.gz MIDNOJQOAQNVNZ-ZBFHGGJFSA-N 2 1 382.346 3.406 20 0 GGADMP C[C@H](c1ccccc1Br)[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000261624919 566126159 /nfs/dbraw/zinc/12/61/59/566126159.db2.gz GORUTNLJDAVFMX-RVKKMQEKSA-N 2 1 394.357 3.090 20 0 GGADMP C[C@H](CNC(=O)[C@](C)([NH3+])c1ccc(Br)cc1)[N@H+]1CCCC[C@H]1C ZINC000261721080 566130435 /nfs/dbraw/zinc/13/04/35/566130435.db2.gz KDRDZEHMIVZIAZ-HBUWYVDXSA-N 2 1 382.346 3.002 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@](C)(C[NH3+])C1 ZINC000261722091 566130663 /nfs/dbraw/zinc/13/06/63/566130663.db2.gz NPLDENUWGIRTHL-GOSISDBHSA-N 2 1 377.330 3.422 20 0 GGADMP O=C(CC[C@H]1CC[NH2+]C1)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000261831082 566135967 /nfs/dbraw/zinc/13/59/67/566135967.db2.gz NEONEOGSENOYRI-AWEZNQCLSA-N 2 1 384.351 3.464 20 0 GGADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)[C@H](C)C1 ZINC000181458040 566141647 /nfs/dbraw/zinc/14/16/47/566141647.db2.gz OLVWFLDYOPHTNZ-CRAIPNDOSA-N 2 1 396.373 3.106 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)[C@H](C)C1 ZINC000181458040 566141650 /nfs/dbraw/zinc/14/16/50/566141650.db2.gz OLVWFLDYOPHTNZ-CRAIPNDOSA-N 2 1 396.373 3.106 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000366262006 566143736 /nfs/dbraw/zinc/14/37/36/566143736.db2.gz XCOGLMAVDNBIRR-XOKHGSTOSA-N 2 1 380.330 3.383 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000366262003 566144556 /nfs/dbraw/zinc/14/45/56/566144556.db2.gz XCOGLMAVDNBIRR-COXVUDFISA-N 2 1 380.330 3.383 20 0 GGADMP CC(C)Sc1cc(Br)ccc1C[N@@H+]1CC[C@@H](N2CC[NH2+]CC2)C1 ZINC000262069689 566145342 /nfs/dbraw/zinc/14/53/42/566145342.db2.gz BXPYQFMTAUOWMB-QGZVFWFLSA-N 2 1 398.414 3.429 20 0 GGADMP CC(C)Sc1cc(Br)ccc1C[N@H+]1CC[C@@H](N2CC[NH2+]CC2)C1 ZINC000262069689 566145349 /nfs/dbraw/zinc/14/53/49/566145349.db2.gz BXPYQFMTAUOWMB-QGZVFWFLSA-N 2 1 398.414 3.429 20 0 GGADMP [NH3+][C@H]1CCCN(C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000417565084 566158832 /nfs/dbraw/zinc/15/88/32/566158832.db2.gz GIPCEZAJPRODBU-AWEZNQCLSA-N 2 1 385.339 3.091 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCCN2CCC[N@@H+](C)CC2)c(Br)c1 ZINC000181704476 566159036 /nfs/dbraw/zinc/15/90/36/566159036.db2.gz LEMXZWGGWPZEBC-OAHLLOKOSA-N 2 1 384.362 3.136 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](CCCc3ccccc3Br)C2)CC1 ZINC000181858602 566170068 /nfs/dbraw/zinc/17/00/68/566170068.db2.gz SNUDNXWDUJGUFI-SFHVURJKSA-N 2 1 380.374 3.094 20 0 GGADMP COc1cc(Br)ccc1CCC[NH+]1CCC([N@H+](C)CCCO)CC1 ZINC000181887240 566172195 /nfs/dbraw/zinc/17/21/95/566172195.db2.gz XVOBOATYWQWHLL-UHFFFAOYSA-N 2 1 399.373 3.169 20 0 GGADMP COc1cc(Br)ccc1CCC[NH+]1CCC([N@@H+](C)CCCO)CC1 ZINC000181887240 566172202 /nfs/dbraw/zinc/17/22/02/566172202.db2.gz XVOBOATYWQWHLL-UHFFFAOYSA-N 2 1 399.373 3.169 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(Br)nc1 ZINC000290592318 566180304 /nfs/dbraw/zinc/18/03/04/566180304.db2.gz GOGZAKTXQUNQLF-KBXCAEBGSA-N 2 1 390.325 3.262 20 0 GGADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(F)cc2I)C1 ZINC000418090121 566197217 /nfs/dbraw/zinc/19/72/17/566197217.db2.gz NEBCBSBJDOKPPH-LBPRGKRZSA-N 2 1 376.257 3.252 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1cc(Br)cc2cccnc21 ZINC000182960727 566232901 /nfs/dbraw/zinc/23/29/01/566232901.db2.gz NLJIRJVVDBXNBA-UHFFFAOYSA-N 2 1 391.357 3.067 20 0 GGADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc(S(N)(=O)=O)c(Cl)c1 ZINC000419678963 566241117 /nfs/dbraw/zinc/24/11/17/566241117.db2.gz FJXAGRCLYUPYRI-UHFFFAOYSA-N 2 1 387.977 3.122 20 0 GGADMP Cc1cc(Br)ccc1C(=O)N1CCC([NH2+]C2CC[NH+](C)CC2)CC1 ZINC000368715188 566244846 /nfs/dbraw/zinc/24/48/46/566244846.db2.gz JDZQFNLOSGKVDF-UHFFFAOYSA-N 2 1 394.357 3.046 20 0 GGADMP CC[NH+](CC)CCSCC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000266146114 566246519 /nfs/dbraw/zinc/24/65/19/566246519.db2.gz MTVYKNDBJMDCQY-KRWDZBQOSA-N 2 1 383.627 3.151 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000575124178 566253621 /nfs/dbraw/zinc/25/36/21/566253621.db2.gz RJVBWHWMHNRGMY-GJZGRUSLSA-N 2 1 380.330 3.018 20 0 GGADMP CC[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481913977 566262678 /nfs/dbraw/zinc/26/26/78/566262678.db2.gz QVPDNAHMJVRZBL-QGZVFWFLSA-N 2 1 387.977 3.165 20 0 GGADMP CC[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481914940 566262923 /nfs/dbraw/zinc/26/29/23/566262923.db2.gz CAIIGUVZBZNFOO-WMLDXEAASA-N 2 1 387.977 3.021 20 0 GGADMP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000420362928 566273362 /nfs/dbraw/zinc/27/33/62/566273362.db2.gz NIANRXNKFYPBAW-MRXNPFEDSA-N 2 1 375.314 3.384 20 0 GGADMP CCCCCOc1ccc(Br)cc1C[NH+]1CCC(O)(C[NH3+])CC1 ZINC000420408060 566276910 /nfs/dbraw/zinc/27/69/10/566276910.db2.gz VMRGAHBFOHZFLJ-UHFFFAOYSA-N 2 1 385.346 3.304 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCCOc2ccc(I)cc21 ZINC000482118060 566285613 /nfs/dbraw/zinc/28/56/13/566285613.db2.gz BZOYZDGVHMLLAJ-OAHLLOKOSA-N 2 1 397.260 3.300 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@@H]3CCc4cc(Br)ccc4NC3=O)CC[C@@H]21 ZINC000625221491 566290961 /nfs/dbraw/zinc/29/09/61/566290961.db2.gz AYIXLZJVFAAOGN-FHLIZLRMSA-N 2 1 392.341 3.119 20 0 GGADMP C[NH+]1CCN(c2cc[nH+]cc2NC(=O)Cc2cccc(Cl)c2Cl)CC1 ZINC000575848934 566292647 /nfs/dbraw/zinc/29/26/47/566292647.db2.gz YCQAZQGZUYHGNR-UHFFFAOYSA-N 2 1 379.291 3.321 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)CC1 ZINC000669690390 566320370 /nfs/dbraw/zinc/32/03/70/566320370.db2.gz SALIWEXTVRZFEI-OKILXGFUSA-N 2 1 375.401 3.075 20 0 GGADMP CN(C)C(=O)CC[NH+]1CCC([NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000482899182 566340638 /nfs/dbraw/zinc/34/06/38/566340638.db2.gz JGXPJFKSTLTOAF-KRWDZBQOSA-N 2 1 381.973 3.409 20 0 GGADMP CN(C)C(=O)CC[NH+]1CCC([NH2+][C@H]2CCSc3c(Cl)cccc32)CC1 ZINC000482888619 566341538 /nfs/dbraw/zinc/34/15/38/566341538.db2.gz SNFVJHLQABIIAR-KRWDZBQOSA-N 2 1 381.973 3.409 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)C[N@@H+](C)[C@@H]1CCSC1)c1ccccc1Cl ZINC000536072066 566349598 /nfs/dbraw/zinc/34/95/98/566349598.db2.gz HDKKPLZHZFVTBW-CRAIPNDOSA-N 2 1 383.989 3.276 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000576498958 566351639 /nfs/dbraw/zinc/35/16/39/566351639.db2.gz VBBHLYSVYKPBKU-COXVUDFISA-N 2 1 380.330 3.383 20 0 GGADMP Cc1[nH+]c2ccc(Br)cc2c(NC[C@@H]2C[N@@H+](C3CC3)CCO2)c1C ZINC000462826154 566357076 /nfs/dbraw/zinc/35/70/76/566357076.db2.gz KQWUWMGRCAWJCX-MRXNPFEDSA-N 2 1 390.325 3.311 20 0 GGADMP Cc1[nH+]c2ccc(Br)cc2c(NC[C@@H]2C[N@H+](C3CC3)CCO2)c1C ZINC000462826154 566357086 /nfs/dbraw/zinc/35/70/86/566357086.db2.gz KQWUWMGRCAWJCX-MRXNPFEDSA-N 2 1 390.325 3.311 20 0 GGADMP [NH3+][C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(Cl)c1 ZINC000649308830 566360867 /nfs/dbraw/zinc/36/08/67/566360867.db2.gz AIWWITGAYVXVAP-KSSFIOAISA-N 2 1 377.941 3.430 20 0 GGADMP [NH3+][C@H](C(=O)NCC1([NH+]2CCSCC2)CCCCC1)c1cccc(Cl)c1 ZINC000649334232 566361631 /nfs/dbraw/zinc/36/16/31/566361631.db2.gz VKOVJRXLEQCESL-KRWDZBQOSA-N 2 1 381.973 3.208 20 0 GGADMP [NH3+][C@@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(Cl)c1 ZINC000649308831 566361902 /nfs/dbraw/zinc/36/19/02/566361902.db2.gz AIWWITGAYVXVAP-RDTXWAMCSA-N 2 1 377.941 3.430 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Br)cc1OCCCO ZINC000462949649 566370164 /nfs/dbraw/zinc/37/01/64/566370164.db2.gz YSQLOGFUPVMEFZ-UAGQMJEPSA-N 2 1 397.357 3.488 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)cc1OCCCO ZINC000462949649 566370167 /nfs/dbraw/zinc/37/01/67/566370167.db2.gz YSQLOGFUPVMEFZ-UAGQMJEPSA-N 2 1 397.357 3.488 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462964461 566371985 /nfs/dbraw/zinc/37/19/85/566371985.db2.gz MVDIFZNUPOPWDG-ZQIUZPCESA-N 2 1 385.346 3.201 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462964461 566371992 /nfs/dbraw/zinc/37/19/92/566371992.db2.gz MVDIFZNUPOPWDG-ZQIUZPCESA-N 2 1 385.346 3.201 20 0 GGADMP C[C@H]1C[N@H+](Cc2cnc(-c3ccsc3)s2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000536664623 566392199 /nfs/dbraw/zinc/39/21/99/566392199.db2.gz RKQOYOUCQJFIKK-MAUKXSAKSA-N 2 1 376.595 3.329 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cnc(-c3ccsc3)s2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000536664623 566392202 /nfs/dbraw/zinc/39/22/02/566392202.db2.gz RKQOYOUCQJFIKK-MAUKXSAKSA-N 2 1 376.595 3.329 20 0 GGADMP C[C@H](CC[NH+](C)C)[NH2+]Cc1cc(Br)cc(Br)c1N ZINC000463301113 566398853 /nfs/dbraw/zinc/39/88/53/566398853.db2.gz OAWYMDYOFAAGFX-SECBINFHSA-N 2 1 379.140 3.224 20 0 GGADMP COCC[NH+]1CCC([NH2+]CCc2cc(Cl)ccc2Br)CC1 ZINC000536837278 566404953 /nfs/dbraw/zinc/40/49/53/566404953.db2.gz GJQOVCYOVPRMSM-UHFFFAOYSA-N 2 1 375.738 3.345 20 0 GGADMP CN(C(=O)Cc1ccc(Cl)cc1Cl)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000601477605 566408120 /nfs/dbraw/zinc/40/81/20/566408120.db2.gz KBGOZJVWZKTXMT-QGZVFWFLSA-N 2 1 384.351 3.163 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC[N@@H+]1C ZINC000536890242 566408886 /nfs/dbraw/zinc/40/88/86/566408886.db2.gz PUCMZKAAJINMGL-MAUKXSAKSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC[N@H+]1C ZINC000536890242 566408889 /nfs/dbraw/zinc/40/88/89/566408889.db2.gz PUCMZKAAJINMGL-MAUKXSAKSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1NCc1ccc(Cl)cc1I ZINC000447566704 566415724 /nfs/dbraw/zinc/41/57/24/566415724.db2.gz VTQIEHZMPYPOLR-YGRLFVJLSA-N 2 1 378.685 3.374 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H](C)[C@@H](OC)c2ccc(Br)cc2)CC1 ZINC000537014786 566417864 /nfs/dbraw/zinc/41/78/64/566417864.db2.gz ZWUWZEMGXFWTKQ-RDTXWAMCSA-N 2 1 385.346 3.226 20 0 GGADMP COC(=O)CC[N@H+](CC[C@H]1CCC[NH+]1C)Cc1cccc(Br)c1 ZINC000484312429 566424272 /nfs/dbraw/zinc/42/42/72/566424272.db2.gz QHTLHRCSSVATJO-QGZVFWFLSA-N 2 1 383.330 3.299 20 0 GGADMP COC(=O)CC[N@@H+](CC[C@H]1CCC[NH+]1C)Cc1cccc(Br)c1 ZINC000484312429 566424282 /nfs/dbraw/zinc/42/42/82/566424282.db2.gz QHTLHRCSSVATJO-QGZVFWFLSA-N 2 1 383.330 3.299 20 0 GGADMP COC(=O)CC[NH+](CC[C@H]1CCC[N@@H+]1C)Cc1cccc(Br)c1 ZINC000484312429 566424288 /nfs/dbraw/zinc/42/42/88/566424288.db2.gz QHTLHRCSSVATJO-QGZVFWFLSA-N 2 1 383.330 3.299 20 0 GGADMP COC(=O)CC[NH+](CC[C@H]1CCC[N@H+]1C)Cc1cccc(Br)c1 ZINC000484312429 566424294 /nfs/dbraw/zinc/42/42/94/566424294.db2.gz QHTLHRCSSVATJO-QGZVFWFLSA-N 2 1 383.330 3.299 20 0 GGADMP COC(=O)CC[N@H+](CCCn1cc[nH+]c1C)Cc1cccc(Br)c1 ZINC000484302252 566425571 /nfs/dbraw/zinc/42/55/71/566425571.db2.gz KELKTYZXWUSUPO-UHFFFAOYSA-N 2 1 394.313 3.409 20 0 GGADMP COC(=O)CC[N@@H+](CCCn1cc[nH+]c1C)Cc1cccc(Br)c1 ZINC000484302252 566425575 /nfs/dbraw/zinc/42/55/75/566425575.db2.gz KELKTYZXWUSUPO-UHFFFAOYSA-N 2 1 394.313 3.409 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(OC)ccc2Br)C1 ZINC000537649301 566459979 /nfs/dbraw/zinc/45/99/79/566459979.db2.gz YZDKWGOFDKOQSR-QGZVFWFLSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cc(OC)ccc2Br)C1 ZINC000537649301 566459985 /nfs/dbraw/zinc/45/99/85/566459985.db2.gz YZDKWGOFDKOQSR-QGZVFWFLSA-N 2 1 385.346 3.390 20 0 GGADMP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]C[C@@H](O)COc1cccc(Cl)c1Cl ZINC000422899338 566464558 /nfs/dbraw/zinc/46/45/58/566464558.db2.gz HDXADKIXNQEYMR-YSVLISHTSA-N 2 1 383.319 3.281 20 0 GGADMP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C[C@H](O)COc1cccc(Cl)c1Cl ZINC000422899336 566464789 /nfs/dbraw/zinc/46/47/89/566464789.db2.gz HDXADKIXNQEYMR-QRTARXTBSA-N 2 1 383.319 3.281 20 0 GGADMP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]C[C@H](O)COc1cccc(Cl)c1Cl ZINC000422899330 566464937 /nfs/dbraw/zinc/46/49/37/566464937.db2.gz HDXADKIXNQEYMR-JLJPHGGASA-N 2 1 383.319 3.281 20 0 GGADMP COc1cc(Br)c(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422945132 566466906 /nfs/dbraw/zinc/46/69/06/566466906.db2.gz MOXHQBUPNJOXNY-LLVKDONJSA-N 2 1 394.313 3.479 20 0 GGADMP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000422989145 566468532 /nfs/dbraw/zinc/46/85/32/566468532.db2.gz KMESZRBPHFHEBF-SJORKVTESA-N 2 1 382.346 3.035 20 0 GGADMP COc1ccc(Br)cc1C[N@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000650705338 566471857 /nfs/dbraw/zinc/47/18/57/566471857.db2.gz DZLGBKFEJXRSDD-FDQGKXFDSA-N 2 1 383.330 3.176 20 0 GGADMP COc1sc(C[N@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)cc1Br ZINC000650708052 566472211 /nfs/dbraw/zinc/47/22/11/566472211.db2.gz SQIKEQYGMKDVHV-HUBLWGQQSA-N 2 1 389.359 3.238 20 0 GGADMP COc1cc(I)c(Cl)cc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423094117 566475180 /nfs/dbraw/zinc/47/51/80/566475180.db2.gz JLDQTFQHYOBSIE-DTWKUNHWSA-N 2 1 382.673 3.169 20 0 GGADMP COc1cc(I)c(Cl)cc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423094119 566475543 /nfs/dbraw/zinc/47/55/43/566475543.db2.gz JLDQTFQHYOBSIE-RKDXNWHRSA-N 2 1 382.673 3.169 20 0 GGADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Br)cc1OCCCO ZINC000423122755 566477394 /nfs/dbraw/zinc/47/73/94/566477394.db2.gz CTQGWRPOHSVLEJ-NTQSIJHJSA-N 2 1 383.330 3.144 20 0 GGADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H](CO)Cc2cc(F)cc(Br)c2)c2ccccc21 ZINC000423173733 566480105 /nfs/dbraw/zinc/48/01/05/566480105.db2.gz ZVITZDPRAXYEEU-UPRAQXHNSA-N 2 1 393.300 3.474 20 0 GGADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H](CO)Cc2cc(Br)ccc2F)c2ccccc21 ZINC000423161435 566480145 /nfs/dbraw/zinc/48/01/45/566480145.db2.gz NVGMPOPIYLOZMF-QQGDVQBRSA-N 2 1 393.300 3.474 20 0 GGADMP COC[C@]1(C[NH2+][C@@H](c2cccc(Br)c2)C2CCOCC2)CCC[NH2+]1 ZINC000423413376 566489077 /nfs/dbraw/zinc/48/90/77/566489077.db2.gz KBHJJFMPAAWFMS-RTBURBONSA-N 2 1 397.357 3.275 20 0 GGADMP C[C@@H]1CC[NH2+][C@@H](C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000423815390 566494505 /nfs/dbraw/zinc/49/45/05/566494505.db2.gz WGQNLUVFUUKXHU-FZKQIMNGSA-N 2 1 384.351 3.462 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ncc(I)s2)C1 ZINC000512142945 566517370 /nfs/dbraw/zinc/51/73/70/566517370.db2.gz BXDZYDIMLGTRIS-LBPRGKRZSA-N 2 1 393.338 3.349 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1cc(Cl)cc(I)c1 ZINC000424286027 566524610 /nfs/dbraw/zinc/52/46/10/566524610.db2.gz FRZVCZHESACREI-QMTHXVAHSA-N 2 1 378.685 3.374 20 0 GGADMP COc1ccc(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c(Br)c1OC ZINC000424285594 566525607 /nfs/dbraw/zinc/52/56/07/566525607.db2.gz FZTMJSDCQMFPQY-ZDUSSCGKSA-N 2 1 383.330 3.430 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000424297537 566526913 /nfs/dbraw/zinc/52/69/13/566526913.db2.gz SVZCBQOOXMZIOG-CQSZACIVSA-N 2 1 380.330 3.160 20 0 GGADMP C[C@@H](NC(=O)C[N@H+]1CC2(C[C@H]1C)CC[NH2+]CC2)c1ccc(Br)cc1 ZINC000424301176 566527285 /nfs/dbraw/zinc/52/72/85/566527285.db2.gz XJKIJVBDXNFNSP-HUUCEWRRSA-N 2 1 394.357 3.090 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2ccnc3c(Br)cccc23)CC1 ZINC000449103487 566529548 /nfs/dbraw/zinc/52/95/48/566529548.db2.gz BFNWTIHQKUDBEN-UHFFFAOYSA-N 2 1 378.314 3.198 20 0 GGADMP Cc1ccc(C[N@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)cc1Br ZINC000538721295 566530052 /nfs/dbraw/zinc/53/00/52/566530052.db2.gz AGFYDOSISIYKAY-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP Cc1ccc(C[N@@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)cc1Br ZINC000538721295 566530055 /nfs/dbraw/zinc/53/00/55/566530055.db2.gz AGFYDOSISIYKAY-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c(OC)c1 ZINC000424379266 566530123 /nfs/dbraw/zinc/53/01/23/566530123.db2.gz OHOQURVYGXPEJZ-ZDUSSCGKSA-N 2 1 383.330 3.430 20 0 GGADMP COc1cc(C[NH2+][C@@H]2CCCC[C@H]2[NH3+])cc(Br)c1OC(F)F ZINC000424384662 566531266 /nfs/dbraw/zinc/53/12/66/566531266.db2.gz VKJAABGQMCCDTO-VXGBXAGGSA-N 2 1 379.245 3.419 20 0 GGADMP CC1CC[NH+](C[C@H](O)C[NH2+]Cc2ccnc3c(Br)cccc23)CC1 ZINC000449128682 566531532 /nfs/dbraw/zinc/53/15/32/566531532.db2.gz ZUNRMUJUBHKTAH-MRXNPFEDSA-N 2 1 392.341 3.180 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2ccc(OC)c(Br)c2)C1 ZINC000538751389 566534050 /nfs/dbraw/zinc/53/40/50/566534050.db2.gz JKWDQIQKBMECPP-MRXNPFEDSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2ccc(OC)c(Br)c2)C1 ZINC000538751389 566534053 /nfs/dbraw/zinc/53/40/53/566534053.db2.gz JKWDQIQKBMECPP-MRXNPFEDSA-N 2 1 385.346 3.390 20 0 GGADMP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2cc(F)cc(Br)c2)CC1 ZINC000449195579 566535714 /nfs/dbraw/zinc/53/57/14/566535714.db2.gz ZMFKKNWYFNUAKG-QZTJIDSGSA-N 2 1 385.321 3.446 20 0 GGADMP Brc1cccc2c1CCC[C@@H]2[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1 ZINC000578618602 566539118 /nfs/dbraw/zinc/53/91/18/566539118.db2.gz IRRUZPDHXHLOQY-INIZCTEOSA-N 2 1 390.329 3.201 20 0 GGADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCC(=O)Nc3cccc(Br)c3)C2)C1 ZINC000559311892 566540740 /nfs/dbraw/zinc/54/07/40/566540740.db2.gz PGKACPRCDLLXFJ-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCC(=O)Nc3cccc(Br)c3)C2)C1 ZINC000559311892 566540747 /nfs/dbraw/zinc/54/07/47/566540747.db2.gz PGKACPRCDLLXFJ-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCC(=O)Nc3cccc(Br)c3)C2)C1 ZINC000559311892 566540755 /nfs/dbraw/zinc/54/07/55/566540755.db2.gz PGKACPRCDLLXFJ-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cn3cc(Br)ccc3n2)C1 ZINC000673756720 566554358 /nfs/dbraw/zinc/55/43/58/566554358.db2.gz IXPQXAWEBSWEKG-KRWDZBQOSA-N 2 1 395.345 3.030 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cn3cc(Br)ccc3n2)C1 ZINC000673756720 566554365 /nfs/dbraw/zinc/55/43/65/566554365.db2.gz IXPQXAWEBSWEKG-KRWDZBQOSA-N 2 1 395.345 3.030 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCn1cc(Br)cn1 ZINC000512972098 566570703 /nfs/dbraw/zinc/57/07/03/566570703.db2.gz PZZCEWREWZCALD-UHFFFAOYSA-N 2 1 379.346 3.393 20 0 GGADMP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046747 566573778 /nfs/dbraw/zinc/57/37/78/566573778.db2.gz BJNSIWMOIXSRCR-HUUCEWRRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046747 566573785 /nfs/dbraw/zinc/57/37/85/566573785.db2.gz BJNSIWMOIXSRCR-HUUCEWRRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046747 566573789 /nfs/dbraw/zinc/57/37/89/566573789.db2.gz BJNSIWMOIXSRCR-HUUCEWRRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046747 566573791 /nfs/dbraw/zinc/57/37/91/566573791.db2.gz BJNSIWMOIXSRCR-HUUCEWRRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046745 566573994 /nfs/dbraw/zinc/57/39/94/566573994.db2.gz BJNSIWMOIXSRCR-CABCVRRESA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046745 566574000 /nfs/dbraw/zinc/57/40/00/566574000.db2.gz BJNSIWMOIXSRCR-CABCVRRESA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046745 566574006 /nfs/dbraw/zinc/57/40/06/566574006.db2.gz BJNSIWMOIXSRCR-CABCVRRESA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000674046745 566574011 /nfs/dbraw/zinc/57/40/11/566574011.db2.gz BJNSIWMOIXSRCR-CABCVRRESA-N 2 1 375.340 3.397 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1Br ZINC000449599466 566580832 /nfs/dbraw/zinc/58/08/32/566580832.db2.gz LASMTYSNJYIACB-KSZLIROESA-N 2 1 381.358 3.125 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2ccc(F)c(Br)c2)[C@@H](C)C1 ZINC000449680471 566591183 /nfs/dbraw/zinc/59/11/83/566591183.db2.gz HAYUSDKBWWSBRS-YEWWUXTCSA-N 2 1 387.337 3.059 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000449684987 566593262 /nfs/dbraw/zinc/59/32/62/566593262.db2.gz QSAIBONAXIDRFN-CGTJXYLNSA-N 2 1 381.358 3.125 20 0 GGADMP CC[C@H]([NH2+]CCC[N@H+](C)CC(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000652221983 566598765 /nfs/dbraw/zinc/59/87/65/566598765.db2.gz BJYMPNSBYDKGGD-KRWDZBQOSA-N 2 1 389.993 3.267 20 0 GGADMP CC[C@H]([NH2+]CCC[N@@H+](C)CC(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000652221983 566598769 /nfs/dbraw/zinc/59/87/69/566598769.db2.gz BJYMPNSBYDKGGD-KRWDZBQOSA-N 2 1 389.993 3.267 20 0 GGADMP CC[C@@H]([NH2+]CCC[N@H+](C)CC(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000652221984 566598848 /nfs/dbraw/zinc/59/88/48/566598848.db2.gz BJYMPNSBYDKGGD-QGZVFWFLSA-N 2 1 389.993 3.267 20 0 GGADMP CC[C@@H]([NH2+]CCC[N@@H+](C)CC(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000652221984 566598854 /nfs/dbraw/zinc/59/88/54/566598854.db2.gz BJYMPNSBYDKGGD-QGZVFWFLSA-N 2 1 389.993 3.267 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](CCOc3ccccc3Br)C2)C1 ZINC000652349176 566603122 /nfs/dbraw/zinc/60/31/22/566603122.db2.gz DUILNJOYBQQDST-RKVPGOIHSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](CCOc3cccc(Br)c3)C2)C1 ZINC000652349417 566603444 /nfs/dbraw/zinc/60/34/44/566603444.db2.gz OJUHWLASINSCRC-YXJHDRRASA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](CC(=O)Nc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000652345666 566603634 /nfs/dbraw/zinc/60/36/34/566603634.db2.gz IHFQPDFOMCQOIS-PBFPGSCMSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](CCOc3cccc(Br)c3)C2)C1 ZINC000652349416 566603744 /nfs/dbraw/zinc/60/37/44/566603744.db2.gz OJUHWLASINSCRC-QGPMSJSTSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](CC(=O)Nc3cccc(Cl)c3Cl)C2)C1 ZINC000652345754 566603898 /nfs/dbraw/zinc/60/38/98/566603898.db2.gz LCURQVWBZDVJMU-IOASZLSFSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](CC(=O)Nc3cccc(Cl)c3Cl)C2)C1 ZINC000652345754 566603900 /nfs/dbraw/zinc/60/39/00/566603900.db2.gz LCURQVWBZDVJMU-IOASZLSFSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](CC(=O)Nc3cc(Cl)ccc3Cl)C2)C1 ZINC000652346157 566603920 /nfs/dbraw/zinc/60/39/20/566603920.db2.gz UYOJLRQIGSEZRG-MRRJBJDNSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](CC(=O)Nc3cc(Cl)ccc3Cl)C2)C1 ZINC000652346157 566603921 /nfs/dbraw/zinc/60/39/21/566603921.db2.gz UYOJLRQIGSEZRG-MRRJBJDNSA-N 2 1 386.323 3.150 20 0 GGADMP Cc1cc(C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)sc1Br ZINC000513572547 566610272 /nfs/dbraw/zinc/61/02/72/566610272.db2.gz NHFOYCCIHIHCLG-CYBMUJFWSA-N 2 1 375.376 3.344 20 0 GGADMP Cc1cc(Br)c(C[N@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)s1 ZINC000560360018 566618825 /nfs/dbraw/zinc/61/88/25/566618825.db2.gz PSLQLINSVVEPCK-HNNXBMFYSA-N 2 1 386.403 3.419 20 0 GGADMP Cc1cc(Br)c(C[N@@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)s1 ZINC000560360018 566618828 /nfs/dbraw/zinc/61/88/28/566618828.db2.gz PSLQLINSVVEPCK-HNNXBMFYSA-N 2 1 386.403 3.419 20 0 GGADMP CN(C)c1ncc(C[NH+]2CCC(Oc3cccc(Br)c3)CC2)n1C ZINC000425336786 566631636 /nfs/dbraw/zinc/63/16/36/566631636.db2.gz LVOQITDEOBEJQB-UHFFFAOYSA-N 2 1 393.329 3.292 20 0 GGADMP Brc1cnn(CC[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c1 ZINC000560580591 566641388 /nfs/dbraw/zinc/64/13/88/566641388.db2.gz KVUIMZZSTNZZAT-NZSAHSFTSA-N 2 1 389.341 3.146 20 0 GGADMP C[C@H]1C[N@H+](C)C[C@@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487013163 566643478 /nfs/dbraw/zinc/64/34/78/566643478.db2.gz LGBYQCHWTJQERE-UGSOOPFHSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487013163 566643486 /nfs/dbraw/zinc/64/34/86/566643486.db2.gz LGBYQCHWTJQERE-UGSOOPFHSA-N 2 1 384.351 3.272 20 0 GGADMP O=C(NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CCC[NH2+]CC1 ZINC000653153736 566654624 /nfs/dbraw/zinc/65/46/24/566654624.db2.gz YFHZXQIPMFCQBO-OAHLLOKOSA-N 2 1 384.351 3.464 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(Br)cc1 ZINC000607055548 566655729 /nfs/dbraw/zinc/65/57/29/566655729.db2.gz JUDPKPBUOBGFLP-KRWDZBQOSA-N 2 1 397.361 3.329 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000560824279 566661067 /nfs/dbraw/zinc/66/10/67/566661067.db2.gz CQFBUCDGAXHWJE-NSHDSACASA-N 2 1 376.303 3.384 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000560824274 566661705 /nfs/dbraw/zinc/66/17/05/566661705.db2.gz CQFBUCDGAXHWJE-LLVKDONJSA-N 2 1 376.303 3.384 20 0 GGADMP CCSc1ccc(C[N@@H+]2CC[C@H](N3CC[NH2+]CC3)C2)c(Br)c1 ZINC000629539046 566664358 /nfs/dbraw/zinc/66/43/58/566664358.db2.gz VEJWYSYGYQDKCH-HNNXBMFYSA-N 2 1 384.387 3.041 20 0 GGADMP CCSc1ccc(C[N@H+]2CC[C@H](N3CC[NH2+]CC3)C2)c(Br)c1 ZINC000629539046 566664362 /nfs/dbraw/zinc/66/43/62/566664362.db2.gz VEJWYSYGYQDKCH-HNNXBMFYSA-N 2 1 384.387 3.041 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](CCOc2cc(F)cc(Br)c2)CC[C@@H]1C(F)(F)F ZINC000629560477 566666041 /nfs/dbraw/zinc/66/60/41/566666041.db2.gz DLJMFUNTSGAEID-HZMBPMFUSA-N 2 1 399.226 3.426 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCOc2cc(F)cc(Br)c2)CC[C@@H]1C(F)(F)F ZINC000629560477 566666046 /nfs/dbraw/zinc/66/60/46/566666046.db2.gz DLJMFUNTSGAEID-HZMBPMFUSA-N 2 1 399.226 3.426 20 0 GGADMP CSc1ccccc1NC(=O)CC[N@H+]1CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629567685 566666085 /nfs/dbraw/zinc/66/60/85/566666085.db2.gz PYXWAAPQTBSQIV-CHWSQXEVSA-N 2 1 375.460 3.196 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](CCOc2cccc(Br)c2)CC[C@@H]1C(F)(F)F ZINC000629562508 566666359 /nfs/dbraw/zinc/66/63/59/566666359.db2.gz NQTJZHQHEJFOKC-RISCZKNCSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCOc2cccc(Br)c2)CC[C@@H]1C(F)(F)F ZINC000629562508 566666360 /nfs/dbraw/zinc/66/63/60/566666360.db2.gz NQTJZHQHEJFOKC-RISCZKNCSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](CCC(=O)Nc2ccc(Cl)cc2F)CC[C@@H]1C(F)(F)F ZINC000629569624 566667907 /nfs/dbraw/zinc/66/79/07/566667907.db2.gz YEJVOVINCWLIDS-PWSUYJOCSA-N 2 1 381.801 3.267 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc(Cl)cc2F)CC[C@@H]1C(F)(F)F ZINC000629569624 566667913 /nfs/dbraw/zinc/66/79/13/566667913.db2.gz YEJVOVINCWLIDS-PWSUYJOCSA-N 2 1 381.801 3.267 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[C@@H]1CCCCC[NH2+]1 ZINC000580201312 566673206 /nfs/dbraw/zinc/67/32/06/566673206.db2.gz HKIBXXJCLCVYKB-SFHVURJKSA-N 2 1 394.357 3.062 20 0 GGADMP Cn1c[nH+]cc1CCC[NH2+]C1(c2cccc(Br)c2)CCOCC1 ZINC000653574125 566677796 /nfs/dbraw/zinc/67/77/96/566677796.db2.gz DRGHIKSRSWMMPE-UHFFFAOYSA-N 2 1 378.314 3.411 20 0 GGADMP O=C(C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000515053348 566687264 /nfs/dbraw/zinc/68/72/64/566687264.db2.gz QKARDBQBVVUEHQ-IXDOHACOSA-N 2 1 380.330 3.288 20 0 GGADMP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](CC(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000561283678 566690378 /nfs/dbraw/zinc/69/03/78/566690378.db2.gz VKXYGGLNZSXKBZ-DYVFJYSZSA-N 2 1 386.323 3.150 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)Nc1ccccc1Br ZINC000561278913 566690773 /nfs/dbraw/zinc/69/07/73/566690773.db2.gz SYDGIQKEQPCASA-DLBZAZTESA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)Nc1ccccc1Br ZINC000561278913 566690779 /nfs/dbraw/zinc/69/07/79/566690779.db2.gz SYDGIQKEQPCASA-DLBZAZTESA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)Nc1ccccc1Br ZINC000561278914 566690895 /nfs/dbraw/zinc/69/08/95/566690895.db2.gz SYDGIQKEQPCASA-IAGOWNOFSA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)Nc1ccccc1Br ZINC000561278914 566690905 /nfs/dbraw/zinc/69/09/05/566690905.db2.gz SYDGIQKEQPCASA-IAGOWNOFSA-N 2 1 380.330 3.384 20 0 GGADMP C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccnc2c(Br)cccc12 ZINC000561356683 566698130 /nfs/dbraw/zinc/69/81/30/566698130.db2.gz XZUBHNHVYCCVKX-KBPBESRZSA-N 2 1 376.298 3.297 20 0 GGADMP O=C(NC[C@H]1CCC[NH2+]1)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000580539744 566702845 /nfs/dbraw/zinc/70/28/45/566702845.db2.gz LQFMYCDNHQDDDI-OAHLLOKOSA-N 2 1 385.339 3.009 20 0 GGADMP O=C(NC[C@@H]1CCC[NH2+]1)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000580539743 566703091 /nfs/dbraw/zinc/70/30/91/566703091.db2.gz LQFMYCDNHQDDDI-HNNXBMFYSA-N 2 1 385.339 3.009 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@H]2CCCc3c(Br)cccc32)CC1 ZINC000541223564 566704076 /nfs/dbraw/zinc/70/40/76/566704076.db2.gz MLBJERZTENOTLX-IBGZPJMESA-N 2 1 380.374 3.444 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(CC[NH+](C)C)Cc1ccc(Br)cc1 ZINC000468706284 566721084 /nfs/dbraw/zinc/72/10/84/566721084.db2.gz JCOOSVMHACRADF-IYBDPMFKSA-N 2 1 396.373 3.212 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H](C[NH3+])C2(C1)CCOCC2 ZINC000580774760 566721292 /nfs/dbraw/zinc/72/12/92/566721292.db2.gz MALUBYVFERJFKS-OLZOCXBDSA-N 2 1 386.323 3.008 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H](C[NH3+])C2(C1)CCOCC2 ZINC000580774760 566721299 /nfs/dbraw/zinc/72/12/99/566721299.db2.gz MALUBYVFERJFKS-OLZOCXBDSA-N 2 1 386.323 3.008 20 0 GGADMP CC(C)[N@@H+](C)CC(=O)N(Cc1ccccc1Br)C1CC[NH+](C)CC1 ZINC000426784170 566729471 /nfs/dbraw/zinc/72/94/71/566729471.db2.gz LVLRRTOMBIYEPV-UHFFFAOYSA-N 2 1 396.373 3.212 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000468864149 566738974 /nfs/dbraw/zinc/73/89/74/566738974.db2.gz GMFJXONPECZMQM-BZUAXINKSA-N 2 1 383.989 3.380 20 0 GGADMP Brc1ccc([C@@H]([NH2+]Cc2nnc(C3CC[NH2+]CC3)[nH]2)C2CC2)cc1 ZINC000581245821 566760715 /nfs/dbraw/zinc/76/07/15/566760715.db2.gz OHSAJZWUTGCKPM-KRWDZBQOSA-N 2 1 390.329 3.275 20 0 GGADMP Brc1cccc(-c2noc(C[N@H+]3CCC[C@@H]([C@H]4CC[NH2+]C4)C3)n2)c1 ZINC000516469851 566763809 /nfs/dbraw/zinc/76/38/09/566763809.db2.gz XJNKBPBHYMDECN-LSDHHAIUSA-N 2 1 391.313 3.321 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)[C@@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000516567242 566769269 /nfs/dbraw/zinc/76/92/69/566769269.db2.gz VDLHVDLCAYRXDM-KHYOSLBOSA-N 2 1 396.373 3.107 20 0 GGADMP O=C(C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)Nc1cccc(Br)c1 ZINC000581364199 566770566 /nfs/dbraw/zinc/77/05/66/566770566.db2.gz IUPPPNRFBJHKEG-YESZJQIVSA-N 2 1 380.330 3.288 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C[C@@H](O)COc2ccc(Br)cc2)C1 ZINC000581364942 566772324 /nfs/dbraw/zinc/77/23/24/566772324.db2.gz URZJNJLFKXJIGU-FUHWJXTLSA-N 2 1 399.373 3.291 20 0 GGADMP CCC[N@@H+](C)[C@@H](CNC(=O)C[NH+](C)[C@@H]1CCSC1)c1ccc(Cl)cc1 ZINC000581445459 566778177 /nfs/dbraw/zinc/77/81/77/566778177.db2.gz BOEXFMNLCYETKJ-MSOLQXFVSA-N 2 1 383.989 3.276 20 0 GGADMP CCC[NH+](C)[C@@H](CNC(=O)C[N@H+](C)[C@@H]1CCSC1)c1ccc(Cl)cc1 ZINC000581445459 566778184 /nfs/dbraw/zinc/77/81/84/566778184.db2.gz BOEXFMNLCYETKJ-MSOLQXFVSA-N 2 1 383.989 3.276 20 0 GGADMP CCC[N@@H+](C)[C@@H](CNC(=O)C[NH+](C)[C@H]1CCSC1)c1ccc(Cl)cc1 ZINC000581445461 566778298 /nfs/dbraw/zinc/77/82/98/566778298.db2.gz BOEXFMNLCYETKJ-ROUUACIJSA-N 2 1 383.989 3.276 20 0 GGADMP CCC[NH+](C)[C@@H](CNC(=O)C[N@H+](C)[C@H]1CCSC1)c1ccc(Cl)cc1 ZINC000581445461 566778306 /nfs/dbraw/zinc/77/83/06/566778306.db2.gz BOEXFMNLCYETKJ-ROUUACIJSA-N 2 1 383.989 3.276 20 0 GGADMP CCOc1c(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc1OC ZINC000469888308 566824716 /nfs/dbraw/zinc/82/47/16/566824716.db2.gz KIAIRVPZRPAADW-LZWOXQAQSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1c(Br)cc(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc1OC ZINC000469888308 566824719 /nfs/dbraw/zinc/82/47/19/566824719.db2.gz KIAIRVPZRPAADW-LZWOXQAQSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1c(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc1OC ZINC000469888307 566825110 /nfs/dbraw/zinc/82/51/10/566825110.db2.gz KIAIRVPZRPAADW-DZKIICNBSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1c(Br)cc(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc1OC ZINC000469888307 566825115 /nfs/dbraw/zinc/82/51/15/566825115.db2.gz KIAIRVPZRPAADW-DZKIICNBSA-N 2 1 383.330 3.416 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1Br ZINC000678929731 566825445 /nfs/dbraw/zinc/82/54/45/566825445.db2.gz MCGUKAQCJSGMBL-INIZCTEOSA-N 2 1 383.330 3.191 20 0 GGADMP O=C(NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)N[C@H]1CCC[NH2+]C1 ZINC000562805931 566825838 /nfs/dbraw/zinc/82/58/38/566825838.db2.gz XHBJCNMZEYLKFE-KRWDZBQOSA-N 2 1 385.339 3.009 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)Oc1cccc(Br)c1 ZINC000655719553 566838370 /nfs/dbraw/zinc/83/83/70/566838370.db2.gz VXDUPJUQIQLUFD-PBHICJAKSA-N 2 1 383.330 3.059 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)Oc1cccc(Br)c1 ZINC000655719845 566838509 /nfs/dbraw/zinc/83/85/09/566838509.db2.gz YTIWKQUSYBITFB-HNAYVOBHSA-N 2 1 397.357 3.449 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)Oc1ccc(Br)cc1 ZINC000655719329 566838694 /nfs/dbraw/zinc/83/86/94/566838694.db2.gz VDABOICLEJXXQI-PBHICJAKSA-N 2 1 383.330 3.059 20 0 GGADMP Fc1cc(Br)ccc1CCC[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655716657 566838896 /nfs/dbraw/zinc/83/88/96/566838896.db2.gz WPUFUBZHERONMN-KRWDZBQOSA-N 2 1 385.321 3.364 20 0 GGADMP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3cccc(Br)c3)nc2C)C1 ZINC000655711330 566839067 /nfs/dbraw/zinc/83/90/67/566839067.db2.gz HPKKAPKEOAOHKH-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3cccc(Br)c3)nc2C)C1 ZINC000655711330 566839072 /nfs/dbraw/zinc/83/90/72/566839072.db2.gz HPKKAPKEOAOHKH-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)Oc1cccc(Br)c1 ZINC000655719555 566839162 /nfs/dbraw/zinc/83/91/62/566839162.db2.gz VXDUPJUQIQLUFD-WMLDXEAASA-N 2 1 383.330 3.059 20 0 GGADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@H](O)COCc2cccs2)[C@@H]1c1cccs1 ZINC000562994570 566841630 /nfs/dbraw/zinc/84/16/30/566841630.db2.gz CBQCAEKRTAYDAB-JTDSTZFVSA-N 2 1 380.579 3.360 20 0 GGADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@H](O)COCc2cccs2)[C@@H]1c1cccs1 ZINC000562994570 566841641 /nfs/dbraw/zinc/84/16/41/566841641.db2.gz CBQCAEKRTAYDAB-JTDSTZFVSA-N 2 1 380.579 3.360 20 0 GGADMP Brc1cccc(NCC[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)c1 ZINC000655750473 566842628 /nfs/dbraw/zinc/84/26/28/566842628.db2.gz BEPIZQBMASURNQ-SFHVURJKSA-N 2 1 382.346 3.094 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C[C@H](O)COc1cccc(Br)c1 ZINC000562986960 566842599 /nfs/dbraw/zinc/84/25/99/566842599.db2.gz DYFBMXVKLLTGJY-WMZOPIPTSA-N 2 1 399.373 3.433 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]Cc2oc3ccccc3c2Br)CC1(C)C ZINC000655769696 566846833 /nfs/dbraw/zinc/84/68/33/566846833.db2.gz MGGRTKIRXAEFNK-UHFFFAOYSA-N 2 1 380.330 3.311 20 0 GGADMP Brc1cc(C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc2c1OCCO2 ZINC000563135801 566857451 /nfs/dbraw/zinc/85/74/51/566857451.db2.gz UJZQXEQESCFHSS-HUUCEWRRSA-N 2 1 381.314 3.042 20 0 GGADMP Brc1cc(C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc2c1OCCO2 ZINC000563135800 566858354 /nfs/dbraw/zinc/85/83/54/566858354.db2.gz UJZQXEQESCFHSS-GJZGRUSLSA-N 2 1 381.314 3.042 20 0 GGADMP Clc1cccc(-n2cc(C[N@H+]3CCC[C@H]([C@H]4CC[NH2+]C4)C3)nn2)c1Cl ZINC000563136285 566858657 /nfs/dbraw/zinc/85/86/57/566858657.db2.gz XEBGOCLXIYUVTO-KBPBESRZSA-N 2 1 380.323 3.396 20 0 GGADMP O=C1[C@H]([N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)CCN1c1ccc(Cl)cc1Cl ZINC000563155020 566860601 /nfs/dbraw/zinc/86/06/01/566860601.db2.gz XYCKYNRIRKXCLJ-HBUWYVDXSA-N 2 1 382.335 3.420 20 0 GGADMP CC[NH+]1CCC([NH+]2CCC(C(=O)Nc3nc4ccsc4s3)CC2)CC1 ZINC000582555234 566874621 /nfs/dbraw/zinc/87/46/21/566874621.db2.gz KHWZIFCAVPKMNM-UHFFFAOYSA-N 2 1 378.567 3.493 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1Br)[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000582726768 566889737 /nfs/dbraw/zinc/88/97/37/566889737.db2.gz LRFSUVOGBMNCJP-KFWWJZLASA-N 2 1 380.330 3.098 20 0 GGADMP C[C@H](C(=O)Nc1ccccc1Br)[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000582726768 566889745 /nfs/dbraw/zinc/88/97/45/566889745.db2.gz LRFSUVOGBMNCJP-KFWWJZLASA-N 2 1 380.330 3.098 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cncc(Br)c1 ZINC000518566017 566892080 /nfs/dbraw/zinc/89/20/80/566892080.db2.gz WLHJOUAYGYVIDD-KUHUBIRLSA-N 2 1 390.325 3.262 20 0 GGADMP O=C(CC[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)Nc1cc(Cl)cc(Cl)c1 ZINC000656260845 566895872 /nfs/dbraw/zinc/89/58/72/566895872.db2.gz WSLSWQDVCUMIID-KRWDZBQOSA-N 2 1 386.323 3.165 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)CC[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000680479011 566911562 /nfs/dbraw/zinc/91/15/62/566911562.db2.gz RBWGMAUVHYGINY-HZPDHXFCSA-N 2 1 380.330 3.303 20 0 GGADMP CN(CC[N@@H+](C)Cc1ccc(OC(F)F)c(Cl)c1)C1CC[NH+](C)CC1 ZINC000582991878 566911980 /nfs/dbraw/zinc/91/19/80/566911980.db2.gz JALIDQJLQWHXND-UHFFFAOYSA-N 2 1 375.891 3.399 20 0 GGADMP C[C@H](NCc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(Br)cn1 ZINC000583178964 566926941 /nfs/dbraw/zinc/92/69/41/566926941.db2.gz WHGCUJCJQRBJAS-KSSFIOAISA-N 2 1 390.325 3.262 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(Br)cn1 ZINC000583178964 566926950 /nfs/dbraw/zinc/92/69/50/566926950.db2.gz WHGCUJCJQRBJAS-KSSFIOAISA-N 2 1 390.325 3.262 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cncc(Br)c1 ZINC000583333392 566940984 /nfs/dbraw/zinc/94/09/84/566940984.db2.gz NSZHFHOCFVMSDL-MORSLUCNSA-N 2 1 382.346 3.263 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cncc(Br)c1 ZINC000583333393 566941171 /nfs/dbraw/zinc/94/11/71/566941171.db2.gz NSZHFHOCFVMSDL-VHSSKADRSA-N 2 1 382.346 3.263 20 0 GGADMP O[C@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)COCc1cccs1 ZINC000564079003 566943437 /nfs/dbraw/zinc/94/34/37/566943437.db2.gz YWIMLJXXEVWRLT-DLBZAZTESA-N 2 1 380.579 3.189 20 0 GGADMP O[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)COCc1cccs1 ZINC000564079003 566943446 /nfs/dbraw/zinc/94/34/46/566943446.db2.gz YWIMLJXXEVWRLT-DLBZAZTESA-N 2 1 380.579 3.189 20 0 GGADMP COc1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c(Br)c1O ZINC000656784968 566950079 /nfs/dbraw/zinc/95/00/79/566950079.db2.gz FPKXZTHGYAZVPA-CQSZACIVSA-N 2 1 383.330 3.375 20 0 GGADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cccc(I)c3)C2)CC1 ZINC000564250381 566957747 /nfs/dbraw/zinc/95/77/47/566957747.db2.gz DOSJHGJIFSOENK-INIZCTEOSA-N 2 1 384.305 3.455 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000564329427 566965485 /nfs/dbraw/zinc/96/54/85/566965485.db2.gz GRAKBFILXRZJNI-ZIAGYGMSSA-N 2 1 398.320 3.238 20 0 GGADMP C[NH+](C)CC1CC[NH+](Cc2nc(Cc3cccc(Br)c3)no2)CC1 ZINC000520239325 566991910 /nfs/dbraw/zinc/99/19/10/566991910.db2.gz ACUGFSKNYHVBCM-UHFFFAOYSA-N 2 1 393.329 3.197 20 0 GGADMP Cc1cc(NC(=O)C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)ccc1Br ZINC000583934970 566995976 /nfs/dbraw/zinc/99/59/76/566995976.db2.gz GCEJDMBCEOXNDN-HNNXBMFYSA-N 2 1 380.330 3.018 20 0 GGADMP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000545150993 567021945 /nfs/dbraw/zinc/02/19/45/567021945.db2.gz HROYRBRZIFBYKU-QGZVFWFLSA-N 2 1 381.339 3.334 20 0 GGADMP C[N@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000545150993 567021950 /nfs/dbraw/zinc/02/19/50/567021950.db2.gz HROYRBRZIFBYKU-QGZVFWFLSA-N 2 1 381.339 3.334 20 0 GGADMP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000545150992 567022212 /nfs/dbraw/zinc/02/22/12/567022212.db2.gz HROYRBRZIFBYKU-KRWDZBQOSA-N 2 1 381.339 3.334 20 0 GGADMP C[N@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000545150992 567022216 /nfs/dbraw/zinc/02/22/16/567022216.db2.gz HROYRBRZIFBYKU-KRWDZBQOSA-N 2 1 381.339 3.334 20 0 GGADMP CC(C)[C@@H]([NH3+])CC[N@H+](C)[C@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000430583538 567022790 /nfs/dbraw/zinc/02/27/90/567022790.db2.gz MWKCAYCFBOYRSP-PBHICJAKSA-N 2 1 384.362 3.101 20 0 GGADMP CC(C)[C@@H]([NH3+])CC[N@@H+](C)[C@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000430583538 567022796 /nfs/dbraw/zinc/02/27/96/567022796.db2.gz MWKCAYCFBOYRSP-PBHICJAKSA-N 2 1 384.362 3.101 20 0 GGADMP O=C(NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1C[C@]12CC[NH2+]C2 ZINC000564939620 567023023 /nfs/dbraw/zinc/02/30/23/567023023.db2.gz FKWFAKQWZAWRQF-MJGOQNOKSA-N 2 1 382.335 3.074 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(OCCC[NH3+])CC1)c1ccc(Cl)cc1Cl ZINC000430599523 567024420 /nfs/dbraw/zinc/02/44/20/567024420.db2.gz VWVLIPQJDFVFIO-CYBMUJFWSA-N 2 1 388.339 3.000 20 0 GGADMP C[C@@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@@]1(O)CC[N@H+](C)C1 ZINC000545161394 567024475 /nfs/dbraw/zinc/02/44/75/567024475.db2.gz UHGOQFZFVQEEIC-LIRRHRJNSA-N 2 1 393.325 3.026 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000564986075 567027161 /nfs/dbraw/zinc/02/71/61/567027161.db2.gz DMRUIJIKKSJTLM-OAHLLOKOSA-N 2 1 380.330 3.018 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Br)cc1)[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000564988728 567027456 /nfs/dbraw/zinc/02/74/56/567027456.db2.gz OSFCSYXZFCNQJL-KFWWJZLASA-N 2 1 380.330 3.098 20 0 GGADMP Cc1cc(NC(=O)C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)ccc1Br ZINC000564989602 567027732 /nfs/dbraw/zinc/02/77/32/567027732.db2.gz TXSUNQSHROUQDY-LSDHHAIUSA-N 2 1 380.330 3.018 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000472483215 567028150 /nfs/dbraw/zinc/02/81/50/567028150.db2.gz HKIHGFLEUDCCDG-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000472483215 567028154 /nfs/dbraw/zinc/02/81/54/567028154.db2.gz HKIHGFLEUDCCDG-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000472483215 567028159 /nfs/dbraw/zinc/02/81/59/567028159.db2.gz HKIHGFLEUDCCDG-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)[N@@H+](C)CCCN(C)CC[NH+](C)C ZINC000565115660 567040367 /nfs/dbraw/zinc/04/03/67/567040367.db2.gz LHBNROQVSRLFAB-AWEZNQCLSA-N 2 1 389.371 3.136 20 0 GGADMP C[C@H](NCc1cnc2n1CCC2)c1ccc(Br)cc1OCCCO ZINC000657472262 567061099 /nfs/dbraw/zinc/06/10/99/567061099.db2.gz KZQGOHKANFNTBP-ZDUSSCGKSA-N 2 1 394.313 3.204 20 0 GGADMP Brc1ccc2c(c1)[C@@H]([NH2+]Cc1nnc(C3CC[NH2+]CC3)[nH]1)CCC2 ZINC000565475809 567070596 /nfs/dbraw/zinc/07/05/96/567070596.db2.gz FPTORXYBDZYDBN-INIZCTEOSA-N 2 1 390.329 3.201 20 0 GGADMP C[C@H](Cc1ccc(F)cc1Br)[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000584861407 567075121 /nfs/dbraw/zinc/07/51/21/567075121.db2.gz DYYTUQGRGVVMRA-OAHLLOKOSA-N 2 1 386.353 3.136 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H](CO)Cc1ccc(F)c(Br)c1 ZINC000453336312 567076065 /nfs/dbraw/zinc/07/60/65/567076065.db2.gz ALTICLYBEBGOCY-GGKPKWOWSA-N 2 1 387.337 3.058 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H](CO)Cc1ccc(F)c(Br)c1 ZINC000453336313 567076797 /nfs/dbraw/zinc/07/67/97/567076797.db2.gz ALTICLYBEBGOCY-HOPMXRPOSA-N 2 1 387.337 3.058 20 0 GGADMP C[N@H+]1CC[C@@](O)(CN[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864906 567081086 /nfs/dbraw/zinc/08/10/86/567081086.db2.gz ARDZDYAWOKFKPH-DNVCBOLYSA-N 2 1 377.941 3.497 20 0 GGADMP C[N@@H+]1CC[C@@](O)(C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864906 567081094 /nfs/dbraw/zinc/08/10/94/567081094.db2.gz ARDZDYAWOKFKPH-DNVCBOLYSA-N 2 1 377.941 3.497 20 0 GGADMP C[N@H+]1CC[C@@](O)(C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864906 567081101 /nfs/dbraw/zinc/08/11/01/567081101.db2.gz ARDZDYAWOKFKPH-DNVCBOLYSA-N 2 1 377.941 3.497 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H](CO)Cc1cc(Br)ccc1F ZINC000453370234 567081256 /nfs/dbraw/zinc/08/12/56/567081256.db2.gz NEIWSEXNFMERCB-ZXTQRBJTSA-N 2 1 387.337 3.058 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)cc1Br ZINC000453380883 567083239 /nfs/dbraw/zinc/08/32/39/567083239.db2.gz RMYBQBLCJIBDSJ-JHDROBOHSA-N 2 1 383.374 3.227 20 0 GGADMP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000522001175 567093632 /nfs/dbraw/zinc/09/36/32/567093632.db2.gz HNHOEDNPEXMZIE-ZFWWWQNUSA-N 2 1 375.314 3.465 20 0 GGADMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000522001175 567093637 /nfs/dbraw/zinc/09/36/37/567093637.db2.gz HNHOEDNPEXMZIE-ZFWWWQNUSA-N 2 1 375.314 3.465 20 0 GGADMP CC(C)[C@@H](Cc1ccc(Br)cc1)[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000657845518 567100663 /nfs/dbraw/zinc/10/06/63/567100663.db2.gz LQZYBQBZGRGYRJ-LJQANCHMSA-N 2 1 383.374 3.453 20 0 GGADMP CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000565834277 567104042 /nfs/dbraw/zinc/10/40/42/567104042.db2.gz DTYKUCAZSXKNHS-HOTGVXAUSA-N 2 1 384.351 3.273 20 0 GGADMP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000546566233 567137253 /nfs/dbraw/zinc/13/72/53/567137253.db2.gz HWSSZOJGURKEEJ-KRWDZBQOSA-N 2 1 381.339 3.334 20 0 GGADMP C[N@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000546566233 567137258 /nfs/dbraw/zinc/13/72/58/567137258.db2.gz HWSSZOJGURKEEJ-KRWDZBQOSA-N 2 1 381.339 3.334 20 0 GGADMP CC(C)[C@H]([NH3+])CC[N@@H+](C)Cc1ccc(Br)cc1N1CCOCC1 ZINC000566230626 567140167 /nfs/dbraw/zinc/14/01/67/567140167.db2.gz SVPTUPZEBBKDMF-QGZVFWFLSA-N 2 1 384.362 3.091 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000566245157 567142356 /nfs/dbraw/zinc/14/23/56/567142356.db2.gz JIKUAIOQOUZOME-GJZGRUSLSA-N 2 1 380.330 3.099 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1)c1ccc(Cl)c(Cl)c1 ZINC000566245416 567142750 /nfs/dbraw/zinc/14/27/50/567142750.db2.gz QSOWUFCSBDIARL-NUEKZKHPSA-N 2 1 384.351 3.492 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]CCc2cn3cc(Br)cc(C)c3n2)[C@@H](C)C1 ZINC000546932656 567171762 /nfs/dbraw/zinc/17/17/62/567171762.db2.gz XMPGCCCAXSSLQE-YOEHRIQHSA-N 2 1 379.346 3.268 20 0 GGADMP CC[NH+](CC)CCN(Cc1ccc(Cl)cc1)C(=O)c1csc(C[NH3+])n1 ZINC000659356509 567208434 /nfs/dbraw/zinc/20/84/34/567208434.db2.gz GBTTXQPJCOVHAU-UHFFFAOYSA-N 2 1 380.945 3.239 20 0 GGADMP O[C@@H](C[NH2+][C@H]1CCCc2c3cc(Br)ccc3[nH]c21)C[NH+]1CCCC1 ZINC000567307644 567234932 /nfs/dbraw/zinc/23/49/32/567234932.db2.gz OAMONHRGHVLORG-KSSFIOAISA-N 2 1 392.341 3.354 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(Br)c1 ZINC000525372302 567245334 /nfs/dbraw/zinc/24/53/34/567245334.db2.gz CGEVMJPTVINZPX-KRWDZBQOSA-N 2 1 397.361 3.329 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Cc1ccc(Cl)cc1Cl ZINC000499524596 567256110 /nfs/dbraw/zinc/25/61/10/567256110.db2.gz WLMIWUKSVAWQBS-QGZVFWFLSA-N 2 1 386.367 3.410 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Cc1ccc(Cl)cc1Cl ZINC000499524595 567256342 /nfs/dbraw/zinc/25/63/42/567256342.db2.gz WLMIWUKSVAWQBS-KRWDZBQOSA-N 2 1 386.367 3.410 20 0 GGADMP C[N@H+](C[C@H](O)C[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1 ZINC000567691859 567268876 /nfs/dbraw/zinc/26/88/76/567268876.db2.gz HLHLZPXRYHRDFS-QGZVFWFLSA-N 2 1 386.367 3.003 20 0 GGADMP C[N@@H+](C[C@H](O)C[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1 ZINC000567691859 567268882 /nfs/dbraw/zinc/26/88/82/567268882.db2.gz HLHLZPXRYHRDFS-QGZVFWFLSA-N 2 1 386.367 3.003 20 0 GGADMP C[N@H+](C[C@@H](O)C[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1 ZINC000567691858 567269381 /nfs/dbraw/zinc/26/93/81/567269381.db2.gz HLHLZPXRYHRDFS-KRWDZBQOSA-N 2 1 386.367 3.003 20 0 GGADMP C[N@@H+](C[C@@H](O)C[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1 ZINC000567691858 567269384 /nfs/dbraw/zinc/26/93/84/567269384.db2.gz HLHLZPXRYHRDFS-KRWDZBQOSA-N 2 1 386.367 3.003 20 0 GGADMP C[C@@H]([NH2+]Cc1cnn2cc(Br)cnc12)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000638970753 567279636 /nfs/dbraw/zinc/27/96/36/567279636.db2.gz OUKSUNCJENLAGE-ZIAGYGMSSA-N 2 1 392.345 3.234 20 0 GGADMP C[C@@H]([NH2+]Cc1cnn2cc(Br)cnc12)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000638970753 567279641 /nfs/dbraw/zinc/27/96/41/567279641.db2.gz OUKSUNCJENLAGE-ZIAGYGMSSA-N 2 1 392.345 3.234 20 0 GGADMP CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000567894639 567288176 /nfs/dbraw/zinc/28/81/76/567288176.db2.gz KZBCDVHWIBPOPW-CVEARBPZSA-N 2 1 384.351 3.273 20 0 GGADMP CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000567894641 567288535 /nfs/dbraw/zinc/28/85/35/567288535.db2.gz KZBCDVHWIBPOPW-HZPDHXFCSA-N 2 1 384.351 3.273 20 0 GGADMP O=c1ccc(C[N@@H+](CCn2ccnc2)Cc2ccc(Br)o2)c[nH]1 ZINC000639175509 567292473 /nfs/dbraw/zinc/29/24/73/567292473.db2.gz PGGMJWIFTNNJQL-UHFFFAOYSA-N 2 1 377.242 3.042 20 0 GGADMP CC(C)(O)C[NH+]1CCC([NH2+][C@@H](CCO)c2cc(Cl)cc(Cl)c2)CC1 ZINC000639356445 567303697 /nfs/dbraw/zinc/30/36/97/567303697.db2.gz JLPYJSVOWILFMW-KRWDZBQOSA-N 2 1 375.340 3.242 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)Nc2cc(N(C)C)c(Br)cn2)C1 ZINC000455873600 567316298 /nfs/dbraw/zinc/31/62/98/567316298.db2.gz XZVIFOUHUJXFTH-CYBMUJFWSA-N 2 1 398.349 3.010 20 0 GGADMP O=C(C[N@@H+]1CC[C@@H](n2cnc3c2CCCC3)C1)NCc1ccc(Cl)s1 ZINC000548664978 567341220 /nfs/dbraw/zinc/34/12/20/567341220.db2.gz ISQVPIHTAUEICT-CYBMUJFWSA-N 2 1 378.929 3.040 20 0 GGADMP Brc1ccc(-c2n[nH]cc2C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)s1 ZINC000527638563 567355034 /nfs/dbraw/zinc/35/50/34/567355034.db2.gz XLKIRCZHNCSZGS-LLVKDONJSA-N 2 1 381.343 3.475 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2c[nH]nc2-c2ccc(Br)s2)CC1 ZINC000527646668 567355469 /nfs/dbraw/zinc/35/54/69/567355469.db2.gz YMVQYXKDEXBKDA-UHFFFAOYSA-N 2 1 399.358 3.101 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C[C@@H]21 ZINC000435377390 567357459 /nfs/dbraw/zinc/35/74/59/567357459.db2.gz BAKQFSDJHVFRSQ-VNQPRFMTSA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C[C@@H]21 ZINC000435377390 567357464 /nfs/dbraw/zinc/35/74/64/567357464.db2.gz BAKQFSDJHVFRSQ-VNQPRFMTSA-N 2 1 375.314 3.398 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000435374824 567358248 /nfs/dbraw/zinc/35/82/48/567358248.db2.gz YSRLWOJOXMPIHP-SGTLLEGYSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000435374824 567358252 /nfs/dbraw/zinc/35/82/52/567358252.db2.gz YSRLWOJOXMPIHP-SGTLLEGYSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000435377113 567358441 /nfs/dbraw/zinc/35/84/41/567358441.db2.gz YCUGYEPKDHMACX-IUODEOHRSA-N 2 1 377.330 3.421 20 0 GGADMP C[NH2+]C[C@H]1CC[N@H+](Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000435387171 567359661 /nfs/dbraw/zinc/35/96/61/567359661.db2.gz XSUNNWJSOPDLIF-OAHLLOKOSA-N 2 1 377.330 3.293 20 0 GGADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000435387171 567359664 /nfs/dbraw/zinc/35/96/64/567359664.db2.gz XSUNNWJSOPDLIF-OAHLLOKOSA-N 2 1 377.330 3.293 20 0 GGADMP Brc1csc(-c2noc(C[N@H+]3CCC[C@H]([C@H]4CC[NH2+]C4)C3)n2)c1 ZINC000569245481 567389156 /nfs/dbraw/zinc/38/91/56/567389156.db2.gz KLVGTOFYTLMEKW-RYUDHWBXSA-N 2 1 397.342 3.382 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)Cc2ccc(Br)c(F)c2)CC1 ZINC000501873323 567410886 /nfs/dbraw/zinc/41/08/86/567410886.db2.gz KUFLRSCZOOEQJA-UHFFFAOYSA-N 2 1 386.353 3.436 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](CCC[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436235940 567415931 /nfs/dbraw/zinc/41/59/31/567415931.db2.gz CUJNFZUDVXKYEH-CYBMUJFWSA-N 2 1 377.838 3.036 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436235940 567415934 /nfs/dbraw/zinc/41/59/34/567415934.db2.gz CUJNFZUDVXKYEH-CYBMUJFWSA-N 2 1 377.838 3.036 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+](CCSc2cccc(Cl)c2)C1)[C@@H]1CCC[NH2+]1 ZINC000662263754 567421931 /nfs/dbraw/zinc/42/19/31/567421931.db2.gz DSNZEOXRMNVBMH-YJBOKZPZSA-N 2 1 381.973 3.012 20 0 GGADMP [NH3+]Cc1cn([C@@H]2CCC[N@H+](Cc3oc4ccccc4c3Br)C2)nn1 ZINC000662281019 567424613 /nfs/dbraw/zinc/42/46/13/567424613.db2.gz HPSLCENYRJRDRM-CYBMUJFWSA-N 2 1 390.285 3.083 20 0 GGADMP [NH3+]Cc1cn([C@@H]2CCC[N@@H+](Cc3oc4ccccc4c3Br)C2)nn1 ZINC000662281019 567424618 /nfs/dbraw/zinc/42/46/18/567424618.db2.gz HPSLCENYRJRDRM-CYBMUJFWSA-N 2 1 390.285 3.083 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@@H]2c2ccc(Br)cn2)CC1 ZINC000550078191 567426455 /nfs/dbraw/zinc/42/64/55/567426455.db2.gz VZINFOFRTWSVHU-LJQANCHMSA-N 2 1 395.389 3.397 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@@H]2c2ccc(Br)cn2)CC1 ZINC000550078191 567426458 /nfs/dbraw/zinc/42/64/58/567426458.db2.gz VZINFOFRTWSVHU-LJQANCHMSA-N 2 1 395.389 3.397 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)c1cccc(F)c1 ZINC000662348669 567429016 /nfs/dbraw/zinc/42/90/16/567429016.db2.gz XKLZRFODGAQWGN-IAGOWNOFSA-N 2 1 394.288 3.007 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662386263 567431872 /nfs/dbraw/zinc/43/18/72/567431872.db2.gz AGIIPWUVBBDTCC-RVKKMQEKSA-N 2 1 396.373 3.323 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662386263 567431875 /nfs/dbraw/zinc/43/18/75/567431875.db2.gz AGIIPWUVBBDTCC-RVKKMQEKSA-N 2 1 396.373 3.323 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)c1ccc(F)cc1 ZINC000662396439 567433807 /nfs/dbraw/zinc/43/38/07/567433807.db2.gz BDRDFTNEZRXPGL-IRXDYDNUSA-N 2 1 394.288 3.007 20 0 GGADMP [NH3+][C@@H](C(=O)NC1CC[NH+](CC2CCCC2)CC1)c1ccccc1Br ZINC000662421034 567434935 /nfs/dbraw/zinc/43/49/35/567434935.db2.gz BTWCRYNXLLTBTR-GOSISDBHSA-N 2 1 394.357 3.220 20 0 GGADMP Cc1cc(Br)ccc1C(=O)Nc1c[nH+]ccc1N1CC[NH+](C)CC1 ZINC000619176667 567438555 /nfs/dbraw/zinc/43/85/55/567438555.db2.gz LZLBELJYKRCMMC-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP C[NH2+][C@H](C(=O)N1CC[C@@H](C[N@H+](C)CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000662486160 567441736 /nfs/dbraw/zinc/44/17/36/567441736.db2.gz LZHHNGFWKXXHSZ-KSSFIOAISA-N 2 1 384.351 3.444 20 0 GGADMP C[NH2+][C@H](C(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000662486160 567441739 /nfs/dbraw/zinc/44/17/39/567441739.db2.gz LZHHNGFWKXXHSZ-KSSFIOAISA-N 2 1 384.351 3.444 20 0 GGADMP C[NH2+][C@H](C(=O)N1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)c1cccc(Cl)c1Cl ZINC000662522273 567444501 /nfs/dbraw/zinc/44/45/01/567444501.db2.gz KKOWIXMCJPXTTA-DEYYWGMASA-N 2 1 384.351 3.492 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(C(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662526471 567446614 /nfs/dbraw/zinc/44/66/14/567446614.db2.gz FCVPPLFUOPONQU-JTOWHCCKSA-N 2 1 394.357 3.313 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662526471 567446619 /nfs/dbraw/zinc/44/66/19/567446619.db2.gz FCVPPLFUOPONQU-JTOWHCCKSA-N 2 1 394.357 3.313 20 0 GGADMP C[NH2+][C@H](C(=O)N1CCC([C@@H]2[NH2+]CC2(C)C)CC1)c1cccc(Cl)c1Cl ZINC000662578007 567451641 /nfs/dbraw/zinc/45/16/41/567451641.db2.gz OMZKNIUHGAMYKB-IRXDYDNUSA-N 2 1 384.351 3.491 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)C1CCCCC1 ZINC000662679954 567456060 /nfs/dbraw/zinc/45/60/60/567456060.db2.gz QISSOMAEMDUHOQ-IAGOWNOFSA-N 2 1 382.346 3.076 20 0 GGADMP C[N@@H+]1CC[C@H]([NH2+]CCCn2cc(Br)cn2)C[C@@H]1c1ccccc1 ZINC000550818273 567463647 /nfs/dbraw/zinc/46/36/47/567463647.db2.gz JLZVBSGLULJBIF-ZWKOTPCHSA-N 2 1 377.330 3.461 20 0 GGADMP C[N@H+]1CC[C@H]([NH2+]CCCn2cc(Br)cn2)C[C@@H]1c1ccccc1 ZINC000550818273 567463653 /nfs/dbraw/zinc/46/36/53/567463653.db2.gz JLZVBSGLULJBIF-ZWKOTPCHSA-N 2 1 377.330 3.461 20 0 GGADMP CC(C)[C@H](CNc1cc[nH+]c2ccc(Br)cc12)[NH+]1CCOCC1 ZINC000503569083 567495593 /nfs/dbraw/zinc/49/55/93/567495593.db2.gz NKVSYVNUYREORE-SFHVURJKSA-N 2 1 378.314 3.188 20 0 GGADMP Brc1cc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc2c1OCO2 ZINC000663347889 567499546 /nfs/dbraw/zinc/49/95/46/567499546.db2.gz ZGMCSXWILZTNSY-CQSZACIVSA-N 2 1 381.314 3.389 20 0 GGADMP Brc1cc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc2c1OCO2 ZINC000663347889 567499553 /nfs/dbraw/zinc/49/95/53/567499553.db2.gz ZGMCSXWILZTNSY-CQSZACIVSA-N 2 1 381.314 3.389 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cn3ccc(Br)cc3n2)C1 ZINC000570766929 567510951 /nfs/dbraw/zinc/51/09/51/567510951.db2.gz CDEIFZJSECFQNP-QGZVFWFLSA-N 2 1 395.345 3.030 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cn3ccc(Br)cc3n2)C1 ZINC000570766929 567510954 /nfs/dbraw/zinc/51/09/54/567510954.db2.gz CDEIFZJSECFQNP-QGZVFWFLSA-N 2 1 395.345 3.030 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cn3ccc(Br)cc3n2)C1 ZINC000570766928 567510975 /nfs/dbraw/zinc/51/09/75/567510975.db2.gz CDEIFZJSECFQNP-KRWDZBQOSA-N 2 1 395.345 3.030 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cn3ccc(Br)cc3n2)C1 ZINC000570766928 567510978 /nfs/dbraw/zinc/51/09/78/567510978.db2.gz CDEIFZJSECFQNP-KRWDZBQOSA-N 2 1 395.345 3.030 20 0 GGADMP Ic1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CC2 ZINC000595008519 567534516 /nfs/dbraw/zinc/53/45/16/567534516.db2.gz UTWRFRZZEJBLGD-PXAZEXFGSA-N 2 1 382.289 3.352 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CC2 ZINC000595010175 567534669 /nfs/dbraw/zinc/53/46/69/567534669.db2.gz IDUXPOJTJSYDJC-HLLBOEOZSA-N 2 1 382.289 3.495 20 0 GGADMP COC(=O)c1ccc(C[N@@H+]2CCCC23CC[NH+](C)CC3)c(Br)c1 ZINC000551803279 567536656 /nfs/dbraw/zinc/53/66/56/567536656.db2.gz PQCZADWSCXXYCK-UHFFFAOYSA-N 2 1 381.314 3.296 20 0 GGADMP COC(=O)c1ccc(C[N@H+]2CCCC23CC[NH+](C)CC3)c(Br)c1 ZINC000551803279 567536663 /nfs/dbraw/zinc/53/66/63/567536663.db2.gz PQCZADWSCXXYCK-UHFFFAOYSA-N 2 1 381.314 3.296 20 0 GGADMP C[N@@H+](Cc1ccccc1)C[C@H](O)C[NH2+]CCc1ccc(Br)s1 ZINC000644514723 567555467 /nfs/dbraw/zinc/55/54/67/567555467.db2.gz JDBOVRDZHWSIIE-OAHLLOKOSA-N 2 1 383.355 3.136 20 0 GGADMP C[N@H+](Cc1ccccc1)C[C@H](O)C[NH2+]CCc1ccc(Br)s1 ZINC000644514723 567555471 /nfs/dbraw/zinc/55/54/71/567555471.db2.gz JDBOVRDZHWSIIE-OAHLLOKOSA-N 2 1 383.355 3.136 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000644532069 567556846 /nfs/dbraw/zinc/55/68/46/567556846.db2.gz YTJVTNUMHHBKMZ-GJZGRUSLSA-N 2 1 375.340 3.443 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+]CCC(=O)Nc1cccc(Br)c1 ZINC000644573782 567561288 /nfs/dbraw/zinc/56/12/88/567561288.db2.gz MTKKVODOUARSCM-UHFFFAOYSA-N 2 1 379.302 3.353 20 0 GGADMP CN(CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)c1cc(Br)ccn1 ZINC000480149100 567583293 /nfs/dbraw/zinc/58/32/93/567583293.db2.gz VKGBGBJYJDWWSH-UHFFFAOYSA-N 2 1 395.389 3.477 20 0 GGADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc4c(cc3Br)OCO4)C2)CC1 ZINC000571960655 567603133 /nfs/dbraw/zinc/60/31/33/567603133.db2.gz PXOALVGAABHWNC-AWEZNQCLSA-N 2 1 381.314 3.342 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cccc(O)c3Br)CC2)C[C@@H](C)O1 ZINC000459307890 567613734 /nfs/dbraw/zinc/61/37/34/567613734.db2.gz ABHHXHVQXKNCTO-HUUCEWRRSA-N 2 1 397.357 3.476 20 0 GGADMP C[C@@H]1CCc2ccc(Br)cc2[C@@H]([NH2+]Cc2nc(C[NH3+])cc(=O)[nH]2)C1 ZINC000665292481 567616918 /nfs/dbraw/zinc/61/69/18/567616918.db2.gz AVFGBXMSQWRGHD-BZNIZROVSA-N 2 1 391.313 3.207 20 0 GGADMP CC(C)C[C@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1cccc(Br)c1 ZINC000665293362 567617316 /nfs/dbraw/zinc/61/73/16/567617316.db2.gz ZKYVLAZQYBIZGU-HNNXBMFYSA-N 2 1 379.302 3.280 20 0 GGADMP Brc1cccc(N2CC[C@H](C[NH2+]C3CC[NH+](C4CC4)CC3)C2)c1 ZINC000459401807 567622269 /nfs/dbraw/zinc/62/22/69/567622269.db2.gz YDZLWJXXYWVQNL-OAHLLOKOSA-N 2 1 378.358 3.492 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000645515960 567636878 /nfs/dbraw/zinc/63/68/78/567636878.db2.gz GCRHQBUYYJJYDH-DNVCBOLYSA-N 2 1 396.373 3.251 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(F)cc(Br)c2)[C@@H](C)C1 ZINC000459693285 567651815 /nfs/dbraw/zinc/65/18/15/567651815.db2.gz HVASUNKVDTVEFP-JOQOYGCGSA-N 2 1 387.337 3.059 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2cc(F)cc(Br)c2)[C@H](C)C1 ZINC000459693290 567651982 /nfs/dbraw/zinc/65/19/82/567651982.db2.gz HVASUNKVDTVEFP-XUWXXGDYSA-N 2 1 387.337 3.059 20 0 GGADMP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459728092 567654314 /nfs/dbraw/zinc/65/43/14/567654314.db2.gz CRIAUANOSYYGJG-LSDHHAIUSA-N 2 1 382.346 3.488 20 0 GGADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000459737455 567656374 /nfs/dbraw/zinc/65/63/74/567656374.db2.gz RHQZLMBDRSATKD-HNNXBMFYSA-N 2 1 377.330 3.456 20 0 GGADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2c(Br)cncc2Br)C1 ZINC000459773831 567657708 /nfs/dbraw/zinc/65/77/08/567657708.db2.gz IWWGWSNRIWOZOX-NSHDSACASA-N 2 1 391.151 3.428 20 0 GGADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2c(Br)cncc2Br)C1 ZINC000459773826 567658258 /nfs/dbraw/zinc/65/82/58/567658258.db2.gz IWWGWSNRIWOZOX-LLVKDONJSA-N 2 1 391.151 3.428 20 0 GGADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000459780901 567660034 /nfs/dbraw/zinc/66/00/34/567660034.db2.gz LTTZLIZEMQJENN-MRXNPFEDSA-N 2 1 396.373 3.107 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1(C)C ZINC000441373880 567662291 /nfs/dbraw/zinc/66/22/91/567662291.db2.gz CQRBRKQSPFVGOL-UHFFFAOYSA-N 2 1 384.351 3.385 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1)Nc1ccccc1Br ZINC000572763844 567662734 /nfs/dbraw/zinc/66/27/34/567662734.db2.gz FAVRFHXJONXXTL-CABCVRRESA-N 2 1 380.330 3.099 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1)Nc1ccccc1Br ZINC000572763846 567663512 /nfs/dbraw/zinc/66/35/12/567663512.db2.gz FAVRFHXJONXXTL-HUUCEWRRSA-N 2 1 380.330 3.099 20 0 GGADMP Cc1nc2c(s1)[C@@H]([NH2+]C[C@H](c1cccs1)N1CC[NH+](C)CC1)CCC2 ZINC000531676931 567673055 /nfs/dbraw/zinc/67/30/55/567673055.db2.gz TVCQFDFMRKERNS-DOTOQJQBSA-N 2 1 376.595 3.469 20 0 GGADMP CC(C)[C@H](C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[C@H](C)[NH3+] ZINC000572999310 567681376 /nfs/dbraw/zinc/68/13/76/567681376.db2.gz QSKUUOIQYAQFRH-KSSFIOAISA-N 2 1 396.373 3.149 20 0 GGADMP Cc1ccc(Br)cc1C[N@@H+]1CC[C@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000573317945 567704654 /nfs/dbraw/zinc/70/46/54/567704654.db2.gz LXRLFACNBOMASK-IBGZPJMESA-N 2 1 380.374 3.358 20 0 GGADMP Cc1cc(Br)ccc1C[NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000532346396 567710377 /nfs/dbraw/zinc/71/03/77/567710377.db2.gz FXURNXDDDITWMJ-FQEVSTJZSA-N 2 1 389.337 3.484 20 0 GGADMP Cc1cc(Br)ccc1C[NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000532346396 567710381 /nfs/dbraw/zinc/71/03/81/567710381.db2.gz FXURNXDDDITWMJ-FQEVSTJZSA-N 2 1 389.337 3.484 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@H]2CCc3c2c(Br)ccc3F)CC1(C)C ZINC000442871811 567713729 /nfs/dbraw/zinc/71/37/29/567713729.db2.gz GYIZHKCYPPIVOH-INIZCTEOSA-N 2 1 384.337 3.191 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@@H]2CCCOc3cc(Br)ccc32)CC1(C)C ZINC000442877053 567714118 /nfs/dbraw/zinc/71/41/18/567714118.db2.gz QQZTVMBGHJOVMM-QGZVFWFLSA-N 2 1 396.373 3.278 20 0 GGADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)ncc1Br ZINC000623488055 567714236 /nfs/dbraw/zinc/71/42/36/567714236.db2.gz GIWNPNCXPRBFSR-GOSISDBHSA-N 2 1 390.325 3.009 20 0 GGADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)ncc1Br ZINC000623488055 567714238 /nfs/dbraw/zinc/71/42/38/567714238.db2.gz GIWNPNCXPRBFSR-GOSISDBHSA-N 2 1 390.325 3.009 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000442919009 567716892 /nfs/dbraw/zinc/71/68/92/567716892.db2.gz DNLXHQVYZQZPBG-HNNXBMFYSA-N 2 1 385.346 3.425 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc(Br)cc1 ZINC000532508898 567720296 /nfs/dbraw/zinc/72/02/96/567720296.db2.gz SXMACHUQPAUHBW-AWEZNQCLSA-N 2 1 382.346 3.042 20 0 GGADMP C[C@@H]([NH3+])C[C@H](C)NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000573719065 567731317 /nfs/dbraw/zinc/73/13/17/567731317.db2.gz QRTKLXDAZMBDMR-OLZOCXBDSA-N 2 1 387.355 3.383 20 0 GGADMP C[C@H](C[C@H](C)[NH3+])NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000573719066 567731606 /nfs/dbraw/zinc/73/16/06/567731606.db2.gz QRTKLXDAZMBDMR-QWHCGFSZSA-N 2 1 387.355 3.383 20 0 GGADMP CSc1cc(Br)ccc1C[N@@H+](C)CCCN1CC[NH+](C)CC1 ZINC000573883627 567742504 /nfs/dbraw/zinc/74/25/04/567742504.db2.gz CGFPXBDXGRFFTH-UHFFFAOYSA-N 2 1 386.403 3.240 20 0 GGADMP C[C@H]([NH2+]CCCCN1CC[NH+](C)CC1)c1cc(F)c(Br)cc1F ZINC000623861738 567743216 /nfs/dbraw/zinc/74/32/16/567743216.db2.gz BOHGXENNQPKKOD-ZDUSSCGKSA-N 2 1 390.316 3.406 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000573906593 567744055 /nfs/dbraw/zinc/74/40/55/567744055.db2.gz FUYZYNRZULFGTC-DLBZAZTESA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000573906593 567744061 /nfs/dbraw/zinc/74/40/61/567744061.db2.gz FUYZYNRZULFGTC-DLBZAZTESA-N 2 1 380.330 3.384 20 0 GGADMP C[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1cncc(Br)c1 ZINC000574055590 567753539 /nfs/dbraw/zinc/75/35/39/567753539.db2.gz ZCNSWRQJYYLGOZ-CQSZACIVSA-N 2 1 393.329 3.420 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121225 567760654 /nfs/dbraw/zinc/76/06/54/567760654.db2.gz QFPJQJPQYNMWFY-HUUCEWRRSA-N 2 1 382.346 3.488 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](CCOc2ccccc2Br)C1 ZINC000508843601 567769097 /nfs/dbraw/zinc/76/90/97/567769097.db2.gz UVGAUKMYPDAHJN-INIZCTEOSA-N 2 1 385.346 3.261 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](CCOc2ccccc2Br)C1 ZINC000508843601 567769102 /nfs/dbraw/zinc/76/91/02/567769102.db2.gz UVGAUKMYPDAHJN-INIZCTEOSA-N 2 1 385.346 3.261 20 0 GGADMP COc1c(Br)cc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1Br ZINC000574501305 567781667 /nfs/dbraw/zinc/78/16/67/567781667.db2.gz PMZNIHGXXWIOCZ-GXSJLCMTSA-N 2 1 392.135 3.450 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cc1O ZINC000647542957 567790412 /nfs/dbraw/zinc/79/04/12/567790412.db2.gz FGGMNZIRFXSIBV-KBPBESRZSA-N 2 1 383.330 3.375 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(Br)c1O ZINC000647542932 567791007 /nfs/dbraw/zinc/79/10/07/567791007.db2.gz DVAKNXYJTWAICI-ZIAGYGMSSA-N 2 1 383.330 3.375 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(Br)c1O ZINC000647542931 567791228 /nfs/dbraw/zinc/79/12/28/567791228.db2.gz DVAKNXYJTWAICI-UONOGXRCSA-N 2 1 383.330 3.375 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c(OC)c1 ZINC000647545707 567791257 /nfs/dbraw/zinc/79/12/57/567791257.db2.gz HYJVUNGENHWELE-UONOGXRCSA-N 2 1 383.330 3.288 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]CCC(=O)Nc1ccc(Br)cc1 ZINC000574685119 567791322 /nfs/dbraw/zinc/79/13/22/567791322.db2.gz ZJIGKMAJLJAKQI-ZDUSSCGKSA-N 2 1 379.302 3.209 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@H]1C[C@]12CC[NH2+]C2 ZINC000444187028 567796652 /nfs/dbraw/zinc/79/66/52/567796652.db2.gz SFSMDOLTQWYENZ-BEFAXECRSA-N 2 1 382.335 3.074 20 0 GGADMP CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1cc(Br)cc(F)c1F ZINC000574814407 567798375 /nfs/dbraw/zinc/79/83/75/567798375.db2.gz HZBVUNVSJLWNCU-UHFFFAOYSA-N 2 1 390.316 3.185 20 0 GGADMP CN(CCN(C)C1CC[NH+](C)CC1)Cc1cc(Br)cc(F)c1F ZINC000574814407 567798378 /nfs/dbraw/zinc/79/83/78/567798378.db2.gz HZBVUNVSJLWNCU-UHFFFAOYSA-N 2 1 390.316 3.185 20 0 GGADMP O=C(CC[N@@H+](C1CC1)C1CC[NH2+]CC1)Nc1ccc(Br)cc1F ZINC000647814382 567802052 /nfs/dbraw/zinc/80/20/52/567802052.db2.gz LQHAWBOJOAXWKE-UHFFFAOYSA-N 2 1 384.293 3.133 20 0 GGADMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000647951803 567808388 /nfs/dbraw/zinc/80/83/88/567808388.db2.gz UYZFYQBMGFHWLP-AWEZNQCLSA-N 2 1 375.314 3.467 20 0 GGADMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000647951804 567808406 /nfs/dbraw/zinc/80/84/06/567808406.db2.gz UYZFYQBMGFHWLP-CQSZACIVSA-N 2 1 375.314 3.467 20 0 GGADMP O=C(C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000647975005 567808805 /nfs/dbraw/zinc/80/88/05/567808805.db2.gz GHTNPOULCSJZTF-KGLIPLIRSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000647975005 567808808 /nfs/dbraw/zinc/80/88/08/567808808.db2.gz GHTNPOULCSJZTF-KGLIPLIRSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)Nc1cccc(Br)c1 ZINC000647977904 567808825 /nfs/dbraw/zinc/80/88/25/567808825.db2.gz JQJHGJIBDWUNGU-CVEARBPZSA-N 2 1 394.357 3.489 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccccc1Br ZINC000647976955 567809029 /nfs/dbraw/zinc/80/90/29/567809029.db2.gz WHJXSZFLNQTCSF-HOTGVXAUSA-N 2 1 394.357 3.489 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(Br)c1 ZINC000647975202 567809141 /nfs/dbraw/zinc/80/91/41/567809141.db2.gz PZEUEULVLAUJQW-CVEARBPZSA-N 2 1 394.357 3.408 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(Br)c1 ZINC000647975202 567809144 /nfs/dbraw/zinc/80/91/44/567809144.db2.gz PZEUEULVLAUJQW-CVEARBPZSA-N 2 1 394.357 3.408 20 0 GGADMP COc1ccc(C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1OC ZINC000647986876 567809553 /nfs/dbraw/zinc/80/95/53/567809553.db2.gz ILBXBQPZEVYFFN-KGLIPLIRSA-N 2 1 383.330 3.288 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1)c1ccc(Cl)cc1Cl ZINC000647987295 567809869 /nfs/dbraw/zinc/80/98/69/567809869.db2.gz GUOOLGAEIUZNMK-KKUMJFAQSA-N 2 1 384.351 3.492 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)CCCOc2ccccc2C(N)=O)cn1 ZINC000097162369 570901251 /nfs/dbraw/zinc/90/12/51/570901251.db2.gz ADMJYWSNTVSKKC-INIZCTEOSA-N 2 1 393.491 3.012 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)[nH+]1 ZINC000737244526 598456530 /nfs/dbraw/zinc/45/65/30/598456530.db2.gz HEKBGJYGLUUUAX-UHFFFAOYSA-N 2 1 391.523 3.227 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(N2CCC(C[N@H+](C)Cc3ccccc3)CC2)[nH+]1 ZINC000737244526 598456532 /nfs/dbraw/zinc/45/65/32/598456532.db2.gz HEKBGJYGLUUUAX-UHFFFAOYSA-N 2 1 391.523 3.227 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2cccc(OCc3cccc(-c4nn[nH]n4)c3)c2)CC[N@H+]1C ZINC000820667473 599448747 /nfs/dbraw/zinc/44/87/47/599448747.db2.gz MOTIRCFGLIHBOH-OXJNMPFZSA-N 2 1 392.507 3.018 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc(OCc3ccccc3-c3nn[nH]n3)c2)CC[N@H+]1C ZINC000820667615 599449217 /nfs/dbraw/zinc/44/92/17/599449217.db2.gz NCBPAPHCWUQFHU-VQIMIIECSA-N 2 1 392.507 3.018 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C2CC[NH+](CCCC(=O)[O-])CC2)cc1 ZINC000833615330 605218959 /nfs/dbraw/zinc/21/89/59/605218959.db2.gz MQYIVGBGBZMLJN-LJQANCHMSA-N 2 1 387.568 3.480 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cc(-c2nn[nH]n2)cs1 ZINC000821615922 606221501 /nfs/dbraw/zinc/22/15/01/606221501.db2.gz URZRILCTHGIPCP-UHFFFAOYSA-N 2 1 394.504 3.443 20 0 GGADMP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(-c3nn[nH]n3)s2)C[N@H+]1Cc1ccccc1 ZINC000824884309 607812525 /nfs/dbraw/zinc/81/25/25/607812525.db2.gz NFGBXCHMEJPFIX-WBVHZDCISA-N 2 1 382.537 3.319 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)cc1-c1nn[nH]n1 ZINC000826202569 608287138 /nfs/dbraw/zinc/28/71/38/608287138.db2.gz DSMBAEIOOCNWGJ-KXBFYZLASA-N 2 1 384.528 3.008 20 0 GGADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CCCc4cc(-c5nn[nH]n5)ccc43)CC2)cc1 ZINC000826521329 608496390 /nfs/dbraw/zinc/49/63/90/608496390.db2.gz IIYZOIBJUFVNHU-JOCHJYFZSA-N 2 1 388.519 3.498 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)c1cccc(-c2nn[nH]n2)c1 ZINC000824537624 609167541 /nfs/dbraw/zinc/16/75/41/609167541.db2.gz FDMMSWXMIHWOIT-JJCGOBCMSA-N 2 1 388.519 3.428 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)CCc1ccccc1 ZINC000053048444 1406271117 /nfs/dbraw/zinc/27/11/17/1406271117.db2.gz IIUSNPWPDDNDMN-HXUWFJFHSA-N 2 1 379.548 3.330 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccc2)CC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000053513460 1406421188 /nfs/dbraw/zinc/42/11/88/1406421188.db2.gz VTFHOPQAQXZKGV-UHFFFAOYSA-N 2 1 392.547 3.178 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)NC[C@@H](c2cccs2)[NH+](C)C)CC1 ZINC000053528524 1406427629 /nfs/dbraw/zinc/42/76/29/1406427629.db2.gz BCRPJFWDIDQWRY-IBGZPJMESA-N 2 1 386.565 3.187 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000054164659 1406634573 /nfs/dbraw/zinc/63/45/73/1406634573.db2.gz CAZHXZNDQFNQSZ-UHFFFAOYSA-N 2 1 389.503 3.492 20 0 GGADMP C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2ccccc2N2CC[NH+](C)CC2)C1 ZINC000054385509 1406710698 /nfs/dbraw/zinc/71/06/98/1406710698.db2.gz CLIPTLKWWSOWDN-SFHVURJKSA-N 2 1 387.572 3.070 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)NCc1ccccc1C[NH+]1CCCC1 ZINC000054686159 1406806780 /nfs/dbraw/zinc/80/67/80/1406806780.db2.gz SMABMEBGTUGGJV-UHFFFAOYSA-N 2 1 398.576 3.201 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)NCc1ccccc1C[NH+]1CCCC1 ZINC000054686159 1406806783 /nfs/dbraw/zinc/80/67/83/1406806783.db2.gz SMABMEBGTUGGJV-UHFFFAOYSA-N 2 1 398.576 3.201 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)o1 ZINC000054698737 1406808142 /nfs/dbraw/zinc/80/81/42/1406808142.db2.gz VHKXJYCHIUYUSZ-PZJWPPBQSA-N 2 1 398.551 3.497 20 0 GGADMP C[N@@H+](CCNC(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1)Cc1ccccc1 ZINC000054761471 1406819895 /nfs/dbraw/zinc/81/98/95/1406819895.db2.gz IPKPHDDISOBJML-UHFFFAOYSA-N 2 1 398.526 3.221 20 0 GGADMP C[N@@H+](CCNC(=O)NCc1cccc(C[NH+]2CCCC2)c1)Cc1ccccc1 ZINC000054764479 1406820823 /nfs/dbraw/zinc/82/08/23/1406820823.db2.gz AUNHPLQGEUYSJE-UHFFFAOYSA-N 2 1 380.536 3.214 20 0 GGADMP CCOc1cc(C[NH2+]C2CC[NH+](C)CC2)ccc1OCC(=O)Nc1ccccc1 ZINC000017313978 1399279036 /nfs/dbraw/zinc/27/90/36/1399279036.db2.gz KTJOWMSHHXJMPG-UHFFFAOYSA-N 2 1 397.519 3.287 20 0 GGADMP C[C@H]1C[NH+](C(C)(C)CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)C[C@H](C)O1 ZINC000021061491 1399363274 /nfs/dbraw/zinc/36/32/74/1399363274.db2.gz QYHKCNPYFALTDC-OALUTQOASA-N 2 1 387.568 3.290 20 0 GGADMP C[NH+]1CCN([C@@H](C[NH2+]Cc2cnn(Cc3ccccc3)c2)c2cccs2)CC1 ZINC000024082338 1399600953 /nfs/dbraw/zinc/60/09/53/1399600953.db2.gz QAXBJOJOKSOSEG-NRFANRHFSA-N 2 1 395.576 3.071 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@H+](Cc3ccccc3)C3CC3)cc2)CC1 ZINC000025218145 1399773409 /nfs/dbraw/zinc/77/34/09/1399773409.db2.gz IGFYMDXBQBXCOB-UHFFFAOYSA-N 2 1 392.547 3.432 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](Cc3ccccc3)C3CC3)cc2)CC1 ZINC000025218145 1399773421 /nfs/dbraw/zinc/77/34/21/1399773421.db2.gz IGFYMDXBQBXCOB-UHFFFAOYSA-N 2 1 392.547 3.432 20 0 GGADMP COc1cccc(C[N@H+](C)[C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000026177120 1399866454 /nfs/dbraw/zinc/86/64/54/1399866454.db2.gz AEZMFQRONBTIDV-IBGZPJMESA-N 2 1 395.547 3.296 20 0 GGADMP COc1cccc(C[N@@H+](C)[C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000026177120 1399866457 /nfs/dbraw/zinc/86/64/57/1399866457.db2.gz AEZMFQRONBTIDV-IBGZPJMESA-N 2 1 395.547 3.296 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+](C)CCOc1ccccc1 ZINC000026184254 1399868185 /nfs/dbraw/zinc/86/81/85/1399868185.db2.gz LMGSXIGUBQDGRT-FQEVSTJZSA-N 2 1 395.547 3.167 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)CCOc1ccccc1 ZINC000026184254 1399868187 /nfs/dbraw/zinc/86/81/87/1399868187.db2.gz LMGSXIGUBQDGRT-FQEVSTJZSA-N 2 1 395.547 3.167 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+](C)Cc1cccc(F)c1 ZINC000026194606 1399868694 /nfs/dbraw/zinc/86/86/94/1399868694.db2.gz PPSCIDPMIBLZTH-GOSISDBHSA-N 2 1 383.511 3.427 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)Cc1cccc(F)c1 ZINC000026194606 1399868696 /nfs/dbraw/zinc/86/86/96/1399868696.db2.gz PPSCIDPMIBLZTH-GOSISDBHSA-N 2 1 383.511 3.427 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NC[C@H](c3ccccc3)[NH+](C)C)cc2)C[C@@H](C)O1 ZINC000028838795 1400201848 /nfs/dbraw/zinc/20/18/48/1400201848.db2.gz IGDWONFQPBINDW-DNVFCKCGSA-N 2 1 395.547 3.329 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)cc2)C[C@@H](C)O1 ZINC000028838802 1400202202 /nfs/dbraw/zinc/20/22/02/1400202202.db2.gz IGDWONFQPBINDW-PWHSHALESA-N 2 1 395.547 3.329 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C[C@@H](C)O1 ZINC000028937778 1400213993 /nfs/dbraw/zinc/21/39/93/1400213993.db2.gz HNFFVCWKQZUZJU-IAGOWNOFSA-N 2 1 387.568 3.335 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C(C)C)[NH+]2CCC(C)CC2)cn1 ZINC000056398917 1407319767 /nfs/dbraw/zinc/31/97/67/1407319767.db2.gz KERWOEOHBUZORE-FQEVSTJZSA-N 2 1 398.555 3.131 20 0 GGADMP C[NH+](C)CCCNC(=O)NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000042923583 1403673727 /nfs/dbraw/zinc/67/37/27/1403673727.db2.gz VUVMHTPPVONLPP-IBGZPJMESA-N 2 1 386.565 3.098 20 0 GGADMP C[NH+](C)CCCNC(=O)NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000042923583 1403673734 /nfs/dbraw/zinc/67/37/34/1403673734.db2.gz VUVMHTPPVONLPP-IBGZPJMESA-N 2 1 386.565 3.098 20 0 GGADMP C[C@H](CNC(=O)NCCC[NH2+]C1CCCCC1)[N@@H+]1CCc2sccc2C1 ZINC000043035957 1403693301 /nfs/dbraw/zinc/69/33/01/1403693301.db2.gz HASHPWKTPKLZFU-MRXNPFEDSA-N 2 1 378.586 3.106 20 0 GGADMP C[C@H](CNC(=O)NCCC[NH2+]C1CCCCC1)[N@H+]1CCc2sccc2C1 ZINC000043035957 1403693305 /nfs/dbraw/zinc/69/33/05/1403693305.db2.gz HASHPWKTPKLZFU-MRXNPFEDSA-N 2 1 378.586 3.106 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000043137217 1403713780 /nfs/dbraw/zinc/71/37/80/1403713780.db2.gz XUVDKMUOLSHENU-OALUTQOASA-N 2 1 376.545 3.370 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)c1cccs1 ZINC000043145599 1403719041 /nfs/dbraw/zinc/71/90/41/1403719041.db2.gz ZVQOXSBTYFVKIQ-LJQANCHMSA-N 2 1 386.565 3.268 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)N(Cc2ccccc2)CC(F)(F)F)CC1 ZINC000056525161 1407353138 /nfs/dbraw/zinc/35/31/38/1407353138.db2.gz HPAPNECYOWBLLN-UHFFFAOYSA-N 2 1 385.474 3.241 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)NC[C@@H](c3ccco3)[NH+](C)C)c(C)c2)CC1 ZINC000043526571 1403779784 /nfs/dbraw/zinc/77/97/84/1403779784.db2.gz KHCYKKIYEXDJPE-FQEVSTJZSA-N 2 1 399.539 3.154 20 0 GGADMP C[N@@H+]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)[C@H](c2ccccc2)C1 ZINC000045191568 1404071578 /nfs/dbraw/zinc/07/15/78/1404071578.db2.gz ZVSLTYOTYYPLRA-QHCPKHFHSA-N 2 1 392.547 3.481 20 0 GGADMP C[N@H+]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)[C@H](c2ccccc2)C1 ZINC000045191568 1404071585 /nfs/dbraw/zinc/07/15/85/1404071585.db2.gz ZVSLTYOTYYPLRA-QHCPKHFHSA-N 2 1 392.547 3.481 20 0 GGADMP Cc1cccc(C[NH+]2CCN(C(=O)NCc3cccc(C[NH+](C)C)c3)CC2)c1 ZINC000045640181 1404168155 /nfs/dbraw/zinc/16/81/55/1404168155.db2.gz CFDGGUZWRVEODG-UHFFFAOYSA-N 2 1 380.536 3.084 20 0 GGADMP C[C@@H](CNC(=O)Nc1cccc(C[NH+](C)C)c1)[NH+]1CCN(c2ccccc2)CC1 ZINC000046853054 1404613606 /nfs/dbraw/zinc/61/36/06/1404613606.db2.gz XLVYXJOUAFYHMA-IBGZPJMESA-N 2 1 395.551 3.080 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NCCC[N@H+]1CCc2ccccc2C1)c1cccs1 ZINC000046893256 1404625605 /nfs/dbraw/zinc/62/56/05/1404625605.db2.gz TZFVOJFDFSHARO-LJQANCHMSA-N 2 1 386.565 3.098 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000047777637 1404938691 /nfs/dbraw/zinc/93/86/91/1404938691.db2.gz QBFZHYMCCXKKNO-NRFANRHFSA-N 2 1 396.535 3.164 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000047882910 1404982394 /nfs/dbraw/zinc/98/23/94/1404982394.db2.gz AROLMOBYAYORHM-RXVVDRJESA-N 2 1 396.535 3.163 20 0 GGADMP CC[NH+](CC)CC1CC[NH+](CC(=O)NCCSc2ccc(C)cc2)CC1 ZINC000047978400 1405014275 /nfs/dbraw/zinc/01/42/75/1405014275.db2.gz RAGJLKWUVSSAGY-UHFFFAOYSA-N 2 1 377.598 3.257 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NCC(C)(C)[NH+]3CCCCC3)cc2)C[C@H](C)O1 ZINC000048178241 1405087682 /nfs/dbraw/zinc/08/76/82/1405087682.db2.gz LDYLTLMDNYGTEV-OALUTQOASA-N 2 1 387.568 3.290 20 0 GGADMP CN(Cc1ccccc1F)C(=O)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000048562689 1405225994 /nfs/dbraw/zinc/22/59/94/1405225994.db2.gz QDRGQEAXBRUEMS-UHFFFAOYSA-N 2 1 375.532 3.372 20 0 GGADMP Cc1ccc(NC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c(OCC[NH+](C)C)c1 ZINC000173475196 1426649035 /nfs/dbraw/zinc/64/90/35/1426649035.db2.gz KALUOHOJHUTKIQ-SFHVURJKSA-N 2 1 376.545 3.274 20 0 GGADMP CCOc1ccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)cc1 ZINC000048778035 1405288691 /nfs/dbraw/zinc/28/86/91/1405288691.db2.gz XYADDXTVIFNJSJ-UHFFFAOYSA-N 2 1 397.519 3.036 20 0 GGADMP Cc1ccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)c(C)c1 ZINC000048778071 1405289346 /nfs/dbraw/zinc/28/93/46/1405289346.db2.gz DGFOOPFCHJEPMS-UHFFFAOYSA-N 2 1 381.520 3.254 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]Cc2ccc(Cl)cc2)c1 ZINC000048777994 1405289698 /nfs/dbraw/zinc/28/96/98/1405289698.db2.gz BSGOOSBJOLASOR-UHFFFAOYSA-N 2 1 387.911 3.291 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3c[nH]nc3-c3cccs3)cc2)CC1 ZINC000048783003 1405292376 /nfs/dbraw/zinc/29/23/76/1405292376.db2.gz XWRGAMSSHYPESE-UHFFFAOYSA-N 2 1 381.549 3.175 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3c[nH]nc3-c3ccccc3)cc2)CC1 ZINC000048782993 1405292429 /nfs/dbraw/zinc/29/24/29/1405292429.db2.gz WTEVKSDPIOCXHQ-UHFFFAOYSA-N 2 1 375.520 3.114 20 0 GGADMP COc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc2c1OCO2 ZINC000048816673 1405298188 /nfs/dbraw/zinc/29/81/88/1405298188.db2.gz LLVXUHUPRCUVPY-CALCHBBNSA-N 2 1 398.503 3.323 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000050024282 1405454222 /nfs/dbraw/zinc/45/42/22/1405454222.db2.gz GSLSJLUYQDTTDM-IRLDBZIGSA-N 2 1 395.547 3.326 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000050024282 1405454228 /nfs/dbraw/zinc/45/42/28/1405454228.db2.gz GSLSJLUYQDTTDM-IRLDBZIGSA-N 2 1 395.547 3.326 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000050024285 1405454386 /nfs/dbraw/zinc/45/43/86/1405454386.db2.gz GSLSJLUYQDTTDM-UNMCSNQZSA-N 2 1 395.547 3.326 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000050024285 1405454389 /nfs/dbraw/zinc/45/43/89/1405454389.db2.gz GSLSJLUYQDTTDM-UNMCSNQZSA-N 2 1 395.547 3.326 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)c1cccc(C[NH+]2CCCC2)c1 ZINC000050029248 1405457656 /nfs/dbraw/zinc/45/76/56/1405457656.db2.gz SILAVCHPXUJFPN-UHFFFAOYSA-N 2 1 377.532 3.461 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000050136969 1405496399 /nfs/dbraw/zinc/49/63/99/1405496399.db2.gz BPMZUODZAQYZTO-QYZOEREBSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000050136969 1405496418 /nfs/dbraw/zinc/49/64/18/1405496418.db2.gz BPMZUODZAQYZTO-QYZOEREBSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000050136969 1405496452 /nfs/dbraw/zinc/49/64/52/1405496452.db2.gz BPMZUODZAQYZTO-QYZOEREBSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)CN(CC[NH+](C)C)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000050137041 1405496729 /nfs/dbraw/zinc/49/67/29/1405496729.db2.gz IHWPNSWXCFAAOW-GOSISDBHSA-N 2 1 380.602 3.189 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCCCC1 ZINC000050136841 1405497062 /nfs/dbraw/zinc/49/70/62/1405497062.db2.gz ITXYHNFLDMUHPL-QZTJIDSGSA-N 2 1 378.586 3.134 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[NH+](C2CCCC2)CC1 ZINC000050137029 1405497211 /nfs/dbraw/zinc/49/72/11/1405497211.db2.gz DIVVDUIEOLAJDZ-SFHVURJKSA-N 2 1 390.597 3.230 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)CC1 ZINC000050137741 1405497599 /nfs/dbraw/zinc/49/75/99/1405497599.db2.gz MXNKTZUIJKKYJQ-GOSISDBHSA-N 2 1 392.613 3.476 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000050137741 1405497615 /nfs/dbraw/zinc/49/76/15/1405497615.db2.gz MXNKTZUIJKKYJQ-GOSISDBHSA-N 2 1 392.613 3.476 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000050137741 1405497626 /nfs/dbraw/zinc/49/76/26/1405497626.db2.gz MXNKTZUIJKKYJQ-GOSISDBHSA-N 2 1 392.613 3.476 20 0 GGADMP CC(C)(C)[NH2+]CC(=O)Nc1ccc(C[NH+]2CCN(Cc3ccccc3)CC2)cc1 ZINC000051155073 1405733367 /nfs/dbraw/zinc/73/33/67/1405733367.db2.gz NLWUOYBUJRNQQE-UHFFFAOYSA-N 2 1 394.563 3.331 20 0 GGADMP O[C@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1)C[NH+]1CCCC1 ZINC000051188011 1405740856 /nfs/dbraw/zinc/74/08/56/1405740856.db2.gz GDGHHKIOHCGZLR-LJQANCHMSA-N 2 1 382.533 3.147 20 0 GGADMP COc1ccc(C[N@H+](C)CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000051317114 1405784315 /nfs/dbraw/zinc/78/43/15/1405784315.db2.gz RCFONKGBBCFRAS-UHFFFAOYSA-N 2 1 395.547 3.216 20 0 GGADMP COc1ccc(C[N@@H+](C)CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000051317114 1405784323 /nfs/dbraw/zinc/78/43/23/1405784323.db2.gz RCFONKGBBCFRAS-UHFFFAOYSA-N 2 1 395.547 3.216 20 0 GGADMP C[NH+](C/C=C/C[N@H+](C)Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2 ZINC000051828037 1405871188 /nfs/dbraw/zinc/87/11/88/1405871188.db2.gz QCZSBNLBLNPRGM-ONEGZZNKSA-N 2 1 382.460 3.264 20 0 GGADMP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051958872 1405889846 /nfs/dbraw/zinc/88/98/46/1405889846.db2.gz WJQQZZFEGQNUHE-IBGZPJMESA-N 2 1 387.568 3.490 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N2CCCc3cc(OC)ccc32)CC1 ZINC000052209044 1405983134 /nfs/dbraw/zinc/98/31/34/1405983134.db2.gz WXQVZNKFEHNPIX-UHFFFAOYSA-N 2 1 387.568 3.418 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N(C)Cc2cccc(OC)c2)CC1 ZINC000052209199 1405983544 /nfs/dbraw/zinc/98/35/44/1405983544.db2.gz MRFSNVHYALWTRH-UHFFFAOYSA-N 2 1 375.557 3.098 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(OC)cc2OC)CC1 ZINC000052209937 1405985505 /nfs/dbraw/zinc/98/55/05/1405985505.db2.gz WHKQVCMRZWDZAK-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(OC)cc2OC)CC1 ZINC000052209937 1405985513 /nfs/dbraw/zinc/98/55/13/1405985513.db2.gz WHKQVCMRZWDZAK-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000052290388 1406008714 /nfs/dbraw/zinc/00/87/14/1406008714.db2.gz RPEMRVXQBWDKRC-ROUUACIJSA-N 2 1 383.540 3.169 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)NC[C@H](c1ccccc1)[NH+]1CCC(C)CC1 ZINC000052552844 1406079717 /nfs/dbraw/zinc/07/97/17/1406079717.db2.gz KBBRFNXVIHKDIL-OAQYLSRUSA-N 2 1 383.540 3.354 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[NH+]1CCCCC1 ZINC000052554793 1406081802 /nfs/dbraw/zinc/08/18/02/1406081802.db2.gz IHACDHUUXURJOT-MRXNPFEDSA-N 2 1 394.510 3.103 20 0 GGADMP CC(=O)Nc1ccc(NC(=O)C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000052713501 1406134258 /nfs/dbraw/zinc/13/42/58/1406134258.db2.gz ALHYHMSXQPLXNZ-UHFFFAOYSA-N 2 1 386.540 3.172 20 0 GGADMP C[C@H](C(=O)Nc1ccc2c(c1)OCO2)[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000052713575 1406134495 /nfs/dbraw/zinc/13/44/95/1406134495.db2.gz AQSJWSLQBHHNLL-QGZVFWFLSA-N 2 1 387.524 3.330 20 0 GGADMP CC(C)n1nccc1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000052713631 1406134743 /nfs/dbraw/zinc/13/47/43/1406134743.db2.gz ISUPJKOEWZIIFS-SFHVURJKSA-N 2 1 375.561 3.379 20 0 GGADMP C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000052713574 1406135102 /nfs/dbraw/zinc/13/51/02/1406135102.db2.gz AQSJWSLQBHHNLL-KRWDZBQOSA-N 2 1 387.524 3.330 20 0 GGADMP CC(C)[NH+]1CCC([NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)CC1 ZINC000052916367 1406228526 /nfs/dbraw/zinc/22/85/26/1406228526.db2.gz WVZNXTYRSTYTRY-UHFFFAOYSA-N 2 1 384.524 3.211 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)CC1 ZINC000056786975 1407432263 /nfs/dbraw/zinc/43/22/63/1407432263.db2.gz KWRDQYPZYRSKFI-ICSRJNTNSA-N 2 1 386.584 3.379 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000056937360 1407479160 /nfs/dbraw/zinc/47/91/60/1407479160.db2.gz ARGIADUDBIXIJS-JOCHJYFZSA-N 2 1 398.526 3.346 20 0 GGADMP COc1cccc([C@@H](CNC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)[NH+](C)C)c1 ZINC000057127927 1407530053 /nfs/dbraw/zinc/53/00/53/1407530053.db2.gz IOCYEWHRXJFQQZ-JTHBVZDNSA-N 2 1 395.547 3.326 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cn1 ZINC000057127569 1407530169 /nfs/dbraw/zinc/53/01/69/1407530169.db2.gz RFSHWPCZTCZBNX-QZTJIDSGSA-N 2 1 398.555 3.133 20 0 GGADMP COc1cccc([C@@H](CNC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)[NH+](C)C)c1 ZINC000057127924 1407530203 /nfs/dbraw/zinc/53/02/03/1407530203.db2.gz IOCYEWHRXJFQQZ-FYYLOGMGSA-N 2 1 395.547 3.326 20 0 GGADMP CCC(CC)[C@@H](CNC(=O)NCc1ccc(-n2cc[nH+]c2C)nc1)[NH+]1CCCC1 ZINC000057128042 1407531291 /nfs/dbraw/zinc/53/12/91/1407531291.db2.gz RWUYUHUAVJFBPO-HXUWFJFHSA-N 2 1 398.555 3.276 20 0 GGADMP C[NH+](C)CCOc1ccc(CNC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000057174565 1407545774 /nfs/dbraw/zinc/54/57/74/1407545774.db2.gz KFIJHXNOYOFZSB-QFIPXVFZSA-N 2 1 395.547 3.155 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000057552297 1407648506 /nfs/dbraw/zinc/64/85/06/1407648506.db2.gz AUSJEKVKDBVTBL-XQBPLPMBSA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000057552297 1407648514 /nfs/dbraw/zinc/64/85/14/1407648514.db2.gz AUSJEKVKDBVTBL-XQBPLPMBSA-N 2 1 387.568 3.242 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000057606318 1407663052 /nfs/dbraw/zinc/66/30/52/1407663052.db2.gz IGSNKLPPXJUKFM-SFHVURJKSA-N 2 1 376.545 3.322 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000057606321 1407663706 /nfs/dbraw/zinc/66/37/06/1407663706.db2.gz IGSNKLPPXJUKFM-GOSISDBHSA-N 2 1 376.545 3.322 20 0 GGADMP CCN1CCc2nc3ccccc3c(C(=O)NC[C@@H]3CC[N@@H+](CC(C)C)C3)c2C1 ZINC000176342167 1428257433 /nfs/dbraw/zinc/25/74/33/1428257433.db2.gz IVTKOZQNMOKNOT-SFHVURJKSA-N 2 1 394.563 3.321 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc(=O)n3ccccc3n2)CC1 ZINC000057843934 1407736339 /nfs/dbraw/zinc/73/63/39/1407736339.db2.gz VPLHHRTZWXBWFB-UHFFFAOYSA-N 2 1 376.504 3.039 20 0 GGADMP COc1ccccc1[C@H](C)NC(=O)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000057889098 1407746259 /nfs/dbraw/zinc/74/62/59/1407746259.db2.gz QCHALBMGKZBYTJ-IBGZPJMESA-N 2 1 387.568 3.460 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NC1CC[NH+](Cc2cccc(OC)c2)CC1)c1ccccc1 ZINC000057914418 1407754330 /nfs/dbraw/zinc/75/43/30/1407754330.db2.gz MJUMXHLWBOHGMH-HSZRJFAPSA-N 2 1 395.547 3.469 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1NC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000058810776 1407884878 /nfs/dbraw/zinc/88/48/78/1407884878.db2.gz UAZXYPKWYCEGHP-IBGZPJMESA-N 2 1 375.476 3.426 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1NC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000058810776 1407884880 /nfs/dbraw/zinc/88/48/80/1407884880.db2.gz UAZXYPKWYCEGHP-IBGZPJMESA-N 2 1 375.476 3.426 20 0 GGADMP O=C([C@@H](c1ccccc1)[NH+]1CCSCC1)N1CCC([NH+]2CCCCC2)CC1 ZINC000058856251 1407889316 /nfs/dbraw/zinc/88/93/16/1407889316.db2.gz VJOMZNQOGZSVED-OAQYLSRUSA-N 2 1 387.593 3.253 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1 ZINC000058891266 1407894914 /nfs/dbraw/zinc/89/49/14/1407894914.db2.gz RWWGOANWFGVRFB-RBUKOAKNSA-N 2 1 375.557 3.257 20 0 GGADMP CC(C)(C)c1ccc(NC(=O)C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1 ZINC000060242018 1407949151 /nfs/dbraw/zinc/94/91/51/1407949151.db2.gz LCXUTYIUQFZMTC-UHFFFAOYSA-N 2 1 387.568 3.357 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(F)c(F)c1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000060368434 1407962311 /nfs/dbraw/zinc/96/23/11/1407962311.db2.gz WSZBYNQJBJNNLT-OAGGEKHMSA-N 2 1 395.494 3.113 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)cc1F ZINC000060368438 1407962753 /nfs/dbraw/zinc/96/27/53/1407962753.db2.gz YHNRVGLOYNCLJS-KURKYZTESA-N 2 1 391.531 3.282 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NCCC[NH+]2CCc3ccccc3C2)c1 ZINC000061863758 1408184665 /nfs/dbraw/zinc/18/46/65/1408184665.db2.gz UHXTXONDYVXBIF-UHFFFAOYSA-N 2 1 394.563 3.386 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NCCC[N@@H+]2CCc3ccccc3C2)c1 ZINC000061863758 1408184686 /nfs/dbraw/zinc/18/46/86/1408184686.db2.gz UHXTXONDYVXBIF-UHFFFAOYSA-N 2 1 394.563 3.386 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NCCC[N@H+]2CCc3ccccc3C2)c1 ZINC000061863758 1408184700 /nfs/dbraw/zinc/18/47/00/1408184700.db2.gz UHXTXONDYVXBIF-UHFFFAOYSA-N 2 1 394.563 3.386 20 0 GGADMP C[C@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCCC[C@H]1C ZINC000063148630 1408308694 /nfs/dbraw/zinc/30/86/94/1408308694.db2.gz MOZNFDIAPMOSDD-RTBURBONSA-N 2 1 388.625 3.378 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)cn1 ZINC000063333865 1408339308 /nfs/dbraw/zinc/33/93/08/1408339308.db2.gz PWJSKGHUKQMNSS-UHFFFAOYSA-N 2 1 396.539 3.030 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3cnn(-c4ccccc4)c3)c2)CCO1 ZINC000063524293 1408367354 /nfs/dbraw/zinc/36/73/54/1408367354.db2.gz SEMWEWBCDZDHPO-IBGZPJMESA-N 2 1 376.504 3.383 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3cnn(-c4ccccc4)c3)c2)CCO1 ZINC000063524293 1408367357 /nfs/dbraw/zinc/36/73/57/1408367357.db2.gz SEMWEWBCDZDHPO-IBGZPJMESA-N 2 1 376.504 3.383 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)o1 ZINC000063524324 1408367900 /nfs/dbraw/zinc/36/79/00/1408367900.db2.gz JVWGWSNSYZZLAV-KRWDZBQOSA-N 2 1 380.492 3.489 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)o1 ZINC000063524324 1408367907 /nfs/dbraw/zinc/36/79/07/1408367907.db2.gz JVWGWSNSYZZLAV-KRWDZBQOSA-N 2 1 380.492 3.489 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000176427858 1428316933 /nfs/dbraw/zinc/31/69/33/1428316933.db2.gz ZBNQAIPVGMDTRN-RTWAWAEBSA-N 2 1 388.531 3.058 20 0 GGADMP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000063914105 1408445116 /nfs/dbraw/zinc/44/51/16/1408445116.db2.gz PIKIJQMXRPLRIF-UHFFFAOYSA-N 2 1 377.532 3.283 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](Cc3cccc(C)c3)CC2)c1 ZINC000064229796 1408515853 /nfs/dbraw/zinc/51/58/53/1408515853.db2.gz WLMOPWCXPSDJHB-UHFFFAOYSA-N 2 1 394.563 3.474 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](Cc3cccc(C)c3)CC2)c1 ZINC000064229796 1408515858 /nfs/dbraw/zinc/51/58/58/1408515858.db2.gz WLMOPWCXPSDJHB-UHFFFAOYSA-N 2 1 394.563 3.474 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000064229936 1408516093 /nfs/dbraw/zinc/51/60/93/1408516093.db2.gz BEVFTPYNZGVDAI-UHFFFAOYSA-N 2 1 394.563 3.208 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000064229936 1408516102 /nfs/dbraw/zinc/51/61/02/1408516102.db2.gz BEVFTPYNZGVDAI-UHFFFAOYSA-N 2 1 394.563 3.208 20 0 GGADMP CC[C@H](C)[C@H](C)[N@H+](CC(=O)NCC1([NH+]2CCOCC2)CCCCC1)C1CC1 ZINC000064808894 1408614227 /nfs/dbraw/zinc/61/42/27/1408614227.db2.gz PUPKJMUPHPFNGN-OALUTQOASA-N 2 1 379.589 3.037 20 0 GGADMP CC[C@H](C)[C@H](C)[N@@H+](CC(=O)NCC1([NH+]2CCOCC2)CCCCC1)C1CC1 ZINC000064808894 1408614236 /nfs/dbraw/zinc/61/42/36/1408614236.db2.gz PUPKJMUPHPFNGN-OALUTQOASA-N 2 1 379.589 3.037 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000176479140 1428334252 /nfs/dbraw/zinc/33/42/52/1428334252.db2.gz AXWGBXDOSSGVSX-FPOVZHCZSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000176479140 1428334259 /nfs/dbraw/zinc/33/42/59/1428334259.db2.gz AXWGBXDOSSGVSX-FPOVZHCZSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000176479140 1428334267 /nfs/dbraw/zinc/33/42/67/1428334267.db2.gz AXWGBXDOSSGVSX-FPOVZHCZSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000176479140 1428334275 /nfs/dbraw/zinc/33/42/75/1428334275.db2.gz AXWGBXDOSSGVSX-FPOVZHCZSA-N 2 1 375.532 3.371 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NC[C@@H](c1ccc(C)cc1)[NH+](C)C)[NH+](C)C ZINC000065470213 1408673999 /nfs/dbraw/zinc/67/39/99/1408673999.db2.gz MDXALBHHSBMFML-SFTDATJTSA-N 2 1 398.551 3.208 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)NC[C@@H](C)[NH+]2CCC(C)CC2)CC1 ZINC000065480368 1408676117 /nfs/dbraw/zinc/67/61/17/1408676117.db2.gz UGUCMLZHMVBIFP-OAQYLSRUSA-N 2 1 386.584 3.333 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C[NH+]1CCCCC1 ZINC000065518006 1408682309 /nfs/dbraw/zinc/68/23/09/1408682309.db2.gz VTAGHNLCDZXAKR-UNMCSNQZSA-N 2 1 386.584 3.320 20 0 GGADMP C[N@@H+](CCNC(=O)N1CCC[NH+](CC2CCCCC2)CC1)Cc1ccccc1 ZINC000065540688 1408685674 /nfs/dbraw/zinc/68/56/74/1408685674.db2.gz REWZWOVEDUSKQA-UHFFFAOYSA-N 2 1 386.584 3.416 20 0 GGADMP C[NH+](CCNC(=O)N1CCC[N@H+](CC2CCCCC2)CC1)Cc1ccccc1 ZINC000065540688 1408685681 /nfs/dbraw/zinc/68/56/81/1408685681.db2.gz REWZWOVEDUSKQA-UHFFFAOYSA-N 2 1 386.584 3.416 20 0 GGADMP C[NH+](CCNC(=O)N1CCC[N@@H+](CC2CCCCC2)CC1)Cc1ccccc1 ZINC000065540688 1408685686 /nfs/dbraw/zinc/68/56/86/1408685686.db2.gz REWZWOVEDUSKQA-UHFFFAOYSA-N 2 1 386.584 3.416 20 0 GGADMP C[N@H+](CCNC(=O)N1CCC[NH+](Cc2ccc(F)cc2)CC1)Cc1ccccc1 ZINC000065541291 1408686183 /nfs/dbraw/zinc/68/61/83/1408686183.db2.gz FPNKPMXGCQTZIQ-UHFFFAOYSA-N 2 1 398.526 3.175 20 0 GGADMP C[N@@H+](CCNC(=O)N1CCC[NH+](Cc2ccc(F)cc2)CC1)Cc1ccccc1 ZINC000065541291 1408686188 /nfs/dbraw/zinc/68/61/88/1408686188.db2.gz FPNKPMXGCQTZIQ-UHFFFAOYSA-N 2 1 398.526 3.175 20 0 GGADMP C[NH+](CCNC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)Cc1ccccc1 ZINC000065541291 1408686191 /nfs/dbraw/zinc/68/61/91/1408686191.db2.gz FPNKPMXGCQTZIQ-UHFFFAOYSA-N 2 1 398.526 3.175 20 0 GGADMP C[NH+](CCNC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)Cc1ccccc1 ZINC000065541291 1408686195 /nfs/dbraw/zinc/68/61/95/1408686195.db2.gz FPNKPMXGCQTZIQ-UHFFFAOYSA-N 2 1 398.526 3.175 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000065876443 1408746872 /nfs/dbraw/zinc/74/68/72/1408746872.db2.gz RCRGHEUTBHIZAW-IBGZPJMESA-N 2 1 375.532 3.371 20 0 GGADMP C#CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)C1CCCCC1 ZINC000065960184 1408763086 /nfs/dbraw/zinc/76/30/86/1408763086.db2.gz BCUOLNGINCIPEU-UHFFFAOYSA-N 2 1 381.564 3.344 20 0 GGADMP CC[C@H](C)[N@@H+](C)CCNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000066175945 1408787200 /nfs/dbraw/zinc/78/72/00/1408787200.db2.gz WDOZKJRCQMYBNS-INIZCTEOSA-N 2 1 380.964 3.334 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000066190962 1408789464 /nfs/dbraw/zinc/78/94/64/1408789464.db2.gz ZEDWCYYVLXOQEV-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@H](c2ccc(OC)cc2)[NH+]2CCCC2)cc1 ZINC000066242520 1408794672 /nfs/dbraw/zinc/79/46/72/1408794672.db2.gz GIGOCQAURLULIC-JOCHJYFZSA-N 2 1 396.535 3.197 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000176524715 1428350144 /nfs/dbraw/zinc/35/01/44/1428350144.db2.gz FQKIATZTOSOEOU-BWAGFHJFSA-N 2 1 384.568 3.480 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)[C@@H](c2ccccc2)[NH+]2CCSCC2)CC1 ZINC000066395501 1408830236 /nfs/dbraw/zinc/83/02/36/1408830236.db2.gz HFOVVVCBZKAUFP-HXUWFJFHSA-N 2 1 375.582 3.109 20 0 GGADMP [NH2+]=C1Nc2nc3ccccc3n2C2(CC[NH+](Cc3c(F)cccc3Cl)CC2)N1 ZINC000066738769 1408897610 /nfs/dbraw/zinc/89/76/10/1408897610.db2.gz BPJPVCLITWTPOF-UHFFFAOYSA-N 2 1 398.873 3.327 20 0 GGADMP CC(C)[C@@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000066896580 1408944621 /nfs/dbraw/zinc/94/46/21/1408944621.db2.gz DFRZOJLNLMRAQZ-KNKQGSTJSA-N 2 1 387.568 3.032 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)NCc2cccc(OC)c2)CC1 ZINC000066960738 1408963635 /nfs/dbraw/zinc/96/36/35/1408963635.db2.gz CAKOUYADGIHRSB-GOSISDBHSA-N 2 1 375.557 3.144 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)NCc2ccccc2OC)CC1 ZINC000066960881 1408963942 /nfs/dbraw/zinc/96/39/42/1408963942.db2.gz ZOXPKAPPWAJURT-SFHVURJKSA-N 2 1 375.557 3.144 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)cc1)[NH+]1CCOCC1 ZINC000176561769 1428364071 /nfs/dbraw/zinc/36/40/71/1428364071.db2.gz IWQHEUHTBQEAAA-RTBURBONSA-N 2 1 386.540 3.029 20 0 GGADMP Cc1ccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)cc1F ZINC000067121689 1409013095 /nfs/dbraw/zinc/01/30/95/1409013095.db2.gz YYIHYIHWXSIJJR-UHFFFAOYSA-N 2 1 385.483 3.085 20 0 GGADMP Cn1cc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c(-c2ccncc2)n1 ZINC000067187804 1409035853 /nfs/dbraw/zinc/03/58/53/1409035853.db2.gz LFAJBPLGOYKLFN-UHFFFAOYSA-N 2 1 375.520 3.279 20 0 GGADMP Cc1nn(CCO)c(C)c1C[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000067189078 1409036720 /nfs/dbraw/zinc/03/67/20/1409036720.db2.gz UXQANUCIKORVOB-HDICACEKSA-N 2 1 384.568 3.260 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000067265073 1409058699 /nfs/dbraw/zinc/05/86/99/1409058699.db2.gz QXXNVXLOJFAKIT-KDURUIRLSA-N 2 1 387.568 3.146 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000067265073 1409058709 /nfs/dbraw/zinc/05/87/09/1409058709.db2.gz QXXNVXLOJFAKIT-KDURUIRLSA-N 2 1 387.568 3.146 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1)c1ccco1 ZINC000067381683 1409094549 /nfs/dbraw/zinc/09/45/49/1409094549.db2.gz IVLUACVAASPJKI-NRFANRHFSA-N 2 1 398.551 3.436 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1)c1ccco1 ZINC000067381683 1409094554 /nfs/dbraw/zinc/09/45/54/1409094554.db2.gz IVLUACVAASPJKI-NRFANRHFSA-N 2 1 398.551 3.436 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000067414790 1409110068 /nfs/dbraw/zinc/11/00/68/1409110068.db2.gz XFCCUMOWNGDZBJ-IBGZPJMESA-N 2 1 397.567 3.381 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000067414790 1409110075 /nfs/dbraw/zinc/11/00/75/1409110075.db2.gz XFCCUMOWNGDZBJ-IBGZPJMESA-N 2 1 397.567 3.381 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2OCC(=O)N(C)C)c1 ZINC000067450009 1409121441 /nfs/dbraw/zinc/12/14/41/1409121441.db2.gz HXNHUHIMUQIIQO-UHFFFAOYSA-N 2 1 383.536 3.284 20 0 GGADMP C[NH+](C)[C@H]1CCC[C@@H](NC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1 ZINC000176604392 1428377340 /nfs/dbraw/zinc/37/73/40/1428377340.db2.gz KCEMIARGGBNCRE-YADHBBJMSA-N 2 1 386.584 3.413 20 0 GGADMP CN(C)C(=O)COc1ccccc1C[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000067507084 1409139559 /nfs/dbraw/zinc/13/95/59/1409139559.db2.gz MBWMOCASTODXQY-OAQYLSRUSA-N 2 1 395.547 3.155 20 0 GGADMP CN(C)C(=O)COc1ccccc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000067507084 1409139566 /nfs/dbraw/zinc/13/95/66/1409139566.db2.gz MBWMOCASTODXQY-OAQYLSRUSA-N 2 1 395.547 3.155 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C)[N@@H+]2CCC[C@H](C)C2)cc1F ZINC000067646552 1409196208 /nfs/dbraw/zinc/19/62/08/1409196208.db2.gz DZRUTGZRFHMXCE-JKSUJKDBSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1F ZINC000067646552 1409196214 /nfs/dbraw/zinc/19/62/14/1409196214.db2.gz DZRUTGZRFHMXCE-JKSUJKDBSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[C@@H]([NH+]3CCCC3)C2)cc1F ZINC000067646746 1409197155 /nfs/dbraw/zinc/19/71/55/1409197155.db2.gz LNKWZEPXEZDILE-GOSISDBHSA-N 2 1 385.487 3.090 20 0 GGADMP CC(C)[N@@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000067686570 1409207139 /nfs/dbraw/zinc/20/71/39/1409207139.db2.gz SJKHBJAHLQVFJQ-IBGZPJMESA-N 2 1 392.975 3.288 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000067686570 1409207143 /nfs/dbraw/zinc/20/71/43/1409207143.db2.gz SJKHBJAHLQVFJQ-IBGZPJMESA-N 2 1 392.975 3.288 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000067686570 1409207146 /nfs/dbraw/zinc/20/71/46/1409207146.db2.gz SJKHBJAHLQVFJQ-IBGZPJMESA-N 2 1 392.975 3.288 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000067686570 1409207151 /nfs/dbraw/zinc/20/71/51/1409207151.db2.gz SJKHBJAHLQVFJQ-IBGZPJMESA-N 2 1 392.975 3.288 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccccc1OCC(=O)N1CCCC1 ZINC000067691356 1409207541 /nfs/dbraw/zinc/20/75/41/1409207541.db2.gz MQOHJAANTZVIGE-HXUWFJFHSA-N 2 1 387.568 3.432 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccccc1OCC(=O)N1CCCC1 ZINC000067691359 1409207633 /nfs/dbraw/zinc/20/76/33/1409207633.db2.gz MQOHJAANTZVIGE-FQEVSTJZSA-N 2 1 387.568 3.432 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000067735117 1409217114 /nfs/dbraw/zinc/21/71/14/1409217114.db2.gz NBMMWFMAZFQCGL-WOJBJXKFSA-N 2 1 384.524 3.094 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000067735117 1409217117 /nfs/dbraw/zinc/21/71/17/1409217117.db2.gz NBMMWFMAZFQCGL-WOJBJXKFSA-N 2 1 384.524 3.094 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000067734531 1409217276 /nfs/dbraw/zinc/21/72/76/1409217276.db2.gz GVAOOOLVMRKTRL-QHCPKHFHSA-N 2 1 394.563 3.460 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000067735115 1409217316 /nfs/dbraw/zinc/21/73/16/1409217316.db2.gz NBMMWFMAZFQCGL-UXHICEINSA-N 2 1 384.524 3.094 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000067735115 1409217322 /nfs/dbraw/zinc/21/73/22/1409217322.db2.gz NBMMWFMAZFQCGL-UXHICEINSA-N 2 1 384.524 3.094 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)c1 ZINC000068201941 1409329709 /nfs/dbraw/zinc/32/97/09/1409329709.db2.gz AZKNNCCYLWGVQH-NRFANRHFSA-N 2 1 383.511 3.416 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)CC1 ZINC000068209351 1409330526 /nfs/dbraw/zinc/33/05/26/1409330526.db2.gz LAIRXNUPSGPBGM-RTBURBONSA-N 2 1 387.568 3.242 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCCCC3)CC2)cs1 ZINC000068236055 1409337046 /nfs/dbraw/zinc/33/70/46/1409337046.db2.gz QJNWHWUDXJKLHZ-UHFFFAOYSA-N 2 1 378.586 3.046 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCc3cccc(C[NH+](C)C)c3)CC2)cs1 ZINC000068260336 1409343205 /nfs/dbraw/zinc/34/32/05/1409343205.db2.gz QFJWIGCIAFNVTD-UHFFFAOYSA-N 2 1 386.565 3.042 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[N@@H+](C)C3CCCCC3)CC2)cs1 ZINC000068261856 1409343925 /nfs/dbraw/zinc/34/39/25/1409343925.db2.gz QLLHOZJPBQCWCZ-UHFFFAOYSA-N 2 1 392.613 3.434 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[N@H+](C)C3CCCCC3)CC2)cs1 ZINC000068261856 1409343934 /nfs/dbraw/zinc/34/39/34/1409343934.db2.gz QLLHOZJPBQCWCZ-UHFFFAOYSA-N 2 1 392.613 3.434 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@]3([NH+](C)C)CCC[C@H](C)C3)CC2)cs1 ZINC000068304370 1409358349 /nfs/dbraw/zinc/35/83/49/1409358349.db2.gz DGZUCEKLXKOKIJ-KKSFZXQISA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@H](C)C[NH+]3C[C@@H](C)C[C@H](C)C3)CC2)cs1 ZINC000068306214 1409358795 /nfs/dbraw/zinc/35/87/95/1409358795.db2.gz NFVXDYHZIAYQQR-YESZJQIVSA-N 2 1 392.613 3.146 20 0 GGADMP CC[N@H+](C)[C@H](C(=O)Nc1ccc(NC(=O)CC[NH+](C)C)cc1)c1ccccc1 ZINC000068309531 1409360028 /nfs/dbraw/zinc/36/00/28/1409360028.db2.gz GFQMLYKYJVBQIT-NRFANRHFSA-N 2 1 382.508 3.208 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)Nc1ccc(NC(=O)CC[NH+](C)C)cc1)c1ccccc1 ZINC000068309531 1409360032 /nfs/dbraw/zinc/36/00/32/1409360032.db2.gz GFQMLYKYJVBQIT-NRFANRHFSA-N 2 1 382.508 3.208 20 0 GGADMP CC[N@H+](C)[C@@H](C(=O)Nc1ccc(NC(=O)CC[NH+](C)C)cc1)c1ccccc1 ZINC000068309533 1409360244 /nfs/dbraw/zinc/36/02/44/1409360244.db2.gz GFQMLYKYJVBQIT-OAQYLSRUSA-N 2 1 382.508 3.208 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)Nc1ccc(NC(=O)CC[NH+](C)C)cc1)c1ccccc1 ZINC000068309533 1409360247 /nfs/dbraw/zinc/36/02/47/1409360247.db2.gz GFQMLYKYJVBQIT-OAQYLSRUSA-N 2 1 382.508 3.208 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000068449852 1409405880 /nfs/dbraw/zinc/40/58/80/1409405880.db2.gz CLBCSHNWUMIKOT-LJQANCHMSA-N 2 1 375.532 3.418 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC1CC[NH+](CC2CCCCC2)CC1)c1ccco1 ZINC000068636965 1409453068 /nfs/dbraw/zinc/45/30/68/1409453068.db2.gz PZXDERXUYWJCHL-IBGZPJMESA-N 2 1 376.545 3.226 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+](C)CCc2ccccc2F)CC1 ZINC000068861952 1409509862 /nfs/dbraw/zinc/50/98/62/1409509862.db2.gz DABHGLQMEBMXML-UHFFFAOYSA-N 2 1 397.538 3.389 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](C)CCc2ccccc2F)CC1 ZINC000068861952 1409509866 /nfs/dbraw/zinc/50/98/66/1409509866.db2.gz DABHGLQMEBMXML-UHFFFAOYSA-N 2 1 397.538 3.389 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](CC(=O)NC3(c4ccccc4)CCC3)CC2)C[C@@H](C)O1 ZINC000069017011 1409544354 /nfs/dbraw/zinc/54/43/54/1409544354.db2.gz LUMRLTSBGVJUQF-WOJBJXKFSA-N 2 1 399.579 3.003 20 0 GGADMP C[C@H](NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1)c1cc2ccccc2o1 ZINC000069028980 1409546719 /nfs/dbraw/zinc/54/67/19/1409546719.db2.gz NCQWAGCNSOGEFK-ROUUACIJSA-N 2 1 399.535 3.043 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCOCC2)CC1)N[C@H](c1ccccc1)C1CCCC1 ZINC000069028457 1409546770 /nfs/dbraw/zinc/54/67/70/1409546770.db2.gz LMDSHTKENPTQOF-XMMPIXPASA-N 2 1 399.579 3.078 20 0 GGADMP COc1ccccc1-c1nc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cs1 ZINC000069028865 1409547019 /nfs/dbraw/zinc/54/70/19/1409547019.db2.gz RCUARNODQGUFLL-UHFFFAOYSA-N 2 1 387.549 3.363 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000069045939 1409552648 /nfs/dbraw/zinc/55/26/48/1409552648.db2.gz VZRREPLKXRMFMP-LJQANCHMSA-N 2 1 375.557 3.257 20 0 GGADMP CCC[N@@H+]1CCCC[C@H]1C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000069459303 1409637674 /nfs/dbraw/zinc/63/76/74/1409637674.db2.gz CLISDWKNNNPHSZ-FQEVSTJZSA-N 2 1 379.495 3.310 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000069459303 1409637682 /nfs/dbraw/zinc/63/76/82/1409637682.db2.gz CLISDWKNNNPHSZ-FQEVSTJZSA-N 2 1 379.495 3.310 20 0 GGADMP CCC[N@@H+]1CCCC[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000069459298 1409637989 /nfs/dbraw/zinc/63/79/89/1409637989.db2.gz CLISDWKNNNPHSZ-HXUWFJFHSA-N 2 1 379.495 3.310 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000069459298 1409637994 /nfs/dbraw/zinc/63/79/94/1409637994.db2.gz CLISDWKNNNPHSZ-HXUWFJFHSA-N 2 1 379.495 3.310 20 0 GGADMP CC(C)[N@@H+]1CCCN(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)CC1 ZINC000069778623 1409696221 /nfs/dbraw/zinc/69/62/21/1409696221.db2.gz MBDUYMIDSDATKV-UHFFFAOYSA-N 2 1 394.510 3.055 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)CC1 ZINC000069778623 1409696224 /nfs/dbraw/zinc/69/62/24/1409696224.db2.gz MBDUYMIDSDATKV-UHFFFAOYSA-N 2 1 394.510 3.055 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(Br)cc3)cc2)CC1 ZINC000069785252 1409698182 /nfs/dbraw/zinc/69/81/82/1409698182.db2.gz XZHVACRLLGJMOU-UHFFFAOYSA-N 2 1 388.353 3.486 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000070031731 1409742194 /nfs/dbraw/zinc/74/21/94/1409742194.db2.gz RUHFPQUDAWKFRW-FQEVSTJZSA-N 2 1 381.520 3.478 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000070448686 1409746603 /nfs/dbraw/zinc/74/66/03/1409746603.db2.gz UMQHQJFVINWOBY-FQEVSTJZSA-N 2 1 383.561 3.135 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000070448686 1409746609 /nfs/dbraw/zinc/74/66/09/1409746609.db2.gz UMQHQJFVINWOBY-FQEVSTJZSA-N 2 1 383.561 3.135 20 0 GGADMP O=C(NCC[NH+]1CCc2sccc2C1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000070448686 1409746612 /nfs/dbraw/zinc/74/66/12/1409746612.db2.gz UMQHQJFVINWOBY-FQEVSTJZSA-N 2 1 383.561 3.135 20 0 GGADMP O=C(NCC[NH+]1CCc2sccc2C1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000070448686 1409746616 /nfs/dbraw/zinc/74/66/16/1409746616.db2.gz UMQHQJFVINWOBY-FQEVSTJZSA-N 2 1 383.561 3.135 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000071935881 1409831722 /nfs/dbraw/zinc/83/17/22/1409831722.db2.gz PHEMRVCGSILBRU-OYRHEFFESA-N 2 1 386.584 3.272 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000071935881 1409831723 /nfs/dbraw/zinc/83/17/23/1409831723.db2.gz PHEMRVCGSILBRU-OYRHEFFESA-N 2 1 386.584 3.272 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000072036125 1409839506 /nfs/dbraw/zinc/83/95/06/1409839506.db2.gz YALKYBVVHIAENC-FQEVSTJZSA-N 2 1 386.584 3.462 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@H](C(C)C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000072092400 1409848118 /nfs/dbraw/zinc/84/81/18/1409848118.db2.gz DTGZOVCXPKKNMC-JQVVWYNYSA-N 2 1 389.584 3.231 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@H](C(C)C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000072092400 1409848119 /nfs/dbraw/zinc/84/81/19/1409848119.db2.gz DTGZOVCXPKKNMC-JQVVWYNYSA-N 2 1 389.584 3.231 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000072731601 1409853086 /nfs/dbraw/zinc/85/30/86/1409853086.db2.gz VQMGFALCVRFATA-OAQYLSRUSA-N 2 1 384.568 3.024 20 0 GGADMP CCn1cc(C[NH+](C)Cc2cccc(C[N@H+](C)Cc3cnn(CC)c3)c2)cn1 ZINC000072989132 1409856841 /nfs/dbraw/zinc/85/68/41/1409856841.db2.gz SGBLIWWGICKWFI-UHFFFAOYSA-N 2 1 380.540 3.383 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCCC2)CC1)[C@@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000073106206 1409858407 /nfs/dbraw/zinc/85/84/07/1409858407.db2.gz VRQXWOMZNOQHDJ-QFIPXVFZSA-N 2 1 384.568 3.207 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCCC2)CC1)[C@@H]1CCC[N@H+]1Cc1ccccn1 ZINC000073106206 1409858409 /nfs/dbraw/zinc/85/84/09/1409858409.db2.gz VRQXWOMZNOQHDJ-QFIPXVFZSA-N 2 1 384.568 3.207 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000073308030 1409860247 /nfs/dbraw/zinc/86/02/47/1409860247.db2.gz IEZOZQMKJKCWHR-QFIPXVFZSA-N 2 1 380.536 3.156 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1 ZINC000073308030 1409860251 /nfs/dbraw/zinc/86/02/51/1409860251.db2.gz IEZOZQMKJKCWHR-QFIPXVFZSA-N 2 1 380.536 3.156 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)N[C@@H](C)C[NH+]1CCCCC1 ZINC000073665510 1409863844 /nfs/dbraw/zinc/86/38/44/1409863844.db2.gz GXMVNCIAHJZXKW-RBBKRZOGSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)N[C@@H](C)C[NH+]1CCCCC1 ZINC000073665517 1409864157 /nfs/dbraw/zinc/86/41/57/1409864157.db2.gz GXMVNCIAHJZXKW-UNMCSNQZSA-N 2 1 386.584 3.414 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1 ZINC000074084671 1409868996 /nfs/dbraw/zinc/86/89/96/1409868996.db2.gz VPFOMMNBJJHABK-VXKWHMMOSA-N 2 1 386.584 3.067 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000074084671 1409868998 /nfs/dbraw/zinc/86/89/98/1409868998.db2.gz VPFOMMNBJJHABK-VXKWHMMOSA-N 2 1 386.584 3.067 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000074084671 1409869001 /nfs/dbraw/zinc/86/90/01/1409869001.db2.gz VPFOMMNBJJHABK-VXKWHMMOSA-N 2 1 386.584 3.067 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CC[C@@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000074103601 1409869329 /nfs/dbraw/zinc/86/93/29/1409869329.db2.gz ZSEVEIKWXIPEFS-IRLDBZIGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000074103601 1409869332 /nfs/dbraw/zinc/86/93/32/1409869332.db2.gz ZSEVEIKWXIPEFS-IRLDBZIGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)C1 ZINC000074103601 1409869333 /nfs/dbraw/zinc/86/93/33/1409869333.db2.gz ZSEVEIKWXIPEFS-IRLDBZIGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)C[C@H](CNC(=O)c1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)[NH+](C)C ZINC000074137049 1409869394 /nfs/dbraw/zinc/86/93/94/1409869394.db2.gz AHFUYKSITHKVIJ-BBTUJRGHSA-N 2 1 375.557 3.002 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000074533105 1409873427 /nfs/dbraw/zinc/87/34/27/1409873427.db2.gz YBFHKIZNBRCEEJ-UHFFFAOYSA-N 2 1 375.561 3.269 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000074533105 1409873428 /nfs/dbraw/zinc/87/34/28/1409873428.db2.gz YBFHKIZNBRCEEJ-UHFFFAOYSA-N 2 1 375.561 3.269 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000074845297 1409877301 /nfs/dbraw/zinc/87/73/01/1409877301.db2.gz DTWWRGRQYJXMHG-HXUWFJFHSA-N 2 1 384.568 3.156 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)C1 ZINC000074852371 1409877695 /nfs/dbraw/zinc/87/76/95/1409877695.db2.gz DQICWKSRVUBERY-SFHLNBCPSA-N 2 1 378.605 3.118 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NC2CC[NH+](CC3CCCCC3)CC2)C1 ZINC000074868204 1409878031 /nfs/dbraw/zinc/87/80/31/1409878031.db2.gz GVEPIEFMZFIRRT-OAQYLSRUSA-N 2 1 390.616 3.404 20 0 GGADMP CCc1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000075007895 1409879966 /nfs/dbraw/zinc/87/99/66/1409879966.db2.gz PODNNOKNNJYCLQ-GOSISDBHSA-N 2 1 375.557 3.399 20 0 GGADMP CCc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000075007896 1409880068 /nfs/dbraw/zinc/88/00/68/1409880068.db2.gz PODNNOKNNJYCLQ-SFHVURJKSA-N 2 1 375.557 3.399 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2cccc(Cl)c2)CC1 ZINC000075007715 1409880252 /nfs/dbraw/zinc/88/02/52/1409880252.db2.gz LPTVYIIUAMSAQZ-MRXNPFEDSA-N 2 1 381.948 3.490 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)CC[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000075835595 1409883198 /nfs/dbraw/zinc/88/31/98/1409883198.db2.gz HIJTWGSHBFRCGN-MRXNPFEDSA-N 2 1 379.932 3.485 20 0 GGADMP c1ccc(-c2nnn(CCCCC[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)n2)cc1 ZINC000075834663 1409883237 /nfs/dbraw/zinc/88/32/37/1409883237.db2.gz VQBWOUQOHSPAHT-HXUWFJFHSA-N 2 1 382.556 3.318 20 0 GGADMP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(C[NH+]3CCSCC3)cc2)[C@H](C)C1 ZINC000076487956 1409888814 /nfs/dbraw/zinc/88/88/14/1409888814.db2.gz YFKBNVGXISZCCH-XLIONFOSSA-N 2 1 375.582 3.038 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)NC[C@H]3CC[N@H+](C4CC4)C3)c2)CC1 ZINC000076554182 1409889407 /nfs/dbraw/zinc/88/94/07/1409889407.db2.gz SIPPYVIBONEADF-OAQYLSRUSA-N 2 1 384.568 3.202 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000076515070 1409889451 /nfs/dbraw/zinc/88/94/51/1409889451.db2.gz VOOLZWFRSDXLRR-JOCHJYFZSA-N 2 1 386.584 3.448 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N[C@@H](C)c2ccccc2OC)CC1 ZINC000076776443 1409891488 /nfs/dbraw/zinc/89/14/88/1409891488.db2.gz JZAAJULZJFGHMD-SFHVURJKSA-N 2 1 375.557 3.316 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000077201978 1409894481 /nfs/dbraw/zinc/89/44/81/1409894481.db2.gz AAYIGTREDTWOSV-LJQANCHMSA-N 2 1 376.545 3.354 20 0 GGADMP CCOc1cc(C)ccc1NC(=O)N(CC[NH+](C)C)C[C@H]1CCC[N@H+]1CC ZINC000077202168 1409894492 /nfs/dbraw/zinc/89/44/92/1409894492.db2.gz LEBQFWLSNSJJLB-GOSISDBHSA-N 2 1 376.545 3.274 20 0 GGADMP CCOc1ccc(NC(=O)N(CC[NH+](C)C)C[C@H]2CCC[N@H+]2CC)c(C)c1 ZINC000077202340 1409894529 /nfs/dbraw/zinc/89/45/29/1409894529.db2.gz ZXOKALWZMVMCFM-GOSISDBHSA-N 2 1 376.545 3.274 20 0 GGADMP CCOc1ccc(NC(=O)N(CC[NH+](C)C)C[C@@H]2CCC[N@H+]2CC)c(C)c1 ZINC000077202341 1409894622 /nfs/dbraw/zinc/89/46/22/1409894622.db2.gz ZXOKALWZMVMCFM-SFHVURJKSA-N 2 1 376.545 3.274 20 0 GGADMP CCC[NH+]1CCC(NC(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000077202910 1409894729 /nfs/dbraw/zinc/89/47/29/1409894729.db2.gz DHNDCQOOOJNVQY-UHFFFAOYSA-N 2 1 376.570 3.231 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c2ccccc2)CC1 ZINC000077785540 1409900467 /nfs/dbraw/zinc/90/04/67/1409900467.db2.gz HSZOKBDOTHYJTK-YADHBBJMSA-N 2 1 384.568 3.339 20 0 GGADMP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000077799924 1409901708 /nfs/dbraw/zinc/90/17/08/1409901708.db2.gz KYDRYHBVXPNHBB-JOCHJYFZSA-N 2 1 384.568 3.442 20 0 GGADMP CC[C@H](CNC(=O)NC1CC[NH+](CC(C)C)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079097230 1409956677 /nfs/dbraw/zinc/95/66/77/1409956677.db2.gz FJJCGILNNHVFMI-JOCHJYFZSA-N 2 1 386.584 3.243 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)NC[C@@H]1CC[NH+](C2CC2)C1 ZINC000079169114 1409961481 /nfs/dbraw/zinc/96/14/81/1409961481.db2.gz VQCGEVWDGYDSED-MOPGFXCFSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000079169114 1409961490 /nfs/dbraw/zinc/96/14/90/1409961490.db2.gz VQCGEVWDGYDSED-MOPGFXCFSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000079169114 1409961502 /nfs/dbraw/zinc/96/15/02/1409961502.db2.gz VQCGEVWDGYDSED-MOPGFXCFSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NC[C@@H]3CC[NH+](C4CC4)C3)cc2)C1 ZINC000079170458 1409961686 /nfs/dbraw/zinc/96/16/86/1409961686.db2.gz JUJFOFMUBAZLIA-NQIIRXRSSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CC[N@@H+](C4CC4)C3)cc2)C1 ZINC000079170458 1409961694 /nfs/dbraw/zinc/96/16/94/1409961694.db2.gz JUJFOFMUBAZLIA-NQIIRXRSSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)cc2)C1 ZINC000079170458 1409961704 /nfs/dbraw/zinc/96/17/04/1409961704.db2.gz JUJFOFMUBAZLIA-NQIIRXRSSA-N 2 1 384.568 3.202 20 0 GGADMP CC[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000079256952 1409963319 /nfs/dbraw/zinc/96/33/19/1409963319.db2.gz PAAHGOOYIYTLNS-FGZHOGPDSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000079227915 1409964414 /nfs/dbraw/zinc/96/44/14/1409964414.db2.gz YRDRGZRPOGBMQP-PXNSSMCTSA-N 2 1 378.536 3.240 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@H](C)[NH+]2CCc3ccccc3C2)CC1 ZINC000079620866 1409983950 /nfs/dbraw/zinc/98/39/50/1409983950.db2.gz HIFKAEAVIPGEPP-IBGZPJMESA-N 2 1 386.584 3.195 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)NC[C@H](C)[N@@H+]2CCc3ccccc3C2)CC1 ZINC000079620866 1409983963 /nfs/dbraw/zinc/98/39/63/1409983963.db2.gz HIFKAEAVIPGEPP-IBGZPJMESA-N 2 1 386.584 3.195 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000079620866 1409983973 /nfs/dbraw/zinc/98/39/73/1409983973.db2.gz HIFKAEAVIPGEPP-IBGZPJMESA-N 2 1 386.584 3.195 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)N[C@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC000079627286 1409984066 /nfs/dbraw/zinc/98/40/66/1409984066.db2.gz KWRJGWSILIBWRY-QFIPXVFZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000079627286 1409984073 /nfs/dbraw/zinc/98/40/73/1409984073.db2.gz KWRJGWSILIBWRY-QFIPXVFZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000079627286 1409984078 /nfs/dbraw/zinc/98/40/78/1409984078.db2.gz KWRJGWSILIBWRY-QFIPXVFZSA-N 2 1 386.584 3.413 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)CC1 ZINC000080015061 1409998538 /nfs/dbraw/zinc/99/85/38/1409998538.db2.gz GYIUCOWNGDWWAW-INIZCTEOSA-N 2 1 378.586 3.011 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)CC1 ZINC000080015061 1409998540 /nfs/dbraw/zinc/99/85/40/1409998540.db2.gz GYIUCOWNGDWWAW-INIZCTEOSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000080164729 1410001795 /nfs/dbraw/zinc/00/17/95/1410001795.db2.gz JUFRSZWTPYNDDX-KNQAVFIVSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000080164725 1410002300 /nfs/dbraw/zinc/00/23/00/1410002300.db2.gz JUFRSZWTPYNDDX-SIKLNZKXSA-N 2 1 386.584 3.413 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2c(C)cccc2C)CC1 ZINC000080650466 1410009528 /nfs/dbraw/zinc/00/95/28/1410009528.db2.gz XEQVEUFAEMBSTH-IBGZPJMESA-N 2 1 375.557 3.453 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)C1 ZINC000080664483 1410009782 /nfs/dbraw/zinc/00/97/82/1410009782.db2.gz RAGHHZSJMUFBDP-IRLDBZIGSA-N 2 1 384.568 3.197 20 0 GGADMP CC1CC[NH+](C[C@H]2CCCN(C(=O)[C@@H]3CCC[N@@H+]3Cc3ccccn3)C2)CC1 ZINC000081023363 1410014466 /nfs/dbraw/zinc/01/44/66/1410014466.db2.gz HEPWJVBWANQNEU-IRLDBZIGSA-N 2 1 384.568 3.017 20 0 GGADMP CC1CC[NH+](C[C@H]2CCCN(C(=O)[C@@H]3CCC[N@H+]3Cc3ccccn3)C2)CC1 ZINC000081023363 1410014476 /nfs/dbraw/zinc/01/44/76/1410014476.db2.gz HEPWJVBWANQNEU-IRLDBZIGSA-N 2 1 384.568 3.017 20 0 GGADMP O=C([C@@H]1CCC[N@@H+]1Cc1ccccn1)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000081338388 1410017911 /nfs/dbraw/zinc/01/79/11/1410017911.db2.gz DRYVPNRKNPVEIS-QFIPXVFZSA-N 2 1 384.568 3.161 20 0 GGADMP O=C([C@@H]1CCC[N@H+]1Cc1ccccn1)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000081338388 1410017917 /nfs/dbraw/zinc/01/79/17/1410017917.db2.gz DRYVPNRKNPVEIS-QFIPXVFZSA-N 2 1 384.568 3.161 20 0 GGADMP C[C@H]1CCC[N@H+](CCCCNC(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000081552296 1410020585 /nfs/dbraw/zinc/02/05/85/1410020585.db2.gz BOGMBHDUBCLNEO-RXVVDRJESA-N 2 1 375.532 3.418 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000081552296 1410020591 /nfs/dbraw/zinc/02/05/91/1410020591.db2.gz BOGMBHDUBCLNEO-RXVVDRJESA-N 2 1 375.532 3.418 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000081552296 1410020598 /nfs/dbraw/zinc/02/05/98/1410020598.db2.gz BOGMBHDUBCLNEO-RXVVDRJESA-N 2 1 375.532 3.418 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000081552296 1410020604 /nfs/dbraw/zinc/02/06/04/1410020604.db2.gz BOGMBHDUBCLNEO-RXVVDRJESA-N 2 1 375.532 3.418 20 0 GGADMP CC(C)[N@H+](C)CC1CCN(C(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)CC1 ZINC000081592299 1410021759 /nfs/dbraw/zinc/02/17/59/1410021759.db2.gz JIXYLUBZLKJVJI-OAQYLSRUSA-N 2 1 375.532 3.369 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)CC1 ZINC000081592299 1410021766 /nfs/dbraw/zinc/02/17/66/1410021766.db2.gz JIXYLUBZLKJVJI-OAQYLSRUSA-N 2 1 375.532 3.369 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000081592299 1410021773 /nfs/dbraw/zinc/02/17/73/1410021773.db2.gz JIXYLUBZLKJVJI-OAQYLSRUSA-N 2 1 375.532 3.369 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000081592299 1410021783 /nfs/dbraw/zinc/02/17/83/1410021783.db2.gz JIXYLUBZLKJVJI-OAQYLSRUSA-N 2 1 375.532 3.369 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)CC[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081631918 1410022809 /nfs/dbraw/zinc/02/28/09/1410022809.db2.gz FOVYGMDFBHKPDO-MRXNPFEDSA-N 2 1 379.932 3.341 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)CC[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000081631918 1410022815 /nfs/dbraw/zinc/02/28/15/1410022815.db2.gz FOVYGMDFBHKPDO-MRXNPFEDSA-N 2 1 379.932 3.341 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)CC[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081631918 1410022824 /nfs/dbraw/zinc/02/28/24/1410022824.db2.gz FOVYGMDFBHKPDO-MRXNPFEDSA-N 2 1 379.932 3.341 20 0 GGADMP [NH2+]=C(NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)N[C@@H]1CCOc2ccccc21 ZINC000083033203 1410026979 /nfs/dbraw/zinc/02/69/79/1410026979.db2.gz BLUQUADMDFMKDC-TZIWHRDSSA-N 2 1 378.520 3.327 20 0 GGADMP [NH2+]=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N[C@@H]1CCOc2ccccc21 ZINC000083033206 1410027317 /nfs/dbraw/zinc/02/73/17/1410027317.db2.gz BLUQUADMDFMKDC-PZJWPPBQSA-N 2 1 378.520 3.327 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCC(=O)Nc3cc(N)ccc3F)C2)CC1 ZINC000083173879 1410028200 /nfs/dbraw/zinc/02/82/00/1410028200.db2.gz AFJIEFBXHIALBG-QGZVFWFLSA-N 2 1 376.520 3.180 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c2ccccc2)CC1 ZINC000085394129 1410040296 /nfs/dbraw/zinc/04/02/96/1410040296.db2.gz GKHAPDNBVSOANC-ILWGZMRPSA-N 2 1 386.584 3.441 20 0 GGADMP COC(=O)c1sccc1C[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000088546715 1410049981 /nfs/dbraw/zinc/04/99/81/1410049981.db2.gz AEZZABMURJXFDI-IYBDPMFKSA-N 2 1 380.554 3.246 20 0 GGADMP COC(=O)c1sccc1C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000088546715 1410049989 /nfs/dbraw/zinc/04/99/89/1410049989.db2.gz AEZZABMURJXFDI-IYBDPMFKSA-N 2 1 380.554 3.246 20 0 GGADMP COc1ccc(C[C@H](C)[NH2+]CC2([NH+]3CCCCC3)CCOCC2)cc1OC ZINC000089594306 1410054863 /nfs/dbraw/zinc/05/48/63/1410054863.db2.gz XOHWCIYJJZJIKL-SFHVURJKSA-N 2 1 376.541 3.260 20 0 GGADMP COCC[C@@H](Cc1cccc(F)c1)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000089594453 1410055240 /nfs/dbraw/zinc/05/52/40/1410055240.db2.gz MYVRZUATAFBUAI-NRFANRHFSA-N 2 1 378.532 3.398 20 0 GGADMP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+][C@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000090234072 1410063532 /nfs/dbraw/zinc/06/35/32/1410063532.db2.gz LWLNBCJXNNEANW-LQWHRVPQSA-N 2 1 375.557 3.363 20 0 GGADMP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+][C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1 ZINC000090234213 1410064376 /nfs/dbraw/zinc/06/43/76/1410064376.db2.gz QPBVDSQNBNTYHM-RYLXDESZSA-N 2 1 375.557 3.361 20 0 GGADMP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1S(C)(=O)=O ZINC000090586827 1410064925 /nfs/dbraw/zinc/06/49/25/1410064925.db2.gz JOSXMMDPNIVJOP-IRXDYDNUSA-N 2 1 382.570 3.117 20 0 GGADMP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)ccc1S(C)(=O)=O ZINC000090586827 1410064930 /nfs/dbraw/zinc/06/49/30/1410064930.db2.gz JOSXMMDPNIVJOP-IRXDYDNUSA-N 2 1 382.570 3.117 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCO[C@@]4(CCSC4)C3)CC2)cc1 ZINC000090540149 1410065015 /nfs/dbraw/zinc/06/50/15/1410065015.db2.gz WZFGVMGUYQCCBY-RTWAWAEBSA-N 2 1 378.557 3.477 20 0 GGADMP C[C@H](CNC(=O)OC(C)(C)C)C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000090715387 1410067350 /nfs/dbraw/zinc/06/73/50/1410067350.db2.gz YQSSIJGATFRHRA-SFHVURJKSA-N 2 1 375.557 3.444 20 0 GGADMP C[C@H]1C[C@@H](NCc2ccnc(OCC[NH+](C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000090937362 1410067836 /nfs/dbraw/zinc/06/78/36/1410067836.db2.gz GNIZOYZVMUNLIP-UGKGYDQZSA-N 2 1 382.552 3.165 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CCN1Cc1ccccc1 ZINC000090937362 1410067841 /nfs/dbraw/zinc/06/78/41/1410067841.db2.gz GNIZOYZVMUNLIP-UGKGYDQZSA-N 2 1 382.552 3.165 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000090937362 1410067849 /nfs/dbraw/zinc/06/78/49/1410067849.db2.gz GNIZOYZVMUNLIP-UGKGYDQZSA-N 3 1 382.552 3.165 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000090937362 1410067856 /nfs/dbraw/zinc/06/78/56/1410067856.db2.gz GNIZOYZVMUNLIP-UGKGYDQZSA-N 3 1 382.552 3.165 20 0 GGADMP C[C@@H]1C[C@@H](NCc2ccnc(OCC[NH+](C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000090937361 1410067961 /nfs/dbraw/zinc/06/79/61/1410067961.db2.gz GNIZOYZVMUNLIP-KNQAVFIVSA-N 2 1 382.552 3.165 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CCN1Cc1ccccc1 ZINC000090937361 1410067967 /nfs/dbraw/zinc/06/79/67/1410067967.db2.gz GNIZOYZVMUNLIP-KNQAVFIVSA-N 2 1 382.552 3.165 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000090937361 1410067976 /nfs/dbraw/zinc/06/79/76/1410067976.db2.gz GNIZOYZVMUNLIP-KNQAVFIVSA-N 3 1 382.552 3.165 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000090937361 1410067987 /nfs/dbraw/zinc/06/79/87/1410067987.db2.gz GNIZOYZVMUNLIP-KNQAVFIVSA-N 3 1 382.552 3.165 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@@H+]2CCCN(C(=O)c3ccsc3)CC2)cc1 ZINC000092149072 1410112982 /nfs/dbraw/zinc/11/29/82/1410112982.db2.gz YQJOZQOEKUTRNK-UHFFFAOYSA-N 2 1 387.549 3.037 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCCN(C(=O)c3ccsc3)CC2)cc1 ZINC000092149072 1410112987 /nfs/dbraw/zinc/11/29/87/1410112987.db2.gz YQJOZQOEKUTRNK-UHFFFAOYSA-N 2 1 387.549 3.037 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(F)c(Cl)c2)CC1 ZINC000092426497 1410157165 /nfs/dbraw/zinc/15/71/65/1410157165.db2.gz QCUHSBVTALICJF-UHFFFAOYSA-N 2 1 383.939 3.395 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCCN(c2nccs2)CC1)C1CC[NH+](C)CC1 ZINC000092482769 1410161245 /nfs/dbraw/zinc/16/12/45/1410161245.db2.gz GJMIUNWIWDFLRS-UHFFFAOYSA-N 2 1 399.608 3.386 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1 ZINC000092513088 1410165804 /nfs/dbraw/zinc/16/58/04/1410165804.db2.gz JMCOQSBYZMHCBM-IBGZPJMESA-N 2 1 391.556 3.364 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NC[C@H](C3CCCCC3)[NH+](C)C)CC2)[nH+]c1 ZINC000176787669 1428461701 /nfs/dbraw/zinc/46/17/01/1428461701.db2.gz JQEXLHMEOFRPLO-HXUWFJFHSA-N 2 1 387.572 3.169 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000092666090 1410186568 /nfs/dbraw/zinc/18/65/68/1410186568.db2.gz GKUAVMYWZFIVLH-BGYRXZFFSA-N 2 1 395.551 3.259 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000092666090 1410186573 /nfs/dbraw/zinc/18/65/73/1410186573.db2.gz GKUAVMYWZFIVLH-BGYRXZFFSA-N 2 1 395.551 3.259 20 0 GGADMP COCCCOc1cccc(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1 ZINC000092666346 1410186796 /nfs/dbraw/zinc/18/67/96/1410186796.db2.gz CSEVFIMYCINWAJ-NHCUHLMSSA-N 2 1 389.584 3.092 20 0 GGADMP CC(C)c1ocnc1C[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000092806482 1410203513 /nfs/dbraw/zinc/20/35/13/1410203513.db2.gz QEQBYDQSRSLZNK-UHFFFAOYSA-N 2 1 376.545 3.002 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000092821370 1410204434 /nfs/dbraw/zinc/20/44/34/1410204434.db2.gz CAKZBNQYYXQGQK-JOCHJYFZSA-N 2 1 378.520 3.425 20 0 GGADMP C[N@H+](CCN1CC[NH+](CC2=Cc3ccccc3OC2)CC1)Cc1ccccc1 ZINC000093104950 1410222537 /nfs/dbraw/zinc/22/25/37/1410222537.db2.gz HODTZOJJQGWJAB-UHFFFAOYSA-N 2 1 377.532 3.212 20 0 GGADMP C[N@@H+](CCN1CC[NH+](CC2=Cc3ccccc3OC2)CC1)Cc1ccccc1 ZINC000093104950 1410222549 /nfs/dbraw/zinc/22/25/49/1410222549.db2.gz HODTZOJJQGWJAB-UHFFFAOYSA-N 2 1 377.532 3.212 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(Oc4cccnc4)c(C)c3)C2)CC1 ZINC000093133106 1410223179 /nfs/dbraw/zinc/22/31/79/1410223179.db2.gz FDWYTKLUZCJUDR-OAQYLSRUSA-N 2 1 380.536 3.394 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(OC)c(OCCC(C)C)c3)C2)CC1 ZINC000093133101 1410223294 /nfs/dbraw/zinc/22/32/94/1410223294.db2.gz DQCNUHFRKMLVLG-NRFANRHFSA-N 2 1 389.584 3.332 20 0 GGADMP c1cc(OCC[NH+]2CCCC2)ccc1C[N@H+]1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000093134538 1410224826 /nfs/dbraw/zinc/22/48/26/1410224826.db2.gz SMMRMQFDCLIRQJ-FQEVSTJZSA-N 2 1 395.551 3.079 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc4c(c3)CC(C)(C)O4)CC2)CC1 ZINC000093141640 1410226518 /nfs/dbraw/zinc/22/65/18/1410226518.db2.gz FHXWSQMBRIHMFD-UHFFFAOYSA-N 2 1 399.579 3.166 20 0 GGADMP C[NH+](C)CCOc1ccc(C[N@H+]2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1 ZINC000093281038 1410230160 /nfs/dbraw/zinc/23/01/60/1410230160.db2.gz UXORWSCXYIHZOH-LJQANCHMSA-N 2 1 375.557 3.001 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+](CCc3ccccc3)C3CCCC3)cn2)CC1 ZINC000093285460 1410231161 /nfs/dbraw/zinc/23/11/61/1410231161.db2.gz MXGVXGYXVODSDH-UHFFFAOYSA-N 2 1 379.552 3.216 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+](CCc3ccccc3)C3CCCC3)cn2)CC1 ZINC000093285460 1410231167 /nfs/dbraw/zinc/23/11/67/1410231167.db2.gz MXGVXGYXVODSDH-UHFFFAOYSA-N 2 1 379.552 3.216 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000093564156 1410253720 /nfs/dbraw/zinc/25/37/20/1410253720.db2.gz MYYYUMUTWYZWNK-LJQANCHMSA-N 2 1 382.508 3.298 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000093564156 1410253724 /nfs/dbraw/zinc/25/37/24/1410253724.db2.gz MYYYUMUTWYZWNK-LJQANCHMSA-N 2 1 382.508 3.298 20 0 GGADMP COc1cccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1OC(F)F ZINC000093735029 1410261596 /nfs/dbraw/zinc/26/15/96/1410261596.db2.gz FARIHHYBJCWMFY-UHFFFAOYSA-N 2 1 384.467 3.373 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cccc3c2OCCCO3)CC1 ZINC000093769389 1410265816 /nfs/dbraw/zinc/26/58/16/1410265816.db2.gz ZLSFYKQJXFLSMU-UHFFFAOYSA-N 2 1 376.541 3.418 20 0 GGADMP CN(c1ccccc1C[N@H+]1CC[C@@H](Cc2cnn(C)c2)C1)C1CC[NH+](C)CC1 ZINC000093870322 1410276246 /nfs/dbraw/zinc/27/62/46/1410276246.db2.gz KIPSTPGAKLBXGV-IBGZPJMESA-N 2 1 381.568 3.015 20 0 GGADMP Cn1cc(C[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c(-c2cccs2)n1 ZINC000093948123 1410289233 /nfs/dbraw/zinc/28/92/33/1410289233.db2.gz KXLAUAHLNKJMSU-UHFFFAOYSA-N 2 1 395.576 3.186 20 0 GGADMP C[NH+]1CCN(CCCN2CC[N@H+](C)CC23CCCCC3)C2(CCCCC2)C1 ZINC000095964082 1410317630 /nfs/dbraw/zinc/31/76/30/1410317630.db2.gz GFZDNFOWCGOGTG-UHFFFAOYSA-N 2 1 376.633 3.277 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(Cc2ccco2)C2CC[NH+](C)CC2)C1 ZINC000097257190 1410361157 /nfs/dbraw/zinc/36/11/57/1410361157.db2.gz ULSWTHAHDZLNBG-GOSISDBHSA-N 2 1 390.572 3.396 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCC[N@H+](C)C1CCCCC1)[NH+](C)C ZINC000097357685 1410366065 /nfs/dbraw/zinc/36/60/65/1410366065.db2.gz GMLUJFMODUAKQH-FQEVSTJZSA-N 2 1 390.572 3.252 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCC[N@@H+](C)C1CCCCC1)[NH+](C)C ZINC000097357685 1410366069 /nfs/dbraw/zinc/36/60/69/1410366069.db2.gz GMLUJFMODUAKQH-FQEVSTJZSA-N 2 1 390.572 3.252 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000098030334 1410397663 /nfs/dbraw/zinc/39/76/63/1410397663.db2.gz CTBOBKKOLOMHEL-ZWKOTPCHSA-N 2 1 376.545 3.006 20 0 GGADMP C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000098034293 1410398955 /nfs/dbraw/zinc/39/89/55/1410398955.db2.gz CLRYFYIOGGPCOF-CEXWTWQISA-N 2 1 390.572 3.252 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000098173241 1410436277 /nfs/dbraw/zinc/43/62/77/1410436277.db2.gz XAOJRNHQNXUBIO-GJZGRUSLSA-N 2 1 382.346 3.488 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000098173240 1410436432 /nfs/dbraw/zinc/43/64/32/1410436432.db2.gz XAOJRNHQNXUBIO-LSDHHAIUSA-N 2 1 382.346 3.488 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@H+](CCCc2ccccc2)CC1)c1ccco1 ZINC000101770777 1410500958 /nfs/dbraw/zinc/50/09/58/1410500958.db2.gz FOGAEWKTOCNJPV-NRFANRHFSA-N 2 1 398.551 3.232 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1)c1ccco1 ZINC000101770777 1410500963 /nfs/dbraw/zinc/50/09/63/1410500963.db2.gz FOGAEWKTOCNJPV-NRFANRHFSA-N 2 1 398.551 3.232 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1ccc(-c2ccco2)nc1C ZINC000101868554 1410510991 /nfs/dbraw/zinc/51/09/91/1410510991.db2.gz XPNSHVPRFMEEGC-GOSISDBHSA-N 2 1 384.524 3.138 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000101993436 1410539039 /nfs/dbraw/zinc/53/90/39/1410539039.db2.gz ULYCVFDFVRIYBO-QRVBRYPASA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000101993436 1410539053 /nfs/dbraw/zinc/53/90/53/1410539053.db2.gz ULYCVFDFVRIYBO-QRVBRYPASA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000101993436 1410539057 /nfs/dbraw/zinc/53/90/57/1410539057.db2.gz ULYCVFDFVRIYBO-QRVBRYPASA-N 2 1 392.613 3.380 20 0 GGADMP C[NH+]1CCC(CCNC(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000102640334 1410681431 /nfs/dbraw/zinc/68/14/31/1410681431.db2.gz ISBWVBRXMHDICL-HXUWFJFHSA-N 2 1 397.485 3.289 20 0 GGADMP COc1ccc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)cc1 ZINC000102781533 1410751616 /nfs/dbraw/zinc/75/16/16/1410751616.db2.gz FJGQUODPEAPIQV-UHFFFAOYSA-N 2 1 384.520 3.475 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)c(F)c1 ZINC000102917901 1410808215 /nfs/dbraw/zinc/80/82/15/1410808215.db2.gz VIHQXRLWNDTILX-UHFFFAOYSA-N 2 1 387.503 3.280 20 0 GGADMP C[NH+](C)CCCOc1ccc(CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000103125606 1410829793 /nfs/dbraw/zinc/82/97/93/1410829793.db2.gz WURGMSJADLZVDF-HSZRJFAPSA-N 2 1 395.547 3.298 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCc2nc3ccccc3c(=O)[nH]2)CC1 ZINC000103142852 1410831378 /nfs/dbraw/zinc/83/13/78/1410831378.db2.gz UXZIXNXVBNLFED-UHFFFAOYSA-N 2 1 390.531 3.310 20 0 GGADMP Cc1cccn2c(=O)cc(C[NH+]3CCC(C[N@H+](C)Cc4ccccc4)CC3)nc12 ZINC000103143170 1410831410 /nfs/dbraw/zinc/83/14/10/1410831410.db2.gz NSWCKRZRONHMHC-UHFFFAOYSA-N 2 1 390.531 3.347 20 0 GGADMP COc1cc(CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc(OC)c1OC ZINC000103173893 1410834210 /nfs/dbraw/zinc/83/42/10/1410834210.db2.gz PNYXPVXPKVYOSC-IBGZPJMESA-N 2 1 384.520 3.367 20 0 GGADMP COc1cc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc(OC)c1OC ZINC000103173893 1410834213 /nfs/dbraw/zinc/83/42/13/1410834213.db2.gz PNYXPVXPKVYOSC-IBGZPJMESA-N 2 1 384.520 3.367 20 0 GGADMP COc1cc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc(OC)c1OC ZINC000103173893 1410834215 /nfs/dbraw/zinc/83/42/15/1410834215.db2.gz PNYXPVXPKVYOSC-IBGZPJMESA-N 2 1 384.520 3.367 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)NCCC2CC[NH+](C)CC2)C1 ZINC000103303369 1410844579 /nfs/dbraw/zinc/84/45/79/1410844579.db2.gz BCMPZAUDNFKIBC-IBGZPJMESA-N 2 1 386.584 3.450 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000103312830 1410846347 /nfs/dbraw/zinc/84/63/47/1410846347.db2.gz ACUMWFCIWCCOOZ-NRFANRHFSA-N 2 1 386.584 3.115 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)c(F)c1 ZINC000104409699 1410894904 /nfs/dbraw/zinc/89/49/04/1410894904.db2.gz MKSZODSLNWKWHG-HXUWFJFHSA-N 2 1 376.520 3.169 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1)C1CCCC1 ZINC000104793637 1410964218 /nfs/dbraw/zinc/96/42/18/1410964218.db2.gz XTZRTTIRCWCEBI-QGZVFWFLSA-N 2 1 378.586 3.134 20 0 GGADMP C[NH+](CCNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1)C1CCCC1 ZINC000104793637 1410964227 /nfs/dbraw/zinc/96/42/27/1410964227.db2.gz XTZRTTIRCWCEBI-QGZVFWFLSA-N 2 1 378.586 3.134 20 0 GGADMP C[NH+](CCNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCCC1 ZINC000104793637 1410964240 /nfs/dbraw/zinc/96/42/40/1410964240.db2.gz XTZRTTIRCWCEBI-QGZVFWFLSA-N 2 1 378.586 3.134 20 0 GGADMP CC[N@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000105093653 1411027164 /nfs/dbraw/zinc/02/71/64/1411027164.db2.gz MCLARAFISPIOII-SFHVURJKSA-N 2 1 392.975 3.336 20 0 GGADMP CC[N@H+]1CCC[C@H](CNC(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000105112908 1411029733 /nfs/dbraw/zinc/02/97/33/1411029733.db2.gz CELVBEMRYTXMPT-HXUWFJFHSA-N 2 1 386.584 3.450 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)CC1 ZINC000105112547 1411030161 /nfs/dbraw/zinc/03/01/61/1411030161.db2.gz BQSNXTVQDJFQAP-FQEVSTJZSA-N 2 1 386.584 3.379 20 0 GGADMP C[C@H](NC(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1)c1ccc(OC(F)F)cc1 ZINC000105131814 1411032922 /nfs/dbraw/zinc/03/29/22/1411032922.db2.gz ZBUMRNXIEZQNSE-HNNXBMFYSA-N 2 1 398.498 3.016 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@H]1C[NH+]1CCCCC1)[N@@H+]1CCc2sccc2C1 ZINC000105150403 1411035361 /nfs/dbraw/zinc/03/53/61/1411035361.db2.gz UYXCDRFBKQZAKG-MJGOQNOKSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@H]1C[NH+]1CCCCC1)[N@H+]1CCc2sccc2C1 ZINC000105150403 1411035371 /nfs/dbraw/zinc/03/53/71/1411035371.db2.gz UYXCDRFBKQZAKG-MJGOQNOKSA-N 2 1 390.597 3.155 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000105161560 1411036539 /nfs/dbraw/zinc/03/65/39/1411036539.db2.gz ZCHZMDQVXVLAMB-IBGZPJMESA-N 2 1 390.547 3.210 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000105161556 1411036602 /nfs/dbraw/zinc/03/66/02/1411036602.db2.gz ZCHZMDQVXVLAMB-LJQANCHMSA-N 2 1 390.547 3.210 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C(C)C)[NH+]2CCCC2)cc1F ZINC000105190198 1411040214 /nfs/dbraw/zinc/04/02/14/1411040214.db2.gz FOBMYMLYEOQVPL-HXUWFJFHSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H]2CCC[N@@H+](C(C)C)C2)cc1F ZINC000105190134 1411040291 /nfs/dbraw/zinc/04/02/91/1411040291.db2.gz UNGSTUOLDZYBDR-SFHVURJKSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1F ZINC000105190134 1411040299 /nfs/dbraw/zinc/04/02/99/1411040299.db2.gz UNGSTUOLDZYBDR-SFHVURJKSA-N 2 1 387.503 3.239 20 0 GGADMP CC(C)[N@@H+]1CCC[C@H](CNC(=O)N2CCC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000105275848 1411048944 /nfs/dbraw/zinc/04/89/44/1411048944.db2.gz RMOOQMDJHBBABF-HXUWFJFHSA-N 2 1 390.547 3.163 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000105275848 1411048952 /nfs/dbraw/zinc/04/89/52/1411048952.db2.gz RMOOQMDJHBBABF-HXUWFJFHSA-N 2 1 390.547 3.163 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)C1 ZINC000105275848 1411048961 /nfs/dbraw/zinc/04/89/61/1411048961.db2.gz RMOOQMDJHBBABF-HXUWFJFHSA-N 2 1 390.547 3.163 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)C1 ZINC000105275848 1411048971 /nfs/dbraw/zinc/04/89/71/1411048971.db2.gz RMOOQMDJHBBABF-HXUWFJFHSA-N 2 1 390.547 3.163 20 0 GGADMP CCOc1cc2[nH+]ccc(NC[C@@H](C)[NH+]3CCN(CC)CC3)c2cc1OCC ZINC000105340577 1411055984 /nfs/dbraw/zinc/05/59/84/1411055984.db2.gz ZFAMAXRZMYHEDS-QGZVFWFLSA-N 2 1 386.540 3.470 20 0 GGADMP CCOc1cc(C[NH2+]CC2CCN(CC[NH+](C)C)CC2)cc(Cl)c1OC ZINC000105451669 1411067694 /nfs/dbraw/zinc/06/76/94/1411067694.db2.gz UGIDAZQDTRFXLC-UHFFFAOYSA-N 2 1 383.964 3.111 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000176994817 1428545299 /nfs/dbraw/zinc/54/52/99/1428545299.db2.gz ZFWBRQYGWPIVMV-MOPGFXCFSA-N 2 1 388.556 3.275 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000176994817 1428545311 /nfs/dbraw/zinc/54/53/11/1428545311.db2.gz ZFWBRQYGWPIVMV-MOPGFXCFSA-N 2 1 388.556 3.275 20 0 GGADMP O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000106537796 1411238049 /nfs/dbraw/zinc/23/80/49/1411238049.db2.gz DWXHPOKZZARLDM-FQEVSTJZSA-N 2 1 388.531 3.106 20 0 GGADMP CC[C@@H](CNC(=O)NCCC[NH2+]C1CCCCC1)[N@H+]1CCc2ccccc2C1 ZINC000107834162 1411416986 /nfs/dbraw/zinc/41/69/86/1411416986.db2.gz KZQCUAKIOOWRTO-QFIPXVFZSA-N 2 1 386.584 3.435 20 0 GGADMP O=C(N[C@@H]1CC[NH+](CC2CC2)C1)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000108302668 1411468493 /nfs/dbraw/zinc/46/84/93/1411468493.db2.gz CPMAPMUGXHZWPX-UYAOXDASSA-N 2 1 395.469 3.042 20 0 GGADMP O=C(N[C@@H]1CC[N@H+](CC2CC2)C1)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1 ZINC000108302668 1411468502 /nfs/dbraw/zinc/46/85/02/1411468502.db2.gz CPMAPMUGXHZWPX-UYAOXDASSA-N 2 1 395.469 3.042 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1 ZINC000108302668 1411468511 /nfs/dbraw/zinc/46/85/11/1411468511.db2.gz CPMAPMUGXHZWPX-UYAOXDASSA-N 2 1 395.469 3.042 20 0 GGADMP C[NH+](C)Cc1c2ccccc2oc1C(=O)NCC[N@@H+](C)Cc1ccc(F)cc1 ZINC000177052299 1428569849 /nfs/dbraw/zinc/56/98/49/1428569849.db2.gz OVYKSTYOTOPRKD-UHFFFAOYSA-N 2 1 383.467 3.495 20 0 GGADMP CCCO[C@@H]1CCC[N@H+]([C@@H](C)C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC000108394137 1411487676 /nfs/dbraw/zinc/48/76/76/1411487676.db2.gz LTLDMESHNFFYRH-KSEOMHKRSA-N 2 1 387.568 3.047 20 0 GGADMP CCCO[C@@H]1CCC[NH+]([C@@H](C)C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000108394137 1411487681 /nfs/dbraw/zinc/48/76/81/1411487681.db2.gz LTLDMESHNFFYRH-KSEOMHKRSA-N 2 1 387.568 3.047 20 0 GGADMP CCCO[C@@H]1CCC[NH+]([C@@H](C)C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000108394137 1411487686 /nfs/dbraw/zinc/48/76/86/1411487686.db2.gz LTLDMESHNFFYRH-KSEOMHKRSA-N 2 1 387.568 3.047 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cccc4cccnc43)c2)C1 ZINC000108420958 1411495146 /nfs/dbraw/zinc/49/51/46/1411495146.db2.gz PPNZRYVODLVIKN-JOCHJYFZSA-N 2 1 388.515 3.222 20 0 GGADMP CCCOc1cccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000108420688 1411495573 /nfs/dbraw/zinc/49/55/73/1411495573.db2.gz OHVXMUTZMFGNPY-QFIPXVFZSA-N 2 1 395.547 3.463 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc4ncccc4c3)c2)C1 ZINC000108420845 1411495672 /nfs/dbraw/zinc/49/56/72/1411495672.db2.gz MIBYQGOJBOCFRC-JOCHJYFZSA-N 2 1 388.515 3.222 20 0 GGADMP CCOc1cccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000108421049 1411497464 /nfs/dbraw/zinc/49/74/64/1411497464.db2.gz OJVFOOVUPWQKGS-OAQYLSRUSA-N 2 1 381.520 3.072 20 0 GGADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000108429116 1411498092 /nfs/dbraw/zinc/49/80/92/1411498092.db2.gz VVKJTOSQMNGQFH-HXUWFJFHSA-N 2 1 375.520 3.425 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(Cl)c(F)c3)c2)C1 ZINC000108421070 1411498177 /nfs/dbraw/zinc/49/81/77/1411498177.db2.gz VLXXJTNUVMEAHI-GOSISDBHSA-N 2 1 389.902 3.466 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)NC[C@@H]2CCC[N@@H+](C)C2)c2cccs2)CC1 ZINC000108541053 1411533577 /nfs/dbraw/zinc/53/35/77/1411533577.db2.gz UYVUXMLQNIJLIP-ZWKOTPCHSA-N 2 1 378.586 3.162 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CCC[N@@H+](C)C2)C1 ZINC000108551671 1411537284 /nfs/dbraw/zinc/53/72/84/1411537284.db2.gz XDFKEFGJDTUSDQ-AQNXPRMDSA-N 2 1 386.584 3.306 20 0 GGADMP CCCC[N@@H+]1CCCC[C@H]1CNC(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000108883947 1411630305 /nfs/dbraw/zinc/63/03/05/1411630305.db2.gz QXHQOULYYLOVPY-IBGZPJMESA-N 2 1 384.528 3.030 20 0 GGADMP CCCC[N@H+]1CCCC[C@H]1CNC(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000108883947 1411630321 /nfs/dbraw/zinc/63/03/21/1411630321.db2.gz QXHQOULYYLOVPY-IBGZPJMESA-N 2 1 384.528 3.030 20 0 GGADMP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000108883945 1411630996 /nfs/dbraw/zinc/63/09/96/1411630996.db2.gz QXHQOULYYLOVPY-LJQANCHMSA-N 2 1 384.528 3.030 20 0 GGADMP CCCC[N@H+]1CCCC[C@@H]1CNC(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000108883945 1411631003 /nfs/dbraw/zinc/63/10/03/1411631003.db2.gz QXHQOULYYLOVPY-LJQANCHMSA-N 2 1 384.528 3.030 20 0 GGADMP COc1cccc([C@@H](CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)[NH+](C)C)c1 ZINC000108930327 1411641989 /nfs/dbraw/zinc/64/19/89/1411641989.db2.gz JZIAUWWPMDYUFU-FGZHOGPDSA-N 2 1 381.520 3.079 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC3CC[NH+](C(C)(C)C)CC3)CC2)cs1 ZINC000109258635 1411727822 /nfs/dbraw/zinc/72/78/22/1411727822.db2.gz HLRCZZWIZOTBCB-UHFFFAOYSA-N 2 1 378.586 3.043 20 0 GGADMP C[C@H](CNC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCC(C)CC1 ZINC000109301412 1411735783 /nfs/dbraw/zinc/73/57/83/1411735783.db2.gz QXWPHKLWCUZCEH-AQNXPRMDSA-N 2 1 387.568 3.146 20 0 GGADMP C[C@H](CNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCC(C)CC1 ZINC000109301412 1411735788 /nfs/dbraw/zinc/73/57/88/1411735788.db2.gz QXWPHKLWCUZCEH-AQNXPRMDSA-N 2 1 387.568 3.146 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCC(C)CC1 ZINC000109301409 1411736300 /nfs/dbraw/zinc/73/63/00/1411736300.db2.gz QXWPHKLWCUZCEH-SLFFLAALSA-N 2 1 387.568 3.146 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCC(C)CC1 ZINC000109301409 1411736303 /nfs/dbraw/zinc/73/63/03/1411736303.db2.gz QXWPHKLWCUZCEH-SLFFLAALSA-N 2 1 387.568 3.146 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@H+](C)C2CC[NH+](CCC)CC2)c(OC)c1 ZINC000109787856 1411810144 /nfs/dbraw/zinc/81/01/44/1411810144.db2.gz VDBUEFXHNZNCJK-ZEZYUPADSA-N 2 1 376.541 3.274 20 0 GGADMP C/C=C/c1ccc(OC[C@@H](O)C[N@H+](C)C2CC[NH+](CCC)CC2)c(OC)c1 ZINC000109787854 1411810384 /nfs/dbraw/zinc/81/03/84/1411810384.db2.gz VDBUEFXHNZNCJK-CYXJOQHWSA-N 2 1 376.541 3.274 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000110427921 1411850350 /nfs/dbraw/zinc/85/03/50/1411850350.db2.gz OBVDZTFTIBZNRM-ZCNNSNEGSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000110427921 1411850351 /nfs/dbraw/zinc/85/03/51/1411850351.db2.gz OBVDZTFTIBZNRM-ZCNNSNEGSA-N 2 1 387.568 3.452 20 0 GGADMP CCC[NH+]1CCC(NC(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000110480829 1411852236 /nfs/dbraw/zinc/85/22/36/1411852236.db2.gz UJIIZNDEWJGHLX-HXUWFJFHSA-N 2 1 397.485 3.432 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)NCCOc2ccccc2)CC1 ZINC000110910355 1411876625 /nfs/dbraw/zinc/87/66/25/1411876625.db2.gz GFFFULJLRCOCNU-UHFFFAOYSA-N 2 1 395.547 3.026 20 0 GGADMP O=C(NCC1([NH+]2CCCCC2)CCOCC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000111102338 1411887299 /nfs/dbraw/zinc/88/72/99/1411887299.db2.gz MHLXDHPEVCKROU-JOCHJYFZSA-N 2 1 399.579 3.050 20 0 GGADMP Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]CCCC[N@H+]1CCC[C@@H]1CO ZINC000111386694 1411938116 /nfs/dbraw/zinc/93/81/16/1411938116.db2.gz KONIHAWTEJJORD-GOSISDBHSA-N 2 1 392.494 3.094 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3c[nH]nc3-c3cccnc3)CC2)cs1 ZINC000111397586 1411941806 /nfs/dbraw/zinc/94/18/06/1411941806.db2.gz JUFCCHYACKZQFM-UHFFFAOYSA-N 2 1 396.564 3.492 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc(-n4cccn4)cc3)CC2)oc1C ZINC000111412302 1411945885 /nfs/dbraw/zinc/94/58/85/1411945885.db2.gz OOPDYPZHKJUULA-UHFFFAOYSA-N 2 1 379.508 3.479 20 0 GGADMP CC[N@@H+]1CCCC[C@@H]1CNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000111460808 1411967226 /nfs/dbraw/zinc/96/72/26/1411967226.db2.gz BFTPTUDDCHKPJU-GOSISDBHSA-N 2 1 394.510 3.103 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1CNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000111460808 1411967247 /nfs/dbraw/zinc/96/72/47/1411967247.db2.gz BFTPTUDDCHKPJU-GOSISDBHSA-N 2 1 394.510 3.103 20 0 GGADMP C[C@@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[N@@H+]1CCc2ccccc2C1 ZINC000111562572 1411991687 /nfs/dbraw/zinc/99/16/87/1411991687.db2.gz VLUPWTJBZXWXOK-IBGZPJMESA-N 2 1 377.532 3.345 20 0 GGADMP C[C@@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[N@H+]1CCc2ccccc2C1 ZINC000111562572 1411991690 /nfs/dbraw/zinc/99/16/90/1411991690.db2.gz VLUPWTJBZXWXOK-IBGZPJMESA-N 2 1 377.532 3.345 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(OCCC[NH+](C)C)cc1)[N@@H+]1CCc2ccccc2C1 ZINC000111607500 1412000609 /nfs/dbraw/zinc/00/06/09/1412000609.db2.gz SBUWNHQVBNMQLM-IBGZPJMESA-N 2 1 395.547 3.080 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(OCCC[NH+](C)C)cc1)[N@H+]1CCc2ccccc2C1 ZINC000111607500 1412000614 /nfs/dbraw/zinc/00/06/14/1412000614.db2.gz SBUWNHQVBNMQLM-IBGZPJMESA-N 2 1 395.547 3.080 20 0 GGADMP C[N@@H+](CCC(=O)Nc1cc(N)ccc1F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000177174393 1428614108 /nfs/dbraw/zinc/61/41/08/1428614108.db2.gz KSHXVXRTMODTAR-SFHVURJKSA-N 2 1 384.499 3.190 20 0 GGADMP C[NH+](CCC(=O)Nc1cc(N)ccc1F)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000177174393 1428614112 /nfs/dbraw/zinc/61/41/12/1428614112.db2.gz KSHXVXRTMODTAR-SFHVURJKSA-N 2 1 384.499 3.190 20 0 GGADMP C[NH+](CCC(=O)Nc1cc(N)ccc1F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000177174393 1428614120 /nfs/dbraw/zinc/61/41/20/1428614120.db2.gz KSHXVXRTMODTAR-SFHVURJKSA-N 2 1 384.499 3.190 20 0 GGADMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N(CC[NH+](C)C)Cc2ccccn2)C1 ZINC000111881254 1412043428 /nfs/dbraw/zinc/04/34/28/1412043428.db2.gz PXQKPTPYWOCKKA-IBGZPJMESA-N 2 1 389.588 3.055 20 0 GGADMP CCOc1cc2[nH+]ccc(N3CC[C@@H](N4CC[NH+](CC)CC4)C3)c2cc1OCC ZINC000112333124 1412132524 /nfs/dbraw/zinc/13/25/24/1412132524.db2.gz LOGIWWKMPGGQMM-GOSISDBHSA-N 2 1 398.551 3.248 20 0 GGADMP C[C@H](CCc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000112545877 1412166677 /nfs/dbraw/zinc/16/66/77/1412166677.db2.gz MOFNDJJVNAJHTB-XXBNENTESA-N 2 1 379.548 3.495 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCCCC1)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000112743980 1412208985 /nfs/dbraw/zinc/20/89/85/1412208985.db2.gz NDGQXAXBYGPZCT-LJQANCHMSA-N 2 1 384.568 3.346 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)[C@H](c2ccccc2)[NH+](C)C)CCOCC1)c1ccccc1 ZINC000113236231 1412280707 /nfs/dbraw/zinc/28/07/07/1412280707.db2.gz CPBXMWXIWMQHTN-UGKGYDQZSA-N 2 1 395.547 3.306 20 0 GGADMP CC(=O)N(c1nc(C[NH2+]CC2CC[NH+](C)CC2)cs1)c1ccc(F)cc1 ZINC000113336336 1412294308 /nfs/dbraw/zinc/29/43/08/1412294308.db2.gz WAXYCZCKTKPPCP-UHFFFAOYSA-N 2 1 376.501 3.398 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc(N2CC[NH+](C)CC2)cc1C ZINC000113364835 1412299325 /nfs/dbraw/zinc/29/93/25/1412299325.db2.gz GFORLYKMEKETON-IBGZPJMESA-N 2 1 387.572 3.133 20 0 GGADMP Cc1ccc([C@H](OC[C@@H](O)C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c2ccccc2)cc1 ZINC000113515348 1412310910 /nfs/dbraw/zinc/31/09/10/1412310910.db2.gz WIFRYPABMYXVDI-FGCOXFRFSA-N 2 1 382.548 3.345 20 0 GGADMP CN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000113578608 1412318021 /nfs/dbraw/zinc/31/80/21/1412318021.db2.gz PJXKMOKYXBHHAC-FQEVSTJZSA-N 2 1 384.524 3.188 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000114024692 1412370294 /nfs/dbraw/zinc/37/02/94/1412370294.db2.gz STIVACJWAFIEDN-WSTZPKSXSA-N 2 1 375.561 3.124 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000114024692 1412370300 /nfs/dbraw/zinc/37/03/00/1412370300.db2.gz STIVACJWAFIEDN-WSTZPKSXSA-N 2 1 375.561 3.124 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cc(OC)ccc2OC)CC1 ZINC000114197103 1412392772 /nfs/dbraw/zinc/39/27/72/1412392772.db2.gz BESNZNKDXIFJDB-KRWDZBQOSA-N 2 1 391.556 3.475 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cc(OC)ccc2OC)CC1 ZINC000114197103 1412392781 /nfs/dbraw/zinc/39/27/81/1412392781.db2.gz BESNZNKDXIFJDB-KRWDZBQOSA-N 2 1 391.556 3.475 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000114424884 1412431983 /nfs/dbraw/zinc/43/19/83/1412431983.db2.gz AIEIMSXTDBDDQP-SFHVURJKSA-N 2 1 394.441 3.381 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000114424884 1412431992 /nfs/dbraw/zinc/43/19/92/1412431992.db2.gz AIEIMSXTDBDDQP-SFHVURJKSA-N 2 1 394.441 3.381 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)[NH+](C)C1CC1 ZINC000114595836 1412470715 /nfs/dbraw/zinc/47/07/15/1412470715.db2.gz RORHDVDAQQQLHH-PBHICJAKSA-N 2 1 398.473 3.062 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1)[N@H+](C)C1CC1 ZINC000114595836 1412470722 /nfs/dbraw/zinc/47/07/22/1412470722.db2.gz RORHDVDAQQQLHH-PBHICJAKSA-N 2 1 398.473 3.062 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1)[N@@H+](C)C1CC1 ZINC000114595836 1412470729 /nfs/dbraw/zinc/47/07/29/1412470729.db2.gz RORHDVDAQQQLHH-PBHICJAKSA-N 2 1 398.473 3.062 20 0 GGADMP C[C@@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)[NH+](C)C1CC1 ZINC000114595835 1412470835 /nfs/dbraw/zinc/47/08/35/1412470835.db2.gz RORHDVDAQQQLHH-YOEHRIQHSA-N 2 1 398.473 3.062 20 0 GGADMP C[C@@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1)[N@H+](C)C1CC1 ZINC000114595835 1412470839 /nfs/dbraw/zinc/47/08/39/1412470839.db2.gz RORHDVDAQQQLHH-YOEHRIQHSA-N 2 1 398.473 3.062 20 0 GGADMP C[C@@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1)[N@@H+](C)C1CC1 ZINC000114595835 1412470840 /nfs/dbraw/zinc/47/08/40/1412470840.db2.gz RORHDVDAQQQLHH-YOEHRIQHSA-N 2 1 398.473 3.062 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)C1 ZINC000114604128 1412473122 /nfs/dbraw/zinc/47/31/22/1412473122.db2.gz WPLNQHBZOHTOFG-ZWKOTPCHSA-N 2 1 398.473 3.015 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000114781907 1412522859 /nfs/dbraw/zinc/52/28/59/1412522859.db2.gz PTZPUIREIMEVLH-JOCHJYFZSA-N 2 1 380.536 3.212 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177269310 1428663925 /nfs/dbraw/zinc/66/39/25/1428663925.db2.gz FOBRIUKVHAQDMI-KRWDZBQOSA-N 2 1 393.597 3.242 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1)c1cccc(OC)c1 ZINC000115790478 1412789487 /nfs/dbraw/zinc/78/94/87/1412789487.db2.gz KJAJVPCMJUDMAU-GHTZIAJQSA-N 2 1 390.572 3.061 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c2ccccc2)CC1 ZINC000115806811 1412794536 /nfs/dbraw/zinc/79/45/36/1412794536.db2.gz PEIYDXJBFUYBPF-RBBKRZOGSA-N 2 1 386.584 3.443 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c2ccccc2)CC1 ZINC000115806808 1412794654 /nfs/dbraw/zinc/79/46/54/1412794654.db2.gz PEIYDXJBFUYBPF-UNMCSNQZSA-N 2 1 386.584 3.443 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2c(c1)C(=O)CCC2 ZINC000177299128 1428677372 /nfs/dbraw/zinc/67/73/72/1428677372.db2.gz CQHUNFAEQWMAFF-LJQANCHMSA-N 2 1 386.540 3.085 20 0 GGADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccccc2OCC(=O)N(C)C)CC1 ZINC000116368230 1412852894 /nfs/dbraw/zinc/85/28/94/1412852894.db2.gz WGMCEUGDJBLUBP-IBGZPJMESA-N 2 1 395.547 3.469 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)cc1F ZINC000116424468 1412858443 /nfs/dbraw/zinc/85/84/43/1412858443.db2.gz NOSNISPOKGUKOB-LJQANCHMSA-N 2 1 389.519 3.485 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)cc1 ZINC000116440903 1412861022 /nfs/dbraw/zinc/86/10/22/1412861022.db2.gz NUWHAOOFAJQMGH-NRFANRHFSA-N 2 1 383.511 3.416 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)[C@@H]2CCC[NH+](Cc3cccnc3)C2)C1 ZINC000116449626 1412861950 /nfs/dbraw/zinc/86/19/50/1412861950.db2.gz JJJQJQDLCBJYLX-SVFBPWRDSA-N 2 1 386.584 3.166 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)[C@@H]2CCC[N@H+](Cc3cccnc3)C2)C1 ZINC000116449626 1412861954 /nfs/dbraw/zinc/86/19/54/1412861954.db2.gz JJJQJQDLCBJYLX-SVFBPWRDSA-N 2 1 386.584 3.166 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)C1 ZINC000116449626 1412861956 /nfs/dbraw/zinc/86/19/56/1412861956.db2.gz JJJQJQDLCBJYLX-SVFBPWRDSA-N 2 1 386.584 3.166 20 0 GGADMP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC1 ZINC000116521048 1412871562 /nfs/dbraw/zinc/87/15/62/1412871562.db2.gz IQNZBWIIQVJCFW-PXNSSMCTSA-N 2 1 384.524 3.407 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000116535877 1412873843 /nfs/dbraw/zinc/87/38/43/1412873843.db2.gz NVYPSRFKXOTYGO-GOSISDBHSA-N 2 1 375.582 3.230 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000116540944 1412874497 /nfs/dbraw/zinc/87/44/97/1412874497.db2.gz SHJWLEYXBKTLNV-ROUUACIJSA-N 2 1 383.540 3.352 20 0 GGADMP C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000116576118 1412880431 /nfs/dbraw/zinc/88/04/31/1412880431.db2.gz VVRQHAHUARLWCH-CEXWTWQISA-N 2 1 389.609 3.332 20 0 GGADMP COc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000177318297 1428685805 /nfs/dbraw/zinc/68/58/05/1428685805.db2.gz ZISMVNXFCKHMOM-UTKZUKDTSA-N 2 1 381.520 3.243 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)[NH+]1CCC(C)CC1 ZINC000118029502 1413098787 /nfs/dbraw/zinc/09/87/87/1413098787.db2.gz GYSDQKNHVGYRFI-MOPGFXCFSA-N 2 1 388.556 3.322 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)C[NH+]1CCCCC1 ZINC000118029550 1413098906 /nfs/dbraw/zinc/09/89/06/1413098906.db2.gz AYWUPKFJLZRSSN-OALUTQOASA-N 2 1 388.556 3.323 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NCc2cccc(C[NH+](C)C)c2)cc1)[NH+]1CCOCC1 ZINC000118029155 1413098968 /nfs/dbraw/zinc/09/89/68/1413098968.db2.gz ZQJIDCQCPNJZRT-SFHVURJKSA-N 2 1 396.535 3.463 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NCC(C)(C)[NH+]2CCCCC2)cc1)[NH+]1CCOCC1 ZINC000118031388 1413099406 /nfs/dbraw/zinc/09/94/06/1413099406.db2.gz SRLBHKHOPNPKJQ-SFHVURJKSA-N 2 1 388.556 3.466 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCCC[NH+]2CCCCCC2)cc1)[NH+]1CCOCC1 ZINC000118032106 1413100392 /nfs/dbraw/zinc/10/03/92/1413100392.db2.gz GVJNGXIUZNHARX-LJQANCHMSA-N 2 1 388.556 3.467 20 0 GGADMP CN(CC[N@@H+](C)Cc1ccc(OCc2ccccn2)cc1)C1CC[NH+](C)CC1 ZINC000177376514 1428709903 /nfs/dbraw/zinc/70/99/03/1428709903.db2.gz TZBFGMMTCXOCSQ-UHFFFAOYSA-N 2 1 382.552 3.118 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118798827 1413222994 /nfs/dbraw/zinc/22/29/94/1413222994.db2.gz DGICAEGJGGALMS-GOSISDBHSA-N 2 1 376.545 3.213 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cccc(C(=O)Nc4ccccc4)c3)C2)CC1 ZINC000118834646 1413238188 /nfs/dbraw/zinc/23/81/88/1413238188.db2.gz XQMVFDPQOXZDMG-HSZRJFAPSA-N 2 1 392.547 3.151 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@H+](C)C[C@@H]3CCC[NH+](C)C3)cc(=O)oc2c1 ZINC000118841445 1413241384 /nfs/dbraw/zinc/24/13/84/1413241384.db2.gz SKMKXFVEFGJFJT-OAHLLOKOSA-N 2 1 387.480 3.135 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@@H+](C)C[C@@H]3CCC[NH+](C)C3)cc(=O)oc2c1 ZINC000118841445 1413241386 /nfs/dbraw/zinc/24/13/86/1413241386.db2.gz SKMKXFVEFGJFJT-OAHLLOKOSA-N 2 1 387.480 3.135 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[NH+](C)C[C@@H]3CCC[N@H+](C)C3)cc(=O)oc2c1 ZINC000118841445 1413241388 /nfs/dbraw/zinc/24/13/88/1413241388.db2.gz SKMKXFVEFGJFJT-OAHLLOKOSA-N 2 1 387.480 3.135 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[NH+](C)C[C@@H]3CCC[N@@H+](C)C3)cc(=O)oc2c1 ZINC000118841445 1413241392 /nfs/dbraw/zinc/24/13/92/1413241392.db2.gz SKMKXFVEFGJFJT-OAHLLOKOSA-N 2 1 387.480 3.135 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841296 1413241695 /nfs/dbraw/zinc/24/16/95/1413241695.db2.gz WVEDFAOCVIGKNZ-LJQANCHMSA-N 2 1 383.540 3.091 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000118841296 1413241702 /nfs/dbraw/zinc/24/17/02/1413241702.db2.gz WVEDFAOCVIGKNZ-LJQANCHMSA-N 2 1 383.540 3.091 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841296 1413241717 /nfs/dbraw/zinc/24/17/17/1413241717.db2.gz WVEDFAOCVIGKNZ-LJQANCHMSA-N 2 1 383.540 3.091 20 0 GGADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177397474 1428718170 /nfs/dbraw/zinc/71/81/70/1428718170.db2.gz XGLQEMJIGBEUCE-QGZVFWFLSA-N 2 1 393.597 3.385 20 0 GGADMP C[C@@H](NC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C[NH+](C)C ZINC000119424018 1413443063 /nfs/dbraw/zinc/44/30/63/1413443063.db2.gz KJQIWPJSARIZHE-SJORKVTESA-N 2 1 380.602 3.236 20 0 GGADMP C[C@@H]1CN(C(C)(C)C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000119501478 1413467980 /nfs/dbraw/zinc/46/79/80/1413467980.db2.gz JULXDKLXNNKEHG-KDURUIRLSA-N 2 1 391.575 3.310 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177424437 1428731183 /nfs/dbraw/zinc/73/11/83/1428731183.db2.gz GBLGARCDYMNDHZ-UHFFFAOYSA-N 2 1 390.597 3.203 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177424437 1428731188 /nfs/dbraw/zinc/73/11/88/1428731188.db2.gz GBLGARCDYMNDHZ-UHFFFAOYSA-N 2 1 390.597 3.203 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3c(C)nn(Cc4ccc(C)cc4)c3C)C2)CC1 ZINC000119591400 1413496586 /nfs/dbraw/zinc/49/65/86/1413496586.db2.gz PCERCJKLWRIXKC-QHCPKHFHSA-N 2 1 395.595 3.068 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3c(C)nn(Cc4ccc(C)cc4)c3C)C2)CC1 ZINC000119591250 1413496610 /nfs/dbraw/zinc/49/66/10/1413496610.db2.gz PCERCJKLWRIXKC-HSZRJFAPSA-N 2 1 395.595 3.068 20 0 GGADMP O=C(NC1CC[NH+](C2CCCCC2)CC1)[C@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000177429765 1428734025 /nfs/dbraw/zinc/73/40/25/1428734025.db2.gz YIYIKMMBFPIOFR-QHCPKHFHSA-N 2 1 399.579 3.098 20 0 GGADMP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(C[NH+]4CCOCC4)CC3)o2)cc1C ZINC000119857083 1413595641 /nfs/dbraw/zinc/59/56/41/1413595641.db2.gz CGTVTSPQJPAKCX-SFHVURJKSA-N 2 1 384.524 3.459 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NC3CC[NH+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000177448814 1428741596 /nfs/dbraw/zinc/74/15/96/1428741596.db2.gz TZBDGQLWJNZUHW-OALUTQOASA-N 2 1 399.579 3.433 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](Cc2cc(F)ccc2F)CC1 ZINC000120261507 1413757604 /nfs/dbraw/zinc/75/76/04/1413757604.db2.gz AADDMKBGAUVKTJ-UHFFFAOYSA-N 2 1 379.495 3.169 20 0 GGADMP Cc1c(C(=O)NC(C)(C)C[N@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000120370479 1413804311 /nfs/dbraw/zinc/80/43/11/1413804311.db2.gz DAYYSLJSJOCWKS-UHFFFAOYSA-N 2 1 377.492 3.216 20 0 GGADMP Cc1c(C(=O)NC(C)(C)C[N@@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000120370479 1413804313 /nfs/dbraw/zinc/80/43/13/1413804313.db2.gz DAYYSLJSJOCWKS-UHFFFAOYSA-N 2 1 377.492 3.216 20 0 GGADMP O[C@@H]1CC[N@@H+](Cc2ccccc2C[NH2+]C2CCN(CCc3ccccc3)CC2)C1 ZINC000120651592 1413866413 /nfs/dbraw/zinc/86/64/13/1413866413.db2.gz IQICZQLWHGKWDB-RUZDIDTESA-N 2 1 393.575 3.050 20 0 GGADMP O[C@@H]1CC[N@H+](Cc2ccccc2CNC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000120651592 1413866414 /nfs/dbraw/zinc/86/64/14/1413866414.db2.gz IQICZQLWHGKWDB-RUZDIDTESA-N 2 1 393.575 3.050 20 0 GGADMP O[C@@H]1CC[N@@H+](Cc2ccccc2CNC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000120651592 1413866418 /nfs/dbraw/zinc/86/64/18/1413866418.db2.gz IQICZQLWHGKWDB-RUZDIDTESA-N 2 1 393.575 3.050 20 0 GGADMP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000120651592 1413866422 /nfs/dbraw/zinc/86/64/22/1413866422.db2.gz IQICZQLWHGKWDB-RUZDIDTESA-N 3 1 393.575 3.050 20 0 GGADMP O[C@@H]1CC[N@@H+](Cc2ccccc2C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000120651592 1413866427 /nfs/dbraw/zinc/86/64/27/1413866427.db2.gz IQICZQLWHGKWDB-RUZDIDTESA-N 3 1 393.575 3.050 20 0 GGADMP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3nnc(-c4ccccc4)o3)CC2)C[C@H](C)O1 ZINC000177483011 1428761520 /nfs/dbraw/zinc/76/15/20/1428761520.db2.gz PWCZOEMSMNPCKH-HDICACEKSA-N 2 1 384.524 3.448 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3nnc(-c4ccccc4)o3)CC2)C[C@H](C)O1 ZINC000177483011 1428761525 /nfs/dbraw/zinc/76/15/25/1428761525.db2.gz PWCZOEMSMNPCKH-HDICACEKSA-N 2 1 384.524 3.448 20 0 GGADMP C[C@H]1C[NH+](CCC2CC[NH+](Cc3nnc(-c4ccccc4)o3)CC2)C[C@H](C)O1 ZINC000177483029 1428761554 /nfs/dbraw/zinc/76/15/54/1428761554.db2.gz PWCZOEMSMNPCKH-ROUUACIJSA-N 2 1 384.524 3.448 20 0 GGADMP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3nnc(-c4ccccc4)o3)CC2)C[C@@H](C)O1 ZINC000177483048 1428761686 /nfs/dbraw/zinc/76/16/86/1428761686.db2.gz PWCZOEMSMNPCKH-QZTJIDSGSA-N 2 1 384.524 3.448 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1)c1cccs1 ZINC000177498001 1428769925 /nfs/dbraw/zinc/76/99/25/1428769925.db2.gz LUCGJBZNCKTONF-KURKYZTESA-N 2 1 393.597 3.137 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+]Cc2c[nH]nc2-c2ccc(C)o2)CC1 ZINC000120997183 1413972342 /nfs/dbraw/zinc/97/23/42/1413972342.db2.gz FMINNLGTLCMKRQ-UHFFFAOYSA-N 2 1 393.535 3.405 20 0 GGADMP C[C@H]1C[NH+](CCC2CC[NH+](Cc3nnc(-c4ccccc4)n3C)CC2)C[C@H](C)O1 ZINC000177500485 1428771475 /nfs/dbraw/zinc/77/14/75/1428771475.db2.gz VYZJHEWORBXQMN-OALUTQOASA-N 2 1 397.567 3.193 20 0 GGADMP CC(C)c1ccc(CN2CCN(C(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000121151941 1414025689 /nfs/dbraw/zinc/02/56/89/1414025689.db2.gz GZEXUJZJSBJHQZ-FQEVSTJZSA-N 2 1 384.568 3.122 20 0 GGADMP CC(C)c1ccc(C[NH+]2CCN(C(=O)NC[C@@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000121151941 1414025697 /nfs/dbraw/zinc/02/56/97/1414025697.db2.gz GZEXUJZJSBJHQZ-FQEVSTJZSA-N 2 1 384.568 3.122 20 0 GGADMP CC(C)c1ccc(C[NH+]2CCN(C(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000121151941 1414025704 /nfs/dbraw/zinc/02/57/04/1414025704.db2.gz GZEXUJZJSBJHQZ-FQEVSTJZSA-N 2 1 384.568 3.122 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)N[C@@H](C)C(C)(C)C[NH+](C)C ZINC000121219610 1414048124 /nfs/dbraw/zinc/04/81/24/1414048124.db2.gz CPIMOPPGYCCBMB-AZUAARDMSA-N 2 1 389.588 3.054 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@H](c1ccc(C)cc1)[NH+]1CCCC1 ZINC000121276407 1414068331 /nfs/dbraw/zinc/06/83/31/1414068331.db2.gz FNZYNUJJIFVPTN-OAQYLSRUSA-N 2 1 383.540 3.369 20 0 GGADMP COCC[N@@H+](C)CCOc1cccc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c1 ZINC000121660837 1414215380 /nfs/dbraw/zinc/21/53/80/1414215380.db2.gz IWEVENOYJVRXSH-BDTNDASRSA-N 2 1 388.552 3.081 20 0 GGADMP Cc1ccccc1O[C@H]1CCCC[C@H]1[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000121685177 1414223088 /nfs/dbraw/zinc/22/30/88/1414223088.db2.gz GVSROCJABGQJCN-IRLDBZIGSA-N 2 1 395.551 3.017 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc(-n4ccnc4)cc3)c2)CCO1 ZINC000121694802 1414226035 /nfs/dbraw/zinc/22/60/35/1414226035.db2.gz RMRKWMWEHWHCIF-LJQANCHMSA-N 2 1 376.504 3.383 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(-n4ccnc4)cc3)c2)CCO1 ZINC000121694802 1414226038 /nfs/dbraw/zinc/22/60/38/1414226038.db2.gz RMRKWMWEHWHCIF-LJQANCHMSA-N 2 1 376.504 3.383 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000121726060 1414237905 /nfs/dbraw/zinc/23/79/05/1414237905.db2.gz MLDXRJDKJJERFI-KDURUIRLSA-N 2 1 396.620 3.028 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000121726060 1414237909 /nfs/dbraw/zinc/23/79/09/1414237909.db2.gz MLDXRJDKJJERFI-KDURUIRLSA-N 2 1 396.620 3.028 20 0 GGADMP CCCC[NH+](C)CC1CCN(C(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000121726060 1414237912 /nfs/dbraw/zinc/23/79/12/1414237912.db2.gz MLDXRJDKJJERFI-KDURUIRLSA-N 2 1 396.620 3.028 20 0 GGADMP CCCC[NH+](C)CC1CCN(C(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000121726060 1414237918 /nfs/dbraw/zinc/23/79/18/1414237918.db2.gz MLDXRJDKJJERFI-KDURUIRLSA-N 2 1 396.620 3.028 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177557088 1428792501 /nfs/dbraw/zinc/79/25/01/1428792501.db2.gz MDVYGLQWUDTHGK-FQEVSTJZSA-N 2 1 376.589 3.347 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3[C@H]4CCO[C@@H]4C34CCC4)CC2)cs1 ZINC000121791329 1414258685 /nfs/dbraw/zinc/25/86/85/1414258685.db2.gz CSXWGECDPJILAZ-RLLQIKCJSA-N 2 1 375.582 3.465 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000121826282 1414270392 /nfs/dbraw/zinc/27/03/92/1414270392.db2.gz AQEPNOXGBZKVOV-SFHLNBCPSA-N 2 1 386.584 3.126 20 0 GGADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000121857275 1414280321 /nfs/dbraw/zinc/28/03/21/1414280321.db2.gz ASSLMVTZQSLYHY-GJZGRUSLSA-N 2 1 382.346 3.488 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](CC(=O)Nc2cc(C)ccc2C)CC1 ZINC000122043854 1414347433 /nfs/dbraw/zinc/34/74/33/1414347433.db2.gz QHSFBHSYRPCMSC-UHFFFAOYSA-N 2 1 375.557 3.312 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(Cl)cn2)CC1 ZINC000122054824 1414350583 /nfs/dbraw/zinc/35/05/83/1414350583.db2.gz JZZUCUPUVWUTSW-INIZCTEOSA-N 2 1 396.963 3.132 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(Cl)cn2)CC1 ZINC000122054824 1414350592 /nfs/dbraw/zinc/35/05/92/1414350592.db2.gz JZZUCUPUVWUTSW-INIZCTEOSA-N 2 1 396.963 3.132 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2C)CC1 ZINC000122137611 1414370666 /nfs/dbraw/zinc/37/06/66/1414370666.db2.gz UPZZKGLOWUJLOO-IBGZPJMESA-N 2 1 375.557 3.392 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(Cl)c1COC ZINC000122141292 1414372492 /nfs/dbraw/zinc/37/24/92/1414372492.db2.gz PAXYBIIEDUZERX-MRXNPFEDSA-N 2 1 396.963 3.366 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)N2[C@H](C)CCC[C@@H]2C)CC1 ZINC000122162979 1414377008 /nfs/dbraw/zinc/37/70/08/1414377008.db2.gz VLKATONIOFRQSZ-HSALFYBXSA-N 2 1 381.605 3.235 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)N2[C@@H](C)CCC[C@@H]2C)CC1 ZINC000122163170 1414377153 /nfs/dbraw/zinc/37/71/53/1414377153.db2.gz VLKATONIOFRQSZ-SLFFLAALSA-N 2 1 381.605 3.235 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](CC(=O)Nc2c(C)cccc2C)CC1 ZINC000122205915 1414388120 /nfs/dbraw/zinc/38/81/20/1414388120.db2.gz XSROYJSROQXELK-UHFFFAOYSA-N 2 1 375.557 3.312 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](CC(=O)Nc2c(C)cccc2C)CC1 ZINC000122205915 1414388125 /nfs/dbraw/zinc/38/81/25/1414388125.db2.gz XSROYJSROQXELK-UHFFFAOYSA-N 2 1 375.557 3.312 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000122724771 1414549302 /nfs/dbraw/zinc/54/93/02/1414549302.db2.gz LYQIZKASGNCATR-IRXDYDNUSA-N 2 1 377.529 3.275 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c(OC)c1 ZINC000122726227 1414550314 /nfs/dbraw/zinc/55/03/14/1414550314.db2.gz ZINFFJCJXCLEMC-IRXDYDNUSA-N 2 1 377.529 3.275 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000122808062 1414569760 /nfs/dbraw/zinc/56/97/60/1414569760.db2.gz DOSXJKIPSMNZDW-YKSBVNFPSA-N 2 1 378.564 3.330 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000122808062 1414569762 /nfs/dbraw/zinc/56/97/62/1414569762.db2.gz DOSXJKIPSMNZDW-YKSBVNFPSA-N 2 1 378.564 3.330 20 0 GGADMP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000122808292 1414569866 /nfs/dbraw/zinc/56/98/66/1414569866.db2.gz DOSXJKIPSMNZDW-RDPSFJRHSA-N 2 1 378.564 3.330 20 0 GGADMP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000122808292 1414569870 /nfs/dbraw/zinc/56/98/70/1414569870.db2.gz DOSXJKIPSMNZDW-RDPSFJRHSA-N 2 1 378.564 3.330 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccc3c(c2)OCO3)[C@H](C)C1 ZINC000122815703 1414572007 /nfs/dbraw/zinc/57/20/07/1414572007.db2.gz MBYKHLLMAZSFGO-MJGOQNOKSA-N 2 1 376.541 3.420 20 0 GGADMP Cc1cc(C(=O)N(C)CC[N@@H+](C)C2CCN(C)CC2)c(C)n1Cc1ccccc1 ZINC000122971069 1414609490 /nfs/dbraw/zinc/60/94/90/1414609490.db2.gz GYCOVGCSNRNKDX-UHFFFAOYSA-N 2 1 396.579 3.251 20 0 GGADMP Cc1cc(C(=O)N(C)CCN(C)C2CC[NH+](C)CC2)c(C)n1Cc1ccccc1 ZINC000122971069 1414609491 /nfs/dbraw/zinc/60/94/91/1414609491.db2.gz GYCOVGCSNRNKDX-UHFFFAOYSA-N 2 1 396.579 3.251 20 0 GGADMP COc1cc(OC)c(NC(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1Cl ZINC000123242292 1414676554 /nfs/dbraw/zinc/67/65/54/1414676554.db2.gz WOQKZOUFMHKDBR-UHFFFAOYSA-N 2 1 397.947 3.350 20 0 GGADMP CC[N@H+]1CC[C@H](CNCc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000123411535 1414721835 /nfs/dbraw/zinc/72/18/35/1414721835.db2.gz LBRQIZRQMFXGCE-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000123411535 1414721851 /nfs/dbraw/zinc/72/18/51/1414721851.db2.gz LBRQIZRQMFXGCE-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000123411535 1414721860 /nfs/dbraw/zinc/72/18/60/1414721860.db2.gz LBRQIZRQMFXGCE-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)CC2)nc(C)[nH+]1 ZINC000123412676 1414722675 /nfs/dbraw/zinc/72/26/75/1414722675.db2.gz IEFCEWWKOGNEPY-MSOLQXFVSA-N 2 1 389.544 3.098 20 0 GGADMP C[C@@H]1C[N@H+](CCCCNC(=O)c2oc3ccccc3c2C[NH+](C)C)C[C@H](C)O1 ZINC000123481384 1414748059 /nfs/dbraw/zinc/74/80/59/1414748059.db2.gz IMZDMBMRHKSNAM-CALCHBBNSA-N 2 1 387.524 3.114 20 0 GGADMP O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000123741176 1414818298 /nfs/dbraw/zinc/81/82/98/1414818298.db2.gz IXKRDIQKOGWCSO-MZYLBHOOSA-N 2 1 396.579 3.482 20 0 GGADMP O=C(C1CCCCC1)N1CC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000123802662 1414826806 /nfs/dbraw/zinc/82/68/06/1414826806.db2.gz UWNCSPCLLWQWHY-QHCPKHFHSA-N 2 1 383.580 3.464 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000123805002 1414827060 /nfs/dbraw/zinc/82/70/60/1414827060.db2.gz IZMHACVNQXUBQS-QIDMFYOTSA-N 2 1 397.567 3.380 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000123805002 1414827061 /nfs/dbraw/zinc/82/70/61/1414827061.db2.gz IZMHACVNQXUBQS-QIDMFYOTSA-N 2 1 397.567 3.380 20 0 GGADMP C[NH+]1CCC2(CC1)NC(=O)N(C[N@@H+]1CCC[C@@H]1c1ccc(C(C)(C)C)cc1)C2=O ZINC000124152113 1414896071 /nfs/dbraw/zinc/89/60/71/1414896071.db2.gz XJTYBHCCJLDBAA-LJQANCHMSA-N 2 1 398.551 3.095 20 0 GGADMP C[NH+]1CCC2(CC1)NC(=O)N(C[N@H+]1CCC[C@@H]1c1ccc(C(C)(C)C)cc1)C2=O ZINC000124152113 1414896076 /nfs/dbraw/zinc/89/60/76/1414896076.db2.gz XJTYBHCCJLDBAA-LJQANCHMSA-N 2 1 398.551 3.095 20 0 GGADMP Cc1c([C@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)cnn1-c1ccc(F)cc1 ZINC000124385098 1414954254 /nfs/dbraw/zinc/95/42/54/1414954254.db2.gz XPWCPJYVVPTDPK-KRWDZBQOSA-N 2 1 387.547 3.244 20 0 GGADMP Cc1c([C@@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)cnn1-c1ccc(F)cc1 ZINC000124384875 1414954285 /nfs/dbraw/zinc/95/42/85/1414954285.db2.gz XPWCPJYVVPTDPK-QGZVFWFLSA-N 2 1 387.547 3.244 20 0 GGADMP C[NH+](C)CCN(C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)C1CCCC1 ZINC000124509765 1414984205 /nfs/dbraw/zinc/98/42/05/1414984205.db2.gz POVRNDNDWKDZKW-OAQYLSRUSA-N 2 1 386.584 3.067 20 0 GGADMP COc1cc(OC)c([C@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)cc1Cl ZINC000124509853 1414984406 /nfs/dbraw/zinc/98/44/06/1414984406.db2.gz QOEZVXPBIVEBND-HNNXBMFYSA-N 2 1 383.964 3.281 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)Nc3ccc(OCCC[NH+](C)C)cc3)CC2)c1 ZINC000124591173 1415001045 /nfs/dbraw/zinc/00/10/45/1415001045.db2.gz SCQFJMXCMNXEPG-UHFFFAOYSA-N 2 1 397.523 3.075 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000124912467 1415071183 /nfs/dbraw/zinc/07/11/83/1415071183.db2.gz GPTRVFFGKZYZNI-CTNGQTDRSA-N 2 1 376.589 3.157 20 0 GGADMP CCCc1cc(NC2CC[NH+](CCS(C)(=O)=O)CC2)c2ccccc2[nH+]1 ZINC000124986863 1415087138 /nfs/dbraw/zinc/08/71/38/1415087138.db2.gz KTMYSSJLVLKPFE-UHFFFAOYSA-N 2 1 375.538 3.108 20 0 GGADMP Cc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000124998532 1415089153 /nfs/dbraw/zinc/08/91/53/1415089153.db2.gz ZTACUBPFVJEYNF-QHCPKHFHSA-N 2 1 393.531 3.433 20 0 GGADMP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125013915 1415091634 /nfs/dbraw/zinc/09/16/34/1415091634.db2.gz XSAUVQWHTOPGHJ-MHECFPHRSA-N 2 1 393.531 3.371 20 0 GGADMP C[C@H](CCc1ccco1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125019002 1415092911 /nfs/dbraw/zinc/09/29/11/1415092911.db2.gz MOGZXQSFTRSYHQ-GOSISDBHSA-N 2 1 385.508 3.051 20 0 GGADMP C[C@H](Cc1ccc(F)cc1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125027255 1415094441 /nfs/dbraw/zinc/09/44/41/1415094441.db2.gz BQAFWBTZNFWVNS-GOSISDBHSA-N 2 1 399.510 3.207 20 0 GGADMP Cc1ccccc1C[C@@H](C)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125028437 1415094526 /nfs/dbraw/zinc/09/45/26/1415094526.db2.gz YYCNPIRLYCNXEU-HXUWFJFHSA-N 2 1 395.547 3.377 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC1 ZINC000125039722 1415097461 /nfs/dbraw/zinc/09/74/61/1415097461.db2.gz FFQKPQVHERDUIB-UHFFFAOYSA-N 2 1 397.611 3.346 20 0 GGADMP Cc1cccc(N2CC[NH+](CCCC[NH2+]C3CCN(CC4CC4)CC3)CC2)c1 ZINC000125325457 1415164762 /nfs/dbraw/zinc/16/47/62/1415164762.db2.gz JWSWUHUNQOSAPX-UHFFFAOYSA-N 2 1 384.612 3.361 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000177846027 1428871240 /nfs/dbraw/zinc/87/12/40/1428871240.db2.gz DURNOPVAKPINTO-GOSISDBHSA-N 2 1 392.975 3.288 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)C1 ZINC000177849287 1428872299 /nfs/dbraw/zinc/87/22/99/1428872299.db2.gz ZFDURNYTEARICR-UGKGYDQZSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000177849287 1428872303 /nfs/dbraw/zinc/87/23/03/1428872303.db2.gz ZFDURNYTEARICR-UGKGYDQZSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000177849287 1428872306 /nfs/dbraw/zinc/87/23/06/1428872306.db2.gz ZFDURNYTEARICR-UGKGYDQZSA-N 2 1 386.584 3.402 20 0 GGADMP O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000125498222 1415214458 /nfs/dbraw/zinc/21/44/58/1415214458.db2.gz XEVCYNKJLMCWJR-WIYYLYMNSA-N 2 1 379.508 3.031 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000125658563 1415247988 /nfs/dbraw/zinc/24/79/88/1415247988.db2.gz JHXQVVPPHOXCHV-QNGMFEMESA-N 2 1 378.605 3.449 20 0 GGADMP CS(=O)(=O)Cc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000125713449 1415260344 /nfs/dbraw/zinc/26/03/44/1415260344.db2.gz YZDDKFVTGAQNMH-UHFFFAOYSA-N 2 1 386.561 3.028 20 0 GGADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000125753846 1415271045 /nfs/dbraw/zinc/27/10/45/1415271045.db2.gz KLMBXHUBIFCSSX-HOCLYGCPSA-N 2 1 381.446 3.412 20 0 GGADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000125753846 1415271049 /nfs/dbraw/zinc/27/10/49/1415271049.db2.gz KLMBXHUBIFCSSX-HOCLYGCPSA-N 2 1 381.446 3.412 20 0 GGADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000125753846 1415271054 /nfs/dbraw/zinc/27/10/54/1415271054.db2.gz KLMBXHUBIFCSSX-HOCLYGCPSA-N 2 1 381.446 3.412 20 0 GGADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1OCC(=O)N(C)C ZINC000125912904 1415311053 /nfs/dbraw/zinc/31/10/53/1415311053.db2.gz DBTFUSOPYOOOEZ-AZUAARDMSA-N 2 1 375.557 3.315 20 0 GGADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1OCC(=O)N(C)C ZINC000125912904 1415311061 /nfs/dbraw/zinc/31/10/61/1415311061.db2.gz DBTFUSOPYOOOEZ-AZUAARDMSA-N 2 1 375.557 3.315 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)[NH+](C)C)cc1 ZINC000126066214 1415349088 /nfs/dbraw/zinc/34/90/88/1415349088.db2.gz AJXCNMXSCCYZKZ-FCEUIQTBSA-N 2 1 384.568 3.256 20 0 GGADMP O=C(N[C@@H]1CC[NH+](C2CCCC2)C1)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000126092551 1415355691 /nfs/dbraw/zinc/35/56/91/1415355691.db2.gz XEFUXUUFXITUAQ-HXUWFJFHSA-N 2 1 388.531 3.060 20 0 GGADMP O=C(N[C@@H]1CC[NH+](C2CCCC2)C1)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000126092551 1415355695 /nfs/dbraw/zinc/35/56/95/1415355695.db2.gz XEFUXUUFXITUAQ-HXUWFJFHSA-N 2 1 388.531 3.060 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](C2CCCC2)C1)N1CCC[NH+](Cc2ccc(F)cc2)CC1 ZINC000126092551 1415355704 /nfs/dbraw/zinc/35/57/04/1415355704.db2.gz XEFUXUUFXITUAQ-HXUWFJFHSA-N 2 1 388.531 3.060 20 0 GGADMP O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCC[NH+](Cc2ccc(F)cc2)CC1 ZINC000126092551 1415355716 /nfs/dbraw/zinc/35/57/16/1415355716.db2.gz XEFUXUUFXITUAQ-HXUWFJFHSA-N 2 1 388.531 3.060 20 0 GGADMP O=C(N[C@H]1CC[NH+](C2CCCC2)C1)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000126092782 1415356085 /nfs/dbraw/zinc/35/60/85/1415356085.db2.gz XEFUXUUFXITUAQ-FQEVSTJZSA-N 2 1 388.531 3.060 20 0 GGADMP O=C(N[C@H]1CC[NH+](C2CCCC2)C1)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000126092782 1415356088 /nfs/dbraw/zinc/35/60/88/1415356088.db2.gz XEFUXUUFXITUAQ-FQEVSTJZSA-N 2 1 388.531 3.060 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](C2CCCC2)C1)N1CCC[NH+](Cc2ccc(F)cc2)CC1 ZINC000126092782 1415356099 /nfs/dbraw/zinc/35/60/99/1415356099.db2.gz XEFUXUUFXITUAQ-FQEVSTJZSA-N 2 1 388.531 3.060 20 0 GGADMP O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCC[NH+](Cc2ccc(F)cc2)CC1 ZINC000126092782 1415356102 /nfs/dbraw/zinc/35/61/02/1415356102.db2.gz XEFUXUUFXITUAQ-FQEVSTJZSA-N 2 1 388.531 3.060 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C[N@@H+]1C1CC1 ZINC000126174838 1415377588 /nfs/dbraw/zinc/37/75/88/1415377588.db2.gz WWNPZMGHWNJJLO-XLIONFOSSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C[N@H+]1C1CC1 ZINC000126174838 1415377590 /nfs/dbraw/zinc/37/75/90/1415377590.db2.gz WWNPZMGHWNJJLO-XLIONFOSSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C[NH+]1C1CC1 ZINC000126174838 1415377594 /nfs/dbraw/zinc/37/75/94/1415377594.db2.gz WWNPZMGHWNJJLO-XLIONFOSSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C[NH+]1C1CC1 ZINC000126174838 1415377600 /nfs/dbraw/zinc/37/76/00/1415377600.db2.gz WWNPZMGHWNJJLO-XLIONFOSSA-N 2 1 396.535 3.336 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCNS(=O)(=O)c2ccc(C)cc2)cc1 ZINC000177995481 1428920596 /nfs/dbraw/zinc/92/05/96/1428920596.db2.gz MKJIXYCEUMPVJO-QGZVFWFLSA-N 2 1 398.532 3.118 20 0 GGADMP CNS(=O)(=O)c1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1 ZINC000177980120 1428913637 /nfs/dbraw/zinc/91/36/37/1428913637.db2.gz ONNBGRKQYLQZTC-QGZVFWFLSA-N 2 1 389.565 3.286 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+][C@H](C)CC(=O)Nc2ccccc2)CC1 ZINC000126359936 1415426965 /nfs/dbraw/zinc/42/69/65/1415426965.db2.gz XZMQJDLWRJZUDO-HXUWFJFHSA-N 2 1 394.563 3.331 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc2c(c1)CCO2 ZINC000178006267 1428929972 /nfs/dbraw/zinc/92/99/72/1428929972.db2.gz NBYBKNZAFUFXNJ-VGSWGCGISA-N 2 1 393.531 3.170 20 0 GGADMP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000126461688 1415459373 /nfs/dbraw/zinc/45/93/73/1415459373.db2.gz YDXDXRIHSYKRMN-LJQANCHMSA-N 2 1 375.561 3.039 20 0 GGADMP CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000126461688 1415459376 /nfs/dbraw/zinc/45/93/76/1415459376.db2.gz YDXDXRIHSYKRMN-LJQANCHMSA-N 2 1 375.561 3.039 20 0 GGADMP CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c1 ZINC000126645021 1415515422 /nfs/dbraw/zinc/51/54/22/1415515422.db2.gz SLQCBSALOCOTMB-GOSISDBHSA-N 2 1 380.536 3.243 20 0 GGADMP Cc1cccc(NC(=O)C[C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1C ZINC000178036388 1428948575 /nfs/dbraw/zinc/94/85/75/1428948575.db2.gz OZZJFINVIPSFRR-GBESFXJTSA-N 2 1 375.557 3.500 20 0 GGADMP CC[N@H+](C)C[C@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000178025399 1428942441 /nfs/dbraw/zinc/94/24/41/1428942441.db2.gz SEQUJNHNKMFZTJ-QGZVFWFLSA-N 2 1 376.570 3.041 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000178025399 1428942454 /nfs/dbraw/zinc/94/24/54/1428942454.db2.gz SEQUJNHNKMFZTJ-QGZVFWFLSA-N 2 1 376.570 3.041 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc(F)cc1N(C)C ZINC000126727760 1415540940 /nfs/dbraw/zinc/54/09/40/1415540940.db2.gz XIVNMNNVGPBXGZ-GOSISDBHSA-N 2 1 384.543 3.490 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(-n2cnnn2)c1 ZINC000126768617 1415553609 /nfs/dbraw/zinc/55/36/09/1415553609.db2.gz DOOGHDXMDQYUOZ-IRXDYDNUSA-N 2 1 382.537 3.287 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(-n2cnnn2)c1 ZINC000126768617 1415553620 /nfs/dbraw/zinc/55/36/20/1415553620.db2.gz DOOGHDXMDQYUOZ-IRXDYDNUSA-N 2 1 382.537 3.287 20 0 GGADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(N2CCOC2=O)c1 ZINC000178037153 1428949622 /nfs/dbraw/zinc/94/96/22/1428949622.db2.gz MXFOBEDRJACXNK-KSZLIROESA-N 2 1 375.513 3.183 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(-n2cnnn2)cc1 ZINC000126883803 1415594968 /nfs/dbraw/zinc/59/49/68/1415594968.db2.gz GPOHDTMNAUQCLY-IRXDYDNUSA-N 2 1 382.537 3.287 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(-n2cnnn2)cc1 ZINC000126883803 1415594976 /nfs/dbraw/zinc/59/49/76/1415594976.db2.gz GPOHDTMNAUQCLY-IRXDYDNUSA-N 2 1 382.537 3.287 20 0 GGADMP CC[NH+](CC)CCn1ccc2cc(NC(=O)C[N@H+](C)[C@H]3CCSC3)ccc21 ZINC000127009010 1415634480 /nfs/dbraw/zinc/63/44/80/1415634480.db2.gz HHUBFJLIIPYKNX-IBGZPJMESA-N 2 1 388.581 3.359 20 0 GGADMP CC[NH+](CC)CCn1ccc2cc(NC(=O)C[N@@H+](C)[C@H]3CCSC3)ccc21 ZINC000127009010 1415634483 /nfs/dbraw/zinc/63/44/83/1415634483.db2.gz HHUBFJLIIPYKNX-IBGZPJMESA-N 2 1 388.581 3.359 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)C1CCCCC1 ZINC000127161522 1415675559 /nfs/dbraw/zinc/67/55/59/1415675559.db2.gz WASXMARGVJVSSX-HLAWJBBLSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)N(Cc2ccco2)C2CC[NH+](C)CC2)C1 ZINC000127261745 1415708084 /nfs/dbraw/zinc/70/80/84/1415708084.db2.gz CJFQDKRZTCWAHT-KDURUIRLSA-N 2 1 390.572 3.253 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc(C[NH+](C)C)c(F)c1 ZINC000127463251 1415788437 /nfs/dbraw/zinc/78/84/37/1415788437.db2.gz RFEQHZBHRHOHEJ-JTSKRJEESA-N 2 1 398.526 3.207 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000127507496 1415802316 /nfs/dbraw/zinc/80/23/16/1415802316.db2.gz DEKYXLAMOJLDOH-ZLNRFVROSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(N[C@@H]1CC[NH+](CC2CC2)C1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000127507496 1415802317 /nfs/dbraw/zinc/80/23/17/1415802317.db2.gz DEKYXLAMOJLDOH-ZLNRFVROSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(N[C@@H]1CC[NH+](CC2CC2)C1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000127507496 1415802318 /nfs/dbraw/zinc/80/23/18/1415802318.db2.gz DEKYXLAMOJLDOH-ZLNRFVROSA-N 2 1 396.579 3.167 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)N[C@@H]1C[C@H](C)[NH+](C2CC2)C1 ZINC000127599747 1415816783 /nfs/dbraw/zinc/81/67/83/1415816783.db2.gz WPKOZZNRQADKBL-CEWLAPEOSA-N 2 1 384.568 3.165 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@@H]1C[C@H](C)[N@@H+](C2CC2)C1 ZINC000127599747 1415816787 /nfs/dbraw/zinc/81/67/87/1415816787.db2.gz WPKOZZNRQADKBL-CEWLAPEOSA-N 2 1 384.568 3.165 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000127599747 1415816789 /nfs/dbraw/zinc/81/67/89/1415816789.db2.gz WPKOZZNRQADKBL-CEWLAPEOSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1ccc(F)cc1 ZINC000127615478 1415820290 /nfs/dbraw/zinc/82/02/90/1415820290.db2.gz BPIFOMWCEYSWIR-GOSISDBHSA-N 2 1 399.510 3.380 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccc(F)cc1 ZINC000127668979 1415829816 /nfs/dbraw/zinc/82/98/16/1415829816.db2.gz XWKUUIDGOHPDMG-JRGCBEDISA-N 2 1 388.531 3.087 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000127862114 1415864909 /nfs/dbraw/zinc/86/49/09/1415864909.db2.gz WNKWDMDQQGUSND-UXHICEINSA-N 2 1 390.572 3.474 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cccc(F)c1 ZINC000127934344 1415877646 /nfs/dbraw/zinc/87/76/46/1415877646.db2.gz HSZULKHBRSZECN-DUXKGJEZSA-N 2 1 388.531 3.087 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000127935050 1415878323 /nfs/dbraw/zinc/87/83/23/1415878323.db2.gz HRGQRJRNNBWUMG-XLIONFOSSA-N 2 1 378.536 3.096 20 0 GGADMP COc1cccc(C[C@H]([NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)c2ccccc2)c1 ZINC000128004294 1415891462 /nfs/dbraw/zinc/89/14/62/1415891462.db2.gz TUCYACJQBLFYDI-GMAHTHKFSA-N 2 1 395.547 3.156 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C[NH2+]Cc3ccc(-n4cncn4)cc3)cc2)C[C@H](C)O1 ZINC000128005646 1415892170 /nfs/dbraw/zinc/89/21/70/1415892170.db2.gz WNPHQMWJXGPWJG-KDURUIRLSA-N 2 1 391.519 3.166 20 0 GGADMP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc2cc(OC)ccc2c1 ZINC000128044983 1415899973 /nfs/dbraw/zinc/89/99/73/1415899973.db2.gz CTLOYWLGTQGYNG-RBBKRZOGSA-N 2 1 383.536 3.477 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)[C@@H]2CCC[N@H+]2C2CCOCC2)CC1 ZINC000178203194 1429017645 /nfs/dbraw/zinc/01/76/45/1429017645.db2.gz UZJKWRUYJNKOFR-QHCPKHFHSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@@H]1C[NH+](CCC2CCN(C(=O)[C@@H](c3ccccc3)[NH+](C)C)CC2)C[C@@H](C)O1 ZINC000178235483 1429026004 /nfs/dbraw/zinc/02/60/04/1429026004.db2.gz OZPMAYSVOZGFFD-WOIUINJBSA-N 2 1 387.568 3.027 20 0 GGADMP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CCCN2CCC[N@@H+](C)CC2)cc1 ZINC000128240003 1415946139 /nfs/dbraw/zinc/94/61/39/1415946139.db2.gz KPKZHGZSTILWCP-LJQANCHMSA-N 2 1 389.588 3.239 20 0 GGADMP COCCOc1ccc(C[N@@H+]2CC[C@@H](CNc3cccc(C)[nH+]3)C2)cc1OC ZINC000128287668 1415955506 /nfs/dbraw/zinc/95/55/06/1415955506.db2.gz MFABLJHLPHAKHM-IBGZPJMESA-N 2 1 385.508 3.358 20 0 GGADMP COCCOc1ccc(C[N@H+]2CC[C@@H](CNc3cccc(C)[nH+]3)C2)cc1OC ZINC000128287668 1415955508 /nfs/dbraw/zinc/95/55/08/1415955508.db2.gz MFABLJHLPHAKHM-IBGZPJMESA-N 2 1 385.508 3.358 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CCN(C(=O)c3cccc(C[NH+](C)C)c3)CC2)C[C@H](C)O1 ZINC000178259175 1429035937 /nfs/dbraw/zinc/03/59/37/1429035937.db2.gz SQDXTQVDGRSFTN-KDURUIRLSA-N 2 1 387.568 3.100 20 0 GGADMP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000128531499 1416006981 /nfs/dbraw/zinc/00/69/81/1416006981.db2.gz RYGZGECQKKEMRK-QHCPKHFHSA-N 2 1 393.531 3.430 20 0 GGADMP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000128531499 1416006985 /nfs/dbraw/zinc/00/69/85/1416006985.db2.gz RYGZGECQKKEMRK-QHCPKHFHSA-N 2 1 393.531 3.430 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]C2CCN(Cc3c(F)cccc3Cl)CC2)CC1 ZINC000128680435 1416041604 /nfs/dbraw/zinc/04/16/04/1416041604.db2.gz OFYWEIHKHJPPSF-UHFFFAOYSA-N 2 1 396.982 3.061 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccco1 ZINC000128727731 1416052759 /nfs/dbraw/zinc/05/27/59/1416052759.db2.gz PXTVGGZUWTZLGG-OALUTQOASA-N 2 1 378.561 3.330 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccco1 ZINC000128726988 1416052917 /nfs/dbraw/zinc/05/29/17/1416052917.db2.gz IDNSRIBHGJZCQB-MISYRCLQSA-N 2 1 388.556 3.321 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1 ZINC000178339711 1429055533 /nfs/dbraw/zinc/05/55/33/1429055533.db2.gz OXRPBROGXFCGDE-SFHVURJKSA-N 2 1 395.613 3.488 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000128819013 1416076750 /nfs/dbraw/zinc/07/67/50/1416076750.db2.gz GSXFEYJCFKVUQQ-UHFFFAOYSA-N 2 1 391.515 3.317 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCc2ccccc2-n2ccnc2)C[N@H+]1Cc1ccccc1 ZINC000128900277 1416096859 /nfs/dbraw/zinc/09/68/59/1416096859.db2.gz IFKBJJZSSSUYSF-NQIIRXRSSA-N 2 1 389.503 3.335 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2-n2ccnc2)C[N@H+]1Cc1ccccc1 ZINC000128900716 1416096925 /nfs/dbraw/zinc/09/69/25/1416096925.db2.gz IFKBJJZSSSUYSF-WIYYLYMNSA-N 2 1 389.503 3.335 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000178409611 1429072461 /nfs/dbraw/zinc/07/24/61/1429072461.db2.gz FKHUHKQYPZDTRL-SFHVURJKSA-N 2 1 381.586 3.244 20 0 GGADMP CCCC[N@H+](C)CC1CCN(c2nc(N)c3cc(OC)c(OC)cc3[nH+]2)CC1 ZINC000178388344 1429067301 /nfs/dbraw/zinc/06/73/01/1429067301.db2.gz PZEPGKXDQTZZBY-UHFFFAOYSA-N 2 1 387.528 3.178 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(c2nc(N)c3cc(OC)c(OC)cc3[nH+]2)CC1 ZINC000178388344 1429067310 /nfs/dbraw/zinc/06/73/10/1429067310.db2.gz PZEPGKXDQTZZBY-UHFFFAOYSA-N 2 1 387.528 3.178 20 0 GGADMP Cc1c(C(=O)NCC2CC[NH+](Cc3cccs3)CC2)cnn1-c1cc[nH+]cc1 ZINC000129369059 1416197688 /nfs/dbraw/zinc/19/76/88/1416197688.db2.gz KZLAYXUZOKOXRE-UHFFFAOYSA-N 2 1 395.532 3.279 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[NH+]1CCSCC1)C(C)(C)C[NH+](C)C ZINC000129394689 1416202325 /nfs/dbraw/zinc/20/23/25/1416202325.db2.gz RPPQQIDZNWCJLK-INIZCTEOSA-N 2 1 378.586 3.333 20 0 GGADMP C[C@@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1cccc(C(F)(F)F)c1 ZINC000129584488 1416232514 /nfs/dbraw/zinc/23/25/14/1416232514.db2.gz QWXIDHGYHBEODR-CQSZACIVSA-N 2 1 379.430 3.098 20 0 GGADMP C[C@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(Cl)c(Cl)c1 ZINC000129588120 1416233218 /nfs/dbraw/zinc/23/32/18/1416233218.db2.gz KYZXBBFDDDEXAD-ZDUSSCGKSA-N 2 1 380.323 3.386 20 0 GGADMP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000129860448 1416275880 /nfs/dbraw/zinc/27/58/80/1416275880.db2.gz QUAUEIJITOEKBL-PGRDOPGGSA-N 2 1 388.600 3.442 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000129860883 1416276117 /nfs/dbraw/zinc/27/61/17/1416276117.db2.gz KBBRUNXWPABJAZ-LJQANCHMSA-N 2 1 378.605 3.451 20 0 GGADMP Cc1nccn1-c1ccc([C@H](C)NCc2ccccc2S(=O)(=O)N(C)C)cc1 ZINC000129929402 1416286572 /nfs/dbraw/zinc/28/65/72/1416286572.db2.gz KFPKOECISHVUST-INIZCTEOSA-N 2 1 398.532 3.282 20 0 GGADMP Cc1nccn1-c1ccc([C@@H](C)NCc2ccccc2S(=O)(=O)N(C)C)cc1 ZINC000129929221 1416286627 /nfs/dbraw/zinc/28/66/27/1416286627.db2.gz KFPKOECISHVUST-MRXNPFEDSA-N 2 1 398.532 3.282 20 0 GGADMP CC(C)CC[NH+]1CCC(CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000129984307 1416296258 /nfs/dbraw/zinc/29/62/58/1416296258.db2.gz ZDAIMFBMVKQLCS-UNMCSNQZSA-N 2 1 390.616 3.403 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000130072903 1416312207 /nfs/dbraw/zinc/31/22/07/1416312207.db2.gz JXTLZRTVDKEZRD-LJQANCHMSA-N 2 1 387.499 3.221 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000130073124 1416312465 /nfs/dbraw/zinc/31/24/65/1416312465.db2.gz JXTLZRTVDKEZRD-IBGZPJMESA-N 2 1 387.499 3.221 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C[N@H+]1C1CC1 ZINC000130316500 1416356753 /nfs/dbraw/zinc/35/67/53/1416356753.db2.gz FOWOZUOFPRTRGV-CRAIPNDOSA-N 2 1 378.948 3.038 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C[N@H+]1C1CC1 ZINC000130316042 1416356771 /nfs/dbraw/zinc/35/67/71/1416356771.db2.gz FOWOZUOFPRTRGV-QAPCUYQASA-N 2 1 378.948 3.038 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C[N@H+]1C1CC1 ZINC000130316279 1416356839 /nfs/dbraw/zinc/35/68/39/1416356839.db2.gz FOWOZUOFPRTRGV-YJBOKZPZSA-N 2 1 378.948 3.038 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)c3ccc(C[NH+](C)C)cc3)cc2)C[C@H](C)O1 ZINC000130333214 1416359433 /nfs/dbraw/zinc/35/94/33/1416359433.db2.gz OTKCKSHSZMXZCB-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP CCOc1cc(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc(Cl)c1OC ZINC000130350246 1416362744 /nfs/dbraw/zinc/36/27/44/1416362744.db2.gz WCTPXDJXDUGVGD-OAHLLOKOSA-N 2 1 382.932 3.338 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O ZINC000130452293 1416380547 /nfs/dbraw/zinc/38/05/47/1416380547.db2.gz LAWPUJBIFOYUKX-KRWDZBQOSA-N 2 1 396.413 3.218 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O ZINC000130452293 1416380550 /nfs/dbraw/zinc/38/05/50/1416380550.db2.gz LAWPUJBIFOYUKX-KRWDZBQOSA-N 2 1 396.413 3.218 20 0 GGADMP C[NH+](C)C[C@H]1CCN(C(=O)NC[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)C1 ZINC000130481047 1416385619 /nfs/dbraw/zinc/38/56/19/1416385619.db2.gz GURZXWGTIDHHJU-ALKREAHSSA-N 2 1 396.938 3.065 20 0 GGADMP CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)Nc2cnn(CC[NH+](C)C)c2)c1 ZINC000130567215 1416400907 /nfs/dbraw/zinc/40/09/07/1416400907.db2.gz FUEBNXQEKKSEDN-UHFFFAOYSA-N 2 1 395.511 3.457 20 0 GGADMP CCOc1ccc([C@@H]2CCCN2C(=O)C[N@@H+](C)CCCn2ccnc2C)cc1 ZINC000130581800 1416404004 /nfs/dbraw/zinc/40/40/04/1416404004.db2.gz XCZFJCSNGXDHLZ-NRFANRHFSA-N 2 1 384.524 3.276 20 0 GGADMP CCOc1ccc([C@@H]2CCCN2C(=O)C[N@@H+](C)CCCn2cc[nH+]c2C)cc1 ZINC000130581800 1416404014 /nfs/dbraw/zinc/40/40/14/1416404014.db2.gz XCZFJCSNGXDHLZ-NRFANRHFSA-N 2 1 384.524 3.276 20 0 GGADMP C[C@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000130656802 1416418385 /nfs/dbraw/zinc/41/83/85/1416418385.db2.gz ZOZMBRINATUNOF-ZWKOTPCHSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000130656802 1416418401 /nfs/dbraw/zinc/41/84/01/1416418401.db2.gz ZOZMBRINATUNOF-ZWKOTPCHSA-N 2 1 390.597 3.477 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000130696464 1416427460 /nfs/dbraw/zinc/42/74/60/1416427460.db2.gz YAJJXVCMXVYVHJ-CQSZACIVSA-N 2 1 398.429 3.289 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000130696464 1416427467 /nfs/dbraw/zinc/42/74/67/1416427467.db2.gz YAJJXVCMXVYVHJ-CQSZACIVSA-N 2 1 398.429 3.289 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ncc(-c3ccccc3)o2)CC1 ZINC000130699462 1416428200 /nfs/dbraw/zinc/42/82/00/1416428200.db2.gz OHLJVIYALXLBDD-UHFFFAOYSA-N 2 1 398.551 3.258 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000130707431 1416430838 /nfs/dbraw/zinc/43/08/38/1416430838.db2.gz KZDSHYSKZLCUEK-MWXLCCTBSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N(Cc2ccco2)C2CC[NH+](C)CC2)C1 ZINC000130725386 1416435510 /nfs/dbraw/zinc/43/55/10/1416435510.db2.gz YQOXDZKQOQYNBD-LJQANCHMSA-N 2 1 390.572 3.253 20 0 GGADMP CC[NH+](CC)CCNC(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000130826047 1416460507 /nfs/dbraw/zinc/46/05/07/1416460507.db2.gz HFVOFQMYFMOOPT-CRAIPNDOSA-N 2 1 384.927 3.113 20 0 GGADMP CCOC(=O)c1cc(C)sc1NC(=O)[C@@H](C)[N@H+](C)CCCn1cc[nH+]c1C ZINC000130939148 1416484475 /nfs/dbraw/zinc/48/44/75/1416484475.db2.gz UIBVIBFYAIRURV-CQSZACIVSA-N 2 1 392.525 3.087 20 0 GGADMP CCOC(=O)c1cc(C)sc1NC(=O)[C@@H](C)[N@@H+](C)CCCn1cc[nH+]c1C ZINC000130939148 1416484479 /nfs/dbraw/zinc/48/44/79/1416484479.db2.gz UIBVIBFYAIRURV-CQSZACIVSA-N 2 1 392.525 3.087 20 0 GGADMP CCC[C@@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1CCOC ZINC000130978869 1416490844 /nfs/dbraw/zinc/49/08/44/1416490844.db2.gz MNMFKOXHORVHMQ-QGZVFWFLSA-N 2 1 387.524 3.067 20 0 GGADMP CCC[C@@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@H+]1CCOC ZINC000130978869 1416490845 /nfs/dbraw/zinc/49/08/45/1416490845.db2.gz MNMFKOXHORVHMQ-QGZVFWFLSA-N 2 1 387.524 3.067 20 0 GGADMP Cc1c(C(=O)Nc2ccccc2NC2CC[NH+](C)CC2)cnn1-c1cc[nH+]cc1 ZINC000131049280 1416501181 /nfs/dbraw/zinc/50/11/81/1416501181.db2.gz PSJUQEWASIGSJC-UHFFFAOYSA-N 2 1 390.491 3.334 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)N3CC[C@H]4[C@H](CCC[N@H+]4C)C3)c(C)c2)CC1 ZINC000178539244 1429101981 /nfs/dbraw/zinc/10/19/81/1429101981.db2.gz KPPXXVCEEKANDV-KNQAVFIVSA-N 2 1 399.583 3.085 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cnn(Cc4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000131060343 1416502831 /nfs/dbraw/zinc/50/28/31/1416502831.db2.gz ZZMBYYVGPTYTEO-BGYRXZFFSA-N 2 1 382.552 3.253 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000131129635 1416513210 /nfs/dbraw/zinc/51/32/10/1416513210.db2.gz YDNLZFDMTQXSIC-OAQYLSRUSA-N 2 1 384.568 3.346 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c(C)c1 ZINC000131270284 1416532873 /nfs/dbraw/zinc/53/28/73/1416532873.db2.gz HHWYICDKZXLJHV-QZTJIDSGSA-N 2 1 397.523 3.028 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)[C@@H](C)[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c(C)c1 ZINC000131270284 1416532876 /nfs/dbraw/zinc/53/28/76/1416532876.db2.gz HHWYICDKZXLJHV-QZTJIDSGSA-N 2 1 397.523 3.028 20 0 GGADMP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2nc3ccc(F)cc3o2)CC1 ZINC000131303101 1416537291 /nfs/dbraw/zinc/53/72/91/1416537291.db2.gz VANZMWBAVQYBAR-UHFFFAOYSA-N 2 1 390.503 3.027 20 0 GGADMP CCN(C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)[C@H](C)c1ccc(F)cc1 ZINC000131322433 1416540024 /nfs/dbraw/zinc/54/00/24/1416540024.db2.gz DFBHYJGZDDKFBZ-QZTJIDSGSA-N 2 1 386.515 3.423 20 0 GGADMP CCN(C(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)[C@H](C)c1ccc(F)cc1 ZINC000131322433 1416540028 /nfs/dbraw/zinc/54/00/28/1416540028.db2.gz DFBHYJGZDDKFBZ-QZTJIDSGSA-N 2 1 386.515 3.423 20 0 GGADMP O=C([C@@H](c1ccccc1)[NH+]1CCSCC1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000131397528 1416550636 /nfs/dbraw/zinc/55/06/36/1416550636.db2.gz KAKZQABBFSUOJY-NHCUHLMSSA-N 2 1 387.593 3.253 20 0 GGADMP CC[NH+](CC)CCC[NH2+][C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000131457884 1416561104 /nfs/dbraw/zinc/56/11/04/1416561104.db2.gz XJJZWJKIZDQCOK-GOSISDBHSA-N 2 1 381.586 3.244 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000131583531 1416580045 /nfs/dbraw/zinc/58/00/45/1416580045.db2.gz NSYWGBKVLWCVNV-VQTJNVASSA-N 2 1 376.932 3.287 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)NCC2CC[NH+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000131650991 1416590489 /nfs/dbraw/zinc/59/04/89/1416590489.db2.gz ZMRJOUSMLJIHNU-VQIMIIECSA-N 2 1 396.938 3.113 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2cc(F)c(F)c(F)c2)CC1 ZINC000131893109 1416643646 /nfs/dbraw/zinc/64/36/46/1416643646.db2.gz MRFGTDVGWPBAPO-UHFFFAOYSA-N 2 1 385.474 3.020 20 0 GGADMP Cc1c(C(=O)NCC(C)(C)[NH2+][C@H](C)c2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000132017468 1416674748 /nfs/dbraw/zinc/67/47/48/1416674748.db2.gz HSCJRGGXEYJVRO-MRXNPFEDSA-N 2 1 377.492 3.435 20 0 GGADMP Cc1c(C(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000132017266 1416675083 /nfs/dbraw/zinc/67/50/83/1416675083.db2.gz HSCJRGGXEYJVRO-INIZCTEOSA-N 2 1 377.492 3.435 20 0 GGADMP CC[C@@H](C(=O)N1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1)[NH+](C)C ZINC000178600716 1429118822 /nfs/dbraw/zinc/11/88/22/1429118822.db2.gz BUUCQPBDRCNMCE-SFHVURJKSA-N 2 1 385.474 3.468 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000132071854 1416688271 /nfs/dbraw/zinc/68/82/71/1416688271.db2.gz BTNQWYQFRLQXNP-IBGZPJMESA-N 2 1 395.551 3.038 20 0 GGADMP Cc1c(C(=O)N(CC[NH+](C)C)Cc2cccc(C)c2)cnn1-c1cc[nH+]cc1 ZINC000132124975 1416701492 /nfs/dbraw/zinc/70/14/92/1416701492.db2.gz GMOQXFKXTQKGJW-UHFFFAOYSA-N 2 1 377.492 3.088 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1)c1ccc([S@](C)=O)cc1 ZINC000178616662 1429123051 /nfs/dbraw/zinc/12/30/51/1429123051.db2.gz QESQADOWLYQQCG-VFUKXHBFSA-N 2 1 386.561 3.496 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1)c1ccc([S@](C)=O)cc1 ZINC000178616662 1429123057 /nfs/dbraw/zinc/12/30/57/1429123057.db2.gz QESQADOWLYQQCG-VFUKXHBFSA-N 2 1 386.561 3.496 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1)c1ccc([S@](C)=O)cc1 ZINC000178616651 1429123201 /nfs/dbraw/zinc/12/32/01/1429123201.db2.gz QESQADOWLYQQCG-UHMYUZELSA-N 2 1 386.561 3.496 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1)c1ccc([S@](C)=O)cc1 ZINC000178616651 1429123204 /nfs/dbraw/zinc/12/32/04/1429123204.db2.gz QESQADOWLYQQCG-UHMYUZELSA-N 2 1 386.561 3.496 20 0 GGADMP CC(C)(C)c1nn(-c2ccccc2)cc1C[NH2+]CCCC[N@H+]1CCC[C@H]1CO ZINC000132327643 1416736983 /nfs/dbraw/zinc/73/69/83/1416736983.db2.gz XAXWPKXVCUWZEV-NRFANRHFSA-N 2 1 384.568 3.496 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)oc1C ZINC000132519106 1416776701 /nfs/dbraw/zinc/77/67/01/1416776701.db2.gz WRQVSIURTNKNLO-SFHVURJKSA-N 2 1 392.544 3.102 20 0 GGADMP Cc1csc(C2([NH2+]CC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)CCCC2)n1 ZINC000132632070 1416797082 /nfs/dbraw/zinc/79/70/82/1416797082.db2.gz XSZWSGFDPXGBJX-SFHVURJKSA-N 2 1 386.565 3.230 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+]([C@@H]3CCCc4ccc(F)cc43)CC2)CC1 ZINC000132767943 1416812603 /nfs/dbraw/zinc/81/26/03/1416812603.db2.gz LHCLKFNDOOKFIS-JOCHJYFZSA-N 2 1 387.543 3.469 20 0 GGADMP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000178667581 1429133346 /nfs/dbraw/zinc/13/33/46/1429133346.db2.gz DJJGGODJWDUSSV-AWEZNQCLSA-N 2 1 389.487 3.156 20 0 GGADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCC(=O)N1CC[NH+](C)CC1 ZINC000178667283 1429133531 /nfs/dbraw/zinc/13/35/31/1429133531.db2.gz DRBOZLHSOWMDFB-INIZCTEOSA-N 2 1 386.565 3.242 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(NC[C@@](C)(O)C[NH+](C)C)n1 ZINC000133027713 1416843671 /nfs/dbraw/zinc/84/36/71/1416843671.db2.gz UGVPHEWMOJFYGI-OAQYLSRUSA-N 2 1 399.564 3.144 20 0 GGADMP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC(=O)N2CC[NH+](C)CC2)CCC3)cc1 ZINC000178668624 1429133642 /nfs/dbraw/zinc/13/36/42/1429133642.db2.gz OHVWDPRWNKWDIK-GOSISDBHSA-N 2 1 398.576 3.250 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)[C@H](C)C1 ZINC000133090286 1416850774 /nfs/dbraw/zinc/85/07/74/1416850774.db2.gz PQWAARSBBRHLJH-UXPWSPDFSA-N 2 1 399.501 3.399 20 0 GGADMP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000178676220 1429136898 /nfs/dbraw/zinc/13/68/98/1429136898.db2.gz KEMIFBGIVSLNAF-SFHVURJKSA-N 2 1 399.510 3.219 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@@H]1C)[NH+]1CCSCC1 ZINC000133128011 1416855178 /nfs/dbraw/zinc/85/51/78/1416855178.db2.gz VCSSOSDPJTXILY-ZWKOTPCHSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1C[N@H+]1CCCC[C@@H]1C)[NH+]1CCSCC1 ZINC000133128011 1416855181 /nfs/dbraw/zinc/85/51/81/1416855181.db2.gz VCSSOSDPJTXILY-ZWKOTPCHSA-N 2 1 375.582 3.115 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCN(c3ccccc3OC)C2)[C@H](C)C1 ZINC000133299805 1416876274 /nfs/dbraw/zinc/87/62/74/1416876274.db2.gz QYJBREWXOFHQHG-HKBOAZHASA-N 2 1 389.584 3.248 20 0 GGADMP O=C(C[C@H]1CSCC[NH2+]1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000133346132 1416881159 /nfs/dbraw/zinc/88/11/59/1416881159.db2.gz QFFLPKZYAACLLD-NRFANRHFSA-N 2 1 395.572 3.015 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000133423312 1416888607 /nfs/dbraw/zinc/88/86/07/1416888607.db2.gz ZFMQNMWOPPYGFW-GCJKJVERSA-N 2 1 399.583 3.171 20 0 GGADMP Cc1c(C(=O)NC[C@H]2CCC[N@@H+]2CC2CCCCC2)cnn1-c1cc[nH+]cc1 ZINC000133452993 1416891358 /nfs/dbraw/zinc/89/13/58/1416891358.db2.gz FOCDYVMRIVQBAK-HXUWFJFHSA-N 2 1 381.524 3.350 20 0 GGADMP Cc1c(C(=O)NC[C@H]2CCC[N@H+]2CC2CCCCC2)cnn1-c1cc[nH+]cc1 ZINC000133452993 1416891359 /nfs/dbraw/zinc/89/13/59/1416891359.db2.gz FOCDYVMRIVQBAK-HXUWFJFHSA-N 2 1 381.524 3.350 20 0 GGADMP C[N@@H+](Cc1ccccc1CNC(=O)C[C@@H]1CSCC[NH2+]1)C1CCCCC1 ZINC000133569177 1416906862 /nfs/dbraw/zinc/90/68/62/1416906862.db2.gz KMJPKFXXWKJKMZ-LJQANCHMSA-N 2 1 375.582 3.162 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1 ZINC000178698410 1429144526 /nfs/dbraw/zinc/14/45/26/1429144526.db2.gz GJCVEPHZTLWAMG-IRXDYDNUSA-N 2 1 392.569 3.209 20 0 GGADMP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2nc3ccccc3s2)CC1 ZINC000178712551 1429148744 /nfs/dbraw/zinc/14/87/44/1429148744.db2.gz FGESVTHJJHTBPF-UHFFFAOYSA-N 2 1 388.581 3.356 20 0 GGADMP Cc1cccc(C2(C[NH2+]Cc3cnc(N4CC[NH+](C)CC4)nc3)CCCC2)c1 ZINC000134270848 1417047891 /nfs/dbraw/zinc/04/78/91/1417047891.db2.gz RMUPKCXWHLPMAK-UHFFFAOYSA-N 2 1 379.552 3.138 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)NCC[NH+]2CCCCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000134506313 1417078268 /nfs/dbraw/zinc/07/82/68/1417078268.db2.gz BHRKNKINWGAQJT-APWZRJJASA-N 2 1 396.938 3.257 20 0 GGADMP CS[C@H]1CCCC[N@H+]([C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000134545361 1417085090 /nfs/dbraw/zinc/08/50/90/1417085090.db2.gz KEDPHPVZERCBKK-NQIIRXRSSA-N 2 1 389.609 3.373 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cccs1 ZINC000178739220 1429157852 /nfs/dbraw/zinc/15/78/52/1429157852.db2.gz VCNPGDCADNWOPN-NJAFHUGGSA-N 2 1 376.570 3.009 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cccs1 ZINC000178739233 1429157879 /nfs/dbraw/zinc/15/78/79/1429157879.db2.gz VCNPGDCADNWOPN-BPQIPLTHSA-N 2 1 376.570 3.009 20 0 GGADMP O[C@@H](COCc1ccccc1Cl)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134879742 1417138756 /nfs/dbraw/zinc/13/87/56/1417138756.db2.gz VNAUEJFOJUQDJA-OZOXKJRCSA-N 2 1 378.944 3.166 20 0 GGADMP O[C@@H](COCc1ccccc1Cl)C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134879742 1417138762 /nfs/dbraw/zinc/13/87/62/1417138762.db2.gz VNAUEJFOJUQDJA-OZOXKJRCSA-N 2 1 378.944 3.166 20 0 GGADMP O[C@@H](COCc1ccccc1Cl)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134879742 1417138768 /nfs/dbraw/zinc/13/87/68/1417138768.db2.gz VNAUEJFOJUQDJA-OZOXKJRCSA-N 2 1 378.944 3.166 20 0 GGADMP C[C@H](C(=O)Nc1cccc(OCCC[NH+](C)C)c1)[N@@H+]1CCc2ccccc2C1 ZINC000134910612 1417143059 /nfs/dbraw/zinc/14/30/59/1417143059.db2.gz FQDKXEYEVYFUKN-GOSISDBHSA-N 2 1 381.520 3.402 20 0 GGADMP C[C@H](C(=O)Nc1cccc(OCCC[NH+](C)C)c1)[N@H+]1CCc2ccccc2C1 ZINC000134910612 1417143063 /nfs/dbraw/zinc/14/30/63/1417143063.db2.gz FQDKXEYEVYFUKN-GOSISDBHSA-N 2 1 381.520 3.402 20 0 GGADMP O[C@H](C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)c1ccc(Br)cc1 ZINC000134926544 1417146373 /nfs/dbraw/zinc/14/63/73/1417146373.db2.gz YNQDFBUKRNBQCB-ATZDWAIDSA-N 2 1 379.342 3.431 20 0 GGADMP O[C@H](C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1ccc(Br)cc1 ZINC000134926544 1417146375 /nfs/dbraw/zinc/14/63/75/1417146375.db2.gz YNQDFBUKRNBQCB-ATZDWAIDSA-N 2 1 379.342 3.431 20 0 GGADMP O[C@H](C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccc(Br)cc1 ZINC000134926544 1417146376 /nfs/dbraw/zinc/14/63/76/1417146376.db2.gz YNQDFBUKRNBQCB-ATZDWAIDSA-N 2 1 379.342 3.431 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccc(C[NH+](C)C)c(F)c1)[N@H+]1CCc2ccccc2C1 ZINC000134994279 1417158183 /nfs/dbraw/zinc/15/81/83/1417158183.db2.gz UJQXDFBPUQRLIN-KRWDZBQOSA-N 2 1 398.526 3.133 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C1 ZINC000135131128 1417175748 /nfs/dbraw/zinc/17/57/48/1417175748.db2.gz ZDBCBUWGNCPASJ-CALCHBBNSA-N 2 1 378.536 3.055 20 0 GGADMP C[N@@H+](Cc1ncc(Br)cc1Br)C1CCC([NH3+])CC1 ZINC000135330069 1417208513 /nfs/dbraw/zinc/20/85/13/1417208513.db2.gz FMQWNFTXWSDCLH-UHFFFAOYSA-N 2 1 377.124 3.308 20 0 GGADMP C[N@H+](Cc1ncc(Br)cc1Br)C1CCC([NH3+])CC1 ZINC000135330069 1417208506 /nfs/dbraw/zinc/20/85/06/1417208506.db2.gz FMQWNFTXWSDCLH-UHFFFAOYSA-N 2 1 377.124 3.308 20 0 GGADMP CC[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000135603017 1417243945 /nfs/dbraw/zinc/24/39/45/1417243945.db2.gz JDOLHMDSUSOOOD-HNAYVOBHSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC(NC(=O)NC[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000135603043 1417244456 /nfs/dbraw/zinc/24/44/56/1417244456.db2.gz JDOLHMDSUSOOOD-DNVCBOLYSA-N 2 1 396.938 3.255 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)[NH+](C)C1CC1 ZINC000135653204 1417253985 /nfs/dbraw/zinc/25/39/85/1417253985.db2.gz AWYPVXYCHJLCEE-FRIZHTMISA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1)[N@H+](C)C1CC1 ZINC000135653204 1417254001 /nfs/dbraw/zinc/25/40/01/1417254001.db2.gz AWYPVXYCHJLCEE-FRIZHTMISA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1)[N@@H+](C)C1CC1 ZINC000135653204 1417254011 /nfs/dbraw/zinc/25/40/11/1417254011.db2.gz AWYPVXYCHJLCEE-FRIZHTMISA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)C[NH+](C)[C@@H]1CCSC1 ZINC000136073514 1417290218 /nfs/dbraw/zinc/29/02/18/1417290218.db2.gz WOXCGNOZFQMIIL-FXAWDEMLSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)C[N@H+](C)[C@@H]1CCSC1 ZINC000136073514 1417290222 /nfs/dbraw/zinc/29/02/22/1417290222.db2.gz WOXCGNOZFQMIIL-FXAWDEMLSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000136073514 1417290228 /nfs/dbraw/zinc/29/02/28/1417290228.db2.gz WOXCGNOZFQMIIL-FXAWDEMLSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)C[NH+](C)[C@@H]1CCSC1 ZINC000136073476 1417290606 /nfs/dbraw/zinc/29/06/06/1417290606.db2.gz WOXCGNOZFQMIIL-YLJYHZDGSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)C[N@H+](C)[C@@H]1CCSC1 ZINC000136073476 1417290612 /nfs/dbraw/zinc/29/06/12/1417290612.db2.gz WOXCGNOZFQMIIL-YLJYHZDGSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000136073476 1417290617 /nfs/dbraw/zinc/29/06/17/1417290617.db2.gz WOXCGNOZFQMIIL-YLJYHZDGSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C[N@H+]1Cc1ccccc1 ZINC000136170221 1417297525 /nfs/dbraw/zinc/29/75/25/1417297525.db2.gz ZKGLRXRXWLJATD-UTKZUKDTSA-N 2 1 398.526 3.350 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NC[C@H](c3ccccc3)[NH+]3CCCC3)CC2)c1 ZINC000136187251 1417299188 /nfs/dbraw/zinc/29/91/88/1417299188.db2.gz HVTJOUZZJYAYBE-OAQYLSRUSA-N 2 1 393.535 3.059 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1F ZINC000136242722 1417304450 /nfs/dbraw/zinc/30/44/50/1417304450.db2.gz ZXBOWWNMUICKFC-NQIIRXRSSA-N 2 1 388.531 3.046 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)CC[C@@H]21 ZINC000136376160 1417312387 /nfs/dbraw/zinc/31/23/87/1417312387.db2.gz FFDYWEHTGVGFNE-BZSNNMDCSA-N 2 1 376.570 3.011 20 0 GGADMP C[C@H](CCc1ccc(O)cc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000136415576 1417314838 /nfs/dbraw/zinc/31/48/38/1417314838.db2.gz SWWMBUASJXQHAW-GCJKJVERSA-N 2 1 395.547 3.200 20 0 GGADMP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc(F)c(Br)c2)CC1 ZINC000136565320 1417326979 /nfs/dbraw/zinc/32/69/79/1417326979.db2.gz ISIMKFDCEVUCNF-ZWKOTPCHSA-N 2 1 385.321 3.446 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1OC(F)F ZINC000136576614 1417328052 /nfs/dbraw/zinc/32/80/52/1417328052.db2.gz JNKCQLDVYMFKTF-DLBZAZTESA-N 2 1 384.467 3.154 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)CC1 ZINC000136745273 1417343238 /nfs/dbraw/zinc/34/32/38/1417343238.db2.gz YZHAURPYADVYRF-UNMCSNQZSA-N 2 1 384.568 3.085 20 0 GGADMP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)c1 ZINC000136781489 1417345854 /nfs/dbraw/zinc/34/58/54/1417345854.db2.gz WEEQVAUBERTQSA-UHFFFAOYSA-N 2 1 395.551 3.264 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000139375011 1417457416 /nfs/dbraw/zinc/45/74/16/1417457416.db2.gz PKANFCPJKCQPTL-UHFFFAOYSA-N 2 1 375.476 3.102 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000139900094 1417479374 /nfs/dbraw/zinc/47/93/74/1417479374.db2.gz QCFSBNPYIJXOIU-UHFFFAOYSA-N 2 1 376.570 3.230 20 0 GGADMP C[C@@H]([NH3+])C1CCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000178850961 1429194803 /nfs/dbraw/zinc/19/48/03/1429194803.db2.gz ALEDAURMKTVLSV-DNVCBOLYSA-N 2 1 383.458 3.027 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)o1 ZINC000144081787 1417656002 /nfs/dbraw/zinc/65/60/02/1417656002.db2.gz RRHQWJBTBJGDKK-GOSISDBHSA-N 2 1 399.535 3.272 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)o1 ZINC000144081787 1417656017 /nfs/dbraw/zinc/65/60/17/1417656017.db2.gz RRHQWJBTBJGDKK-GOSISDBHSA-N 2 1 399.535 3.272 20 0 GGADMP C[C@@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000145590937 1417693367 /nfs/dbraw/zinc/69/33/67/1417693367.db2.gz HZMZKXMQDSEOKU-OALUTQOASA-N 2 1 388.625 3.236 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000148874042 1417768738 /nfs/dbraw/zinc/76/87/38/1417768738.db2.gz PMYYTLFWESFLDT-GOSISDBHSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000150756904 1417800698 /nfs/dbraw/zinc/80/06/98/1417800698.db2.gz AMCGHSIBOGLFTQ-NRFANRHFSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000150759917 1417801774 /nfs/dbraw/zinc/80/17/74/1417801774.db2.gz RNCTWHXBFNLSJC-NRFANRHFSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C1 ZINC000150762540 1417802365 /nfs/dbraw/zinc/80/23/65/1417802365.db2.gz SRHNTUGMGOOWOT-LJQANCHMSA-N 2 1 394.991 3.391 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N(C)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000150764242 1417802588 /nfs/dbraw/zinc/80/25/88/1417802588.db2.gz IIUZWNFMGCPSFZ-FGZHOGPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000150764242 1417802590 /nfs/dbraw/zinc/80/25/90/1417802590.db2.gz IIUZWNFMGCPSFZ-FGZHOGPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000150764242 1417802593 /nfs/dbraw/zinc/80/25/93/1417802593.db2.gz IIUZWNFMGCPSFZ-FGZHOGPDSA-N 2 1 386.584 3.270 20 0 GGADMP Cc1cccn2cc(C[NH2+]Cc3ccccc3N(C)C3CC[NH+](C)CC3)nc12 ZINC000150952665 1417842712 /nfs/dbraw/zinc/84/27/12/1417842712.db2.gz PECAPHQQSYKZQL-UHFFFAOYSA-N 2 1 377.536 3.463 20 0 GGADMP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2csc(C(C)C)n2)CC1 ZINC000151004489 1417853535 /nfs/dbraw/zinc/85/35/35/1417853535.db2.gz HISAAPSPLAIPJY-UHFFFAOYSA-N 2 1 380.602 3.327 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)C1 ZINC000151105770 1417873149 /nfs/dbraw/zinc/87/31/49/1417873149.db2.gz WXBQYRNEVNYWCF-ROUUACIJSA-N 2 1 381.586 3.100 20 0 GGADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(S(=O)(=O)C(F)F)c(OC)c2)C1 ZINC000151122127 1417876604 /nfs/dbraw/zinc/87/66/04/1417876604.db2.gz KWEHQAOHUQEYJS-KBPBESRZSA-N 2 1 390.496 3.074 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(S(=O)(=O)C(F)F)c(OC)c2)C1 ZINC000151122127 1417876607 /nfs/dbraw/zinc/87/66/07/1417876607.db2.gz KWEHQAOHUQEYJS-KBPBESRZSA-N 2 1 390.496 3.074 20 0 GGADMP Cc1cccn2c(=O)cc(C[NH+]3CCC(CC[N@@H+]4CCCC[C@@H]4C)CC3)nc12 ZINC000151148160 1417882463 /nfs/dbraw/zinc/88/24/63/1417882463.db2.gz VBHKCODXJLYABF-IBGZPJMESA-N 2 1 382.552 3.479 20 0 GGADMP Cc1ccc(N2CCC(C(=O)Nc3ccc(C)cc3OCC[NH+](C)C)CC2)[nH+]c1 ZINC000151318931 1417925139 /nfs/dbraw/zinc/92/51/39/1417925139.db2.gz JPDWKIRMUHUKFA-UHFFFAOYSA-N 2 1 396.535 3.494 20 0 GGADMP CC[NH+]1CCC(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000151424376 1417962412 /nfs/dbraw/zinc/96/24/12/1417962412.db2.gz COOLWBDBEUXYPP-RBBKRZOGSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3csc(N(C)C4CC4)n3)CC2)C[C@@H](C)O1 ZINC000151527762 1418014497 /nfs/dbraw/zinc/01/44/97/1418014497.db2.gz GIPJAQWPHXGHSH-IAGOWNOFSA-N 2 1 392.613 3.453 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1)C[NH+]1CCCC1 ZINC000151555321 1418023177 /nfs/dbraw/zinc/02/31/77/1418023177.db2.gz QDEODDGWYFNWRY-MZYLBHOOSA-N 2 1 398.595 3.414 20 0 GGADMP C[C@H]1CCN(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)C[C@H]1n1ccnc1 ZINC000151650248 1418050023 /nfs/dbraw/zinc/05/00/23/1418050023.db2.gz WKVSQCDWSZFTMW-GBESFXJTSA-N 2 1 385.512 3.296 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)ccc1OCCO ZINC000151657823 1418052637 /nfs/dbraw/zinc/05/26/37/1418052637.db2.gz SUZWZPWOFUBCRH-LJQANCHMSA-N 2 1 398.547 3.424 20 0 GGADMP C[NH+]1CCC(CCNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000151686948 1418061089 /nfs/dbraw/zinc/06/10/89/1418061089.db2.gz SUKIFMQYJHYGLL-PKTZIBPZSA-N 2 1 398.595 3.414 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(Cl)nc1 ZINC000179123660 1429269557 /nfs/dbraw/zinc/26/95/57/1429269557.db2.gz LZFOSUABJNRBRM-KXBFYZLASA-N 2 1 386.927 3.283 20 0 GGADMP Cc1cccc(OC[C@@H](O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000179389687 1429354625 /nfs/dbraw/zinc/35/46/25/1429354625.db2.gz FSNBWPZAMLOQEK-QFIPXVFZSA-N 2 1 383.536 3.368 20 0 GGADMP Cc1cccc(OC[C@H](O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000179389676 1429354888 /nfs/dbraw/zinc/35/48/88/1429354888.db2.gz FSNBWPZAMLOQEK-JOCHJYFZSA-N 2 1 383.536 3.368 20 0 GGADMP C[C@@H](c1nnnn1-c1ccccc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179392512 1429356001 /nfs/dbraw/zinc/35/60/01/1429356001.db2.gz LPLKFAYOOOIXOI-SFHVURJKSA-N 2 1 391.523 3.357 20 0 GGADMP C[C@@H](c1nnnn1-c1ccccc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179392512 1429356008 /nfs/dbraw/zinc/35/60/08/1429356008.db2.gz LPLKFAYOOOIXOI-SFHVURJKSA-N 2 1 391.523 3.357 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H](O)COCc1cccs1 ZINC000179394226 1429357305 /nfs/dbraw/zinc/35/73/05/1429357305.db2.gz ZDAKIXNGIXZATC-HXUWFJFHSA-N 2 1 389.565 3.259 20 0 GGADMP CN(Cc1ccc(F)cc1)C(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179394145 1429357488 /nfs/dbraw/zinc/35/74/88/1429357488.db2.gz CYQAXGMUUXMOAD-UHFFFAOYSA-N 2 1 398.526 3.418 20 0 GGADMP COc1cccc(NC(=O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000179394594 1429357629 /nfs/dbraw/zinc/35/76/29/1429357629.db2.gz CJFDJPBVHKETSP-UHFFFAOYSA-N 2 1 382.508 3.267 20 0 GGADMP CC(=O)c1cccc(NC(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000179396255 1429358111 /nfs/dbraw/zinc/35/81/11/1429358111.db2.gz FFLOVWKQFMBCHR-UHFFFAOYSA-N 2 1 394.519 3.461 20 0 GGADMP CC(=O)c1cccc(NC(=O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000179396255 1429358119 /nfs/dbraw/zinc/35/81/19/1429358119.db2.gz FFLOVWKQFMBCHR-UHFFFAOYSA-N 2 1 394.519 3.461 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1 ZINC000179398878 1429358896 /nfs/dbraw/zinc/35/88/96/1429358896.db2.gz AGZFFHMUICRBSR-UHFFFAOYSA-N 2 1 384.480 3.051 20 0 GGADMP Cc1cc2ncc([C@@H](C)[NH2+]C3CCN(c4cc(C)[nH+]c(C)n4)CC3)c(C)n2n1 ZINC000179443665 1429378466 /nfs/dbraw/zinc/37/84/66/1429378466.db2.gz STRHPFKGXXUPIN-OAHLLOKOSA-N 2 1 379.512 3.073 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3F)C2=O)[C@H](C)C1 ZINC000179498496 1429396525 /nfs/dbraw/zinc/39/65/25/1429396525.db2.gz COFVDUQPJGOAQC-YZGWKJHDSA-N 2 1 391.531 3.048 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3F)C2=O)[C@H](C)C1 ZINC000179498496 1429396530 /nfs/dbraw/zinc/39/65/30/1429396530.db2.gz COFVDUQPJGOAQC-YZGWKJHDSA-N 2 1 391.531 3.048 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000179556916 1429431170 /nfs/dbraw/zinc/43/11/70/1429431170.db2.gz SSPDQAZHGGNCFY-JOCHJYFZSA-N 2 1 396.510 3.218 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000179556916 1429431179 /nfs/dbraw/zinc/43/11/79/1429431179.db2.gz SSPDQAZHGGNCFY-JOCHJYFZSA-N 2 1 396.510 3.218 20 0 GGADMP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000179555633 1429430057 /nfs/dbraw/zinc/43/00/57/1429430057.db2.gz AVBLVYUWYRPDCQ-JOCHJYFZSA-N 2 1 392.547 3.326 20 0 GGADMP CCC[C@H]1CN(C(=O)CCCC[NH+]2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000179660514 1429495580 /nfs/dbraw/zinc/49/55/80/1429495580.db2.gz CACGVVDJOQBSNE-QFIPXVFZSA-N 2 1 387.568 3.002 20 0 GGADMP CCC[C@H]1CN(C(=O)CCCC[NH+]2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000179660514 1429495584 /nfs/dbraw/zinc/49/55/84/1429495584.db2.gz CACGVVDJOQBSNE-QFIPXVFZSA-N 2 1 387.568 3.002 20 0 GGADMP COc1cccc(C[N@H+](C)C2CCN(Cc3[nH+]cc(C)c(OC)c3C)CC2)n1 ZINC000179658620 1429494068 /nfs/dbraw/zinc/49/40/68/1429494068.db2.gz YHFANCOUSLSBQI-UHFFFAOYSA-N 2 1 384.524 3.207 20 0 GGADMP COc1cccc(C[N@@H+](C)C2CCN(Cc3[nH+]cc(C)c(OC)c3C)CC2)n1 ZINC000179658620 1429494070 /nfs/dbraw/zinc/49/40/70/1429494070.db2.gz YHFANCOUSLSBQI-UHFFFAOYSA-N 2 1 384.524 3.207 20 0 GGADMP CC(C)(C)CC(=O)N1CCC([NH2+]CC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC000152319111 1422071187 /nfs/dbraw/zinc/07/11/87/1422071187.db2.gz KUKHZLANUAWRFN-UHFFFAOYSA-N 2 1 379.589 3.038 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@]2([NH+](C)C)CCC[C@H](C)C2)C1 ZINC000152423592 1422099296 /nfs/dbraw/zinc/09/92/96/1422099296.db2.gz HFMQZSSJMRBNGA-UEXGIBASSA-N 2 1 375.561 3.303 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@@]2([NH+](C)C)CCC[C@H](C)C2)C1 ZINC000152423749 1422099397 /nfs/dbraw/zinc/09/93/97/1422099397.db2.gz HFMQZSSJMRBNGA-WAOWUJCRSA-N 2 1 375.561 3.303 20 0 GGADMP Cc1c(C(=O)NCc2cccc(C[N@H+](C)C(C)C)c2)cnn1-c1ccncc1 ZINC000152656387 1422192071 /nfs/dbraw/zinc/19/20/71/1422192071.db2.gz FZQGRMHSBXBGRQ-UHFFFAOYSA-N 2 1 377.492 3.346 20 0 GGADMP Cc1c(C(=O)NCc2cccc(C[N@@H+](C)C(C)C)c2)cnn1-c1cc[nH+]cc1 ZINC000152656387 1422192073 /nfs/dbraw/zinc/19/20/73/1422192073.db2.gz FZQGRMHSBXBGRQ-UHFFFAOYSA-N 2 1 377.492 3.346 20 0 GGADMP Cc1c(C(=O)NCc2cccc(C[N@H+](C)C(C)C)c2)cnn1-c1cc[nH+]cc1 ZINC000152656387 1422192074 /nfs/dbraw/zinc/19/20/74/1422192074.db2.gz FZQGRMHSBXBGRQ-UHFFFAOYSA-N 2 1 377.492 3.346 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000152690408 1422210572 /nfs/dbraw/zinc/21/05/72/1422210572.db2.gz AUERYSKNGUFWBY-QNGMFEMESA-N 2 1 378.605 3.403 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000152690296 1422210911 /nfs/dbraw/zinc/21/09/11/1422210911.db2.gz AUERYSKNGUFWBY-MWXLCCTBSA-N 2 1 378.605 3.403 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N3CC[C@@H]4[C@@H](CCC[N@H+]4C)C3)CC2)CC1 ZINC000152745998 1422234288 /nfs/dbraw/zinc/23/42/88/1422234288.db2.gz OJQLLWVABAYIHE-GKYDQMIMSA-N 2 1 376.589 3.155 20 0 GGADMP Cc1c(C(=O)Nc2ccc3ccn(CC[NH+](C)C)c3c2)cnn1-c1cc[nH+]cc1 ZINC000152898065 1422288239 /nfs/dbraw/zinc/28/82/39/1422288239.db2.gz XDHRTCXDNGFFFW-UHFFFAOYSA-N 2 1 388.475 3.344 20 0 GGADMP Cn1cc[nH+]c1CC1CC[NH+](C[C@@H](O)Cc2ccccc2C(F)(F)F)CC1 ZINC000152951883 1422305838 /nfs/dbraw/zinc/30/58/38/1422305838.db2.gz DNXGIMJYHMOBMF-KRWDZBQOSA-N 2 1 381.442 3.297 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cc(C)nc(-c4ccc(Cl)cc4)n3)C2)CC1 ZINC000153146240 1422371202 /nfs/dbraw/zinc/37/12/02/1422371202.db2.gz DPOQUAAMUZLJQS-OAQYLSRUSA-N 2 1 399.970 3.317 20 0 GGADMP CCCN(CC[NH+](CC)CC)C(=O)NC1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000153146072 1422371566 /nfs/dbraw/zinc/37/15/66/1422371566.db2.gz WGUJXEKXLWMRCC-UHFFFAOYSA-N 2 1 375.561 3.122 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCN(CC(F)(F)F)CC3)c2)CCO1 ZINC000153462501 1422549915 /nfs/dbraw/zinc/54/99/15/1422549915.db2.gz GVCMZJRNYHWTTN-MRXNPFEDSA-N 2 1 385.474 3.024 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCN(CC(F)(F)F)CC3)c2)CCO1 ZINC000153462501 1422549932 /nfs/dbraw/zinc/54/99/32/1422549932.db2.gz GVCMZJRNYHWTTN-MRXNPFEDSA-N 2 1 385.474 3.024 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1)c1ccc(-n2cncn2)cc1 ZINC000153502444 1422574519 /nfs/dbraw/zinc/57/45/19/1422574519.db2.gz UNJBYMWACTWWOT-MOPGFXCFSA-N 2 1 391.519 3.339 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1)c1ccc(-n2cncn2)cc1 ZINC000153502444 1422574536 /nfs/dbraw/zinc/57/45/36/1422574536.db2.gz UNJBYMWACTWWOT-MOPGFXCFSA-N 2 1 391.519 3.339 20 0 GGADMP CN(CC[NH+]1CCCC1)C(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000153574987 1422628030 /nfs/dbraw/zinc/62/80/30/1422628030.db2.gz ZZYWGJLJCOTDPF-LPHOPBHVSA-N 2 1 396.938 3.209 20 0 GGADMP CC(C)[NH+]1CCC(C(=O)Nc2ccnn2[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000153652014 1422680498 /nfs/dbraw/zinc/68/04/98/1422680498.db2.gz VDUZJUOONSDVCT-OAQYLSRUSA-N 2 1 395.551 3.389 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(-n3cnnn3)cc2)cc1F ZINC000153728672 1422726273 /nfs/dbraw/zinc/72/62/73/1422726273.db2.gz RIOWOGNEZOVNON-AWEZNQCLSA-N 2 1 377.427 3.146 20 0 GGADMP CC(C)[NH+]1CCC(C(=O)N[C@@H]2CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)CC1 ZINC000153961038 1422817412 /nfs/dbraw/zinc/81/74/12/1422817412.db2.gz DKWBKFLVUBSTEB-LJQANCHMSA-N 2 1 393.959 3.247 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2cc(Cl)c(OC)cc2OC)CC1 ZINC000154530537 1422906312 /nfs/dbraw/zinc/90/63/12/1422906312.db2.gz BPDARNFGRWLNBV-MRXNPFEDSA-N 2 1 383.964 3.426 20 0 GGADMP COc1ccccc1COC[C@@H](O)C[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000154736578 1423016591 /nfs/dbraw/zinc/01/65/91/1423016591.db2.gz GNXLLESVOBTQCL-IRLDBZIGSA-N 2 1 390.568 3.017 20 0 GGADMP COc1cccc(COC[C@@H](O)C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000154736813 1423016631 /nfs/dbraw/zinc/01/66/31/1423016631.db2.gz KZJOGOLZKWKSDQ-YADHBBJMSA-N 2 1 390.568 3.017 20 0 GGADMP COc1ccccc1COC[C@@H](O)C[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000154736468 1423016656 /nfs/dbraw/zinc/01/66/56/1423016656.db2.gz GNXLLESVOBTQCL-UNMCSNQZSA-N 2 1 390.568 3.017 20 0 GGADMP CNS(=O)(=O)c1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000154864884 1423060273 /nfs/dbraw/zinc/06/02/73/1423060273.db2.gz LTWUPQJLHBQWLZ-KRWDZBQOSA-N 2 1 389.565 3.286 20 0 GGADMP CNS(=O)(=O)c1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000154864989 1423060313 /nfs/dbraw/zinc/06/03/13/1423060313.db2.gz LTWUPQJLHBQWLZ-QGZVFWFLSA-N 2 1 389.565 3.286 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)[C@@H]1C[NH+](C)CCO1 ZINC000155013280 1423114961 /nfs/dbraw/zinc/11/49/61/1423114961.db2.gz UBLFWBYXCUYAID-UWJYYQICSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[N@@H+](C)C1CCCCC1)[C@@H]1C[NH+](C)CCO1 ZINC000155013280 1423114965 /nfs/dbraw/zinc/11/49/65/1423114965.db2.gz UBLFWBYXCUYAID-UWJYYQICSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@@H]1C[N@H+](C)CCO1 ZINC000155013280 1423114972 /nfs/dbraw/zinc/11/49/72/1423114972.db2.gz UBLFWBYXCUYAID-UWJYYQICSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@H](NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@@H]1C[N@@H+](C)CCO1 ZINC000155013280 1423114976 /nfs/dbraw/zinc/11/49/76/1423114976.db2.gz UBLFWBYXCUYAID-UWJYYQICSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC000155619216 1423450147 /nfs/dbraw/zinc/45/01/47/1423450147.db2.gz CGVUYZOKSYEPQE-ICSRJNTNSA-N 2 1 384.568 3.378 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC000155618975 1423450184 /nfs/dbraw/zinc/45/01/84/1423450184.db2.gz CGVUYZOKSYEPQE-AZUAARDMSA-N 2 1 384.568 3.378 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000155662838 1423474090 /nfs/dbraw/zinc/47/40/90/1423474090.db2.gz RQNRNHAGHOFOMC-XXBNENTESA-N 2 1 392.547 3.388 20 0 GGADMP C[N@@H+](CC(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1)[C@@H]1CCSC1 ZINC000155666662 1423475946 /nfs/dbraw/zinc/47/59/46/1423475946.db2.gz USYNOOJSCNLMLF-GOSISDBHSA-N 2 1 396.000 3.106 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)c1ccccc1 ZINC000155672740 1423480069 /nfs/dbraw/zinc/48/00/69/1423480069.db2.gz MYCJKPSOONNQGZ-PGRDOPGGSA-N 2 1 380.536 3.416 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](CCCC(=O)Nc3c(C)cc(C)cc3C)C2)CC1 ZINC000155684294 1423485948 /nfs/dbraw/zinc/48/59/48/1423485948.db2.gz VWTWFRJXDKRPAD-OAQYLSRUSA-N 2 1 386.584 3.042 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCN1CCN(c2cccc(Cl)c2)CC1 ZINC000155700301 1423494355 /nfs/dbraw/zinc/49/43/55/1423494355.db2.gz FWZWWJUSJFZVJW-LVCYWYKZSA-N 2 1 378.992 3.170 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)c3cccc(C[NH+](C)C)c3)cc2)C[C@H](C)O1 ZINC000155725393 1423505391 /nfs/dbraw/zinc/50/53/91/1423505391.db2.gz QQAAKGYOJFRMLP-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP CC[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cc(Br)ccc1O ZINC000155774114 1423528674 /nfs/dbraw/zinc/52/86/74/1423528674.db2.gz YSKNEYKVJDIKPE-WBVHZDCISA-N 2 1 385.346 3.432 20 0 GGADMP C[N@@H+](CC(=O)NCc1ccccc1C[NH+]1CCCCCC1)[C@H]1CCSC1 ZINC000155860465 1423565527 /nfs/dbraw/zinc/56/55/27/1423565527.db2.gz VVXZJIPKKWDUQH-FQEVSTJZSA-N 2 1 375.582 3.116 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]C[C@H](C)[N@@H+]2CCC[C@@H](C)C2)c(OC)c1 ZINC000155949338 1423605964 /nfs/dbraw/zinc/60/59/64/1423605964.db2.gz LGOFVAOHPZGFNF-IKGGRYGDSA-N 2 1 377.529 3.131 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]C[C@H](C)[N@H+]2CCC[C@@H](C)C2)c(OC)c1 ZINC000155949338 1423605979 /nfs/dbraw/zinc/60/59/79/1423605979.db2.gz LGOFVAOHPZGFNF-IKGGRYGDSA-N 2 1 377.529 3.131 20 0 GGADMP C[C@H]1CCCC[N@@H+]1Cc1ccc(NCc2cnc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000156089753 1423667511 /nfs/dbraw/zinc/66/75/11/1423667511.db2.gz IKBYEJCUAJETOO-IBGZPJMESA-N 2 1 394.567 3.215 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(NCc2cnc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000156089753 1423667515 /nfs/dbraw/zinc/66/75/15/1423667515.db2.gz IKBYEJCUAJETOO-IBGZPJMESA-N 2 1 394.567 3.215 20 0 GGADMP C[C@@H]1CCC[N@H+](Cc2ccc(NCc3cnc(N4CC[NH+](C)CC4)nc3)cc2)C1 ZINC000156105144 1423674689 /nfs/dbraw/zinc/67/46/89/1423674689.db2.gz PHCFSZJSTVBPLK-LJQANCHMSA-N 2 1 394.567 3.072 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(NCc3cnc(N4CC[NH+](C)CC4)nc3)cc2)C1 ZINC000156105144 1423674700 /nfs/dbraw/zinc/67/47/00/1423674700.db2.gz PHCFSZJSTVBPLK-LJQANCHMSA-N 2 1 394.567 3.072 20 0 GGADMP CC1CC[NH+](CCNC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000156333041 1423785041 /nfs/dbraw/zinc/78/50/41/1423785041.db2.gz UAKUWUTXKKRGJZ-IRLDBZIGSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)N(C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000156337442 1423787866 /nfs/dbraw/zinc/78/78/66/1423787866.db2.gz STPXEFOSJUHGPP-KCZVDYSFSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000156337442 1423787878 /nfs/dbraw/zinc/78/78/78/1423787878.db2.gz STPXEFOSJUHGPP-KCZVDYSFSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000156337442 1423787890 /nfs/dbraw/zinc/78/78/90/1423787890.db2.gz STPXEFOSJUHGPP-KCZVDYSFSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1cccc(S(=O)(=O)CCC[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000156473819 1423815230 /nfs/dbraw/zinc/81/52/30/1423815230.db2.gz DPYPQULWZPBNDJ-MOPGFXCFSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1cccc(S(=O)(=O)CCC[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000156473819 1423815233 /nfs/dbraw/zinc/81/52/33/1423815233.db2.gz DPYPQULWZPBNDJ-MOPGFXCFSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nc(C)[nH+]1 ZINC000156595732 1423834000 /nfs/dbraw/zinc/83/40/00/1423834000.db2.gz WUCRWGMATYOJQP-SFHVURJKSA-N 2 1 389.544 3.051 20 0 GGADMP CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]CC2([NH+]3CCCCC3)CCOCC2)C1 ZINC000156670845 1423844783 /nfs/dbraw/zinc/84/47/83/1423844783.db2.gz ZQMREJCGVLPOMB-SFHVURJKSA-N 2 1 381.561 3.011 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000156785196 1423864398 /nfs/dbraw/zinc/86/43/98/1423864398.db2.gz BQBDMDYMMWDMGG-UGKGYDQZSA-N 2 1 384.568 3.093 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000156815386 1423869332 /nfs/dbraw/zinc/86/93/32/1423869332.db2.gz TZYMBBITQKCWLI-VXKWHMMOSA-N 2 1 380.536 3.485 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000156815386 1423869334 /nfs/dbraw/zinc/86/93/34/1423869334.db2.gz TZYMBBITQKCWLI-VXKWHMMOSA-N 2 1 380.536 3.485 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H](Cc3ccccc3)C3CC3)c2)C1 ZINC000156891716 1423881443 /nfs/dbraw/zinc/88/14/43/1423881443.db2.gz ODMHNXQHLRSAKT-BJKOFHAPSA-N 2 1 391.559 3.495 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H](Cc3ccccc3)C3CC3)c2)C1 ZINC000156891597 1423881560 /nfs/dbraw/zinc/88/15/60/1423881560.db2.gz ODMHNXQHLRSAKT-ZEQRLZLVSA-N 2 1 391.559 3.495 20 0 GGADMP COc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c1)CC2 ZINC000156906917 1423883677 /nfs/dbraw/zinc/88/36/77/1423883677.db2.gz LEXPZHGVMGDJJZ-REWPJTCUSA-N 2 1 393.531 3.170 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1F ZINC000156905967 1423883691 /nfs/dbraw/zinc/88/36/91/1423883691.db2.gz OTAHMXLMVZJFFK-JXFKEZNVSA-N 2 1 399.510 3.382 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1F ZINC000156906102 1423883787 /nfs/dbraw/zinc/88/37/87/1423883787.db2.gz OTAHMXLMVZJFFK-UZLBHIALSA-N 2 1 399.510 3.382 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccnc1Cl ZINC000156909908 1423884373 /nfs/dbraw/zinc/88/43/73/1423884373.db2.gz KLEVFWYFIJWWRD-QAPCUYQASA-N 2 1 386.927 3.283 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccnc1Cl ZINC000156909908 1423884374 /nfs/dbraw/zinc/88/43/74/1423884374.db2.gz KLEVFWYFIJWWRD-QAPCUYQASA-N 2 1 386.927 3.283 20 0 GGADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156911512 1423884774 /nfs/dbraw/zinc/88/47/74/1423884774.db2.gz FWVLCBNMXSOIPA-FRGLQRNOSA-N 2 1 377.532 3.407 20 0 GGADMP C[C@H](CSC(C)(C)C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156920665 1423885779 /nfs/dbraw/zinc/88/57/79/1423885779.db2.gz XHWBOCZWMTVOED-APWZRJJASA-N 2 1 377.598 3.394 20 0 GGADMP C[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C[NH+]1CCCC1 ZINC000157046466 1423910206 /nfs/dbraw/zinc/91/02/06/1423910206.db2.gz CNTAKIWSMLLNGS-RZUBCFFCSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H](CNC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C[NH+]1CCCC1 ZINC000157046755 1423910477 /nfs/dbraw/zinc/91/04/77/1423910477.db2.gz CNTAKIWSMLLNGS-URVUXULASA-N 2 1 386.584 3.413 20 0 GGADMP c1ccc(-c2nnn(CCCCC[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)n2)cc1 ZINC000157375726 1423998026 /nfs/dbraw/zinc/99/80/26/1423998026.db2.gz FPZRXXOUTBARIE-OAQYLSRUSA-N 2 1 382.556 3.461 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1c(C)cc(N(C)C)cc1C ZINC000157379358 1423998918 /nfs/dbraw/zinc/99/89/18/1423998918.db2.gz KAXYPRMVACOSBC-IBGZPJMESA-N 2 1 389.588 3.249 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)CC1 ZINC000157817890 1424094771 /nfs/dbraw/zinc/09/47/71/1424094771.db2.gz ONGFAACYSQYHPL-HXUWFJFHSA-N 2 1 386.584 3.237 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)ccc1S(C)(=O)=O ZINC000157927802 1424121498 /nfs/dbraw/zinc/12/14/98/1424121498.db2.gz OYOWWMMMMXAEBX-SJORKVTESA-N 2 1 382.570 3.261 20 0 GGADMP CC(C)OCC[NH+]1CCC([NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)CC1 ZINC000158020798 1424141593 /nfs/dbraw/zinc/14/15/93/1424141593.db2.gz YKVJUPBQAYWFFM-UHFFFAOYSA-N 2 1 388.600 3.200 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(Cl)c1OC ZINC000158060960 1424153491 /nfs/dbraw/zinc/15/34/91/1424153491.db2.gz FSFHADFZTKFPBR-HNNXBMFYSA-N 2 1 382.936 3.228 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2c(c1)OC(C)(C)O2 ZINC000158069991 1424156641 /nfs/dbraw/zinc/15/66/41/1424156641.db2.gz OQCGSGGKVLPVJX-QGZVFWFLSA-N 2 1 390.528 3.074 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(COC(C)C)c1 ZINC000158071913 1424157301 /nfs/dbraw/zinc/15/73/01/1424157301.db2.gz PDFLRLYYCJGAGE-NRFANRHFSA-N 2 1 390.572 3.491 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(COC(C)C)c1 ZINC000158071777 1424157944 /nfs/dbraw/zinc/15/79/44/1424157944.db2.gz PDFLRLYYCJGAGE-OAQYLSRUSA-N 2 1 390.572 3.491 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1c(C)cccc1OC(F)F ZINC000158177937 1424187724 /nfs/dbraw/zinc/18/77/24/1424187724.db2.gz LLZXJPAJDYWKCD-INIZCTEOSA-N 2 1 398.498 3.476 20 0 GGADMP COc1ccccc1[C@H]1CCC[N@@H+]1CC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000158246072 1424206788 /nfs/dbraw/zinc/20/67/88/1424206788.db2.gz HPDUNJFCNPXWHT-NHCUHLMSSA-N 2 1 381.520 3.251 20 0 GGADMP COc1ccccc1[C@H]1CCC[N@H+]1CC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000158246072 1424206795 /nfs/dbraw/zinc/20/67/95/1424206795.db2.gz HPDUNJFCNPXWHT-NHCUHLMSSA-N 2 1 381.520 3.251 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000158457708 1424260752 /nfs/dbraw/zinc/26/07/52/1424260752.db2.gz ZIVVPSRKDVJALF-AZUAARDMSA-N 2 1 388.556 3.355 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158457436 1424260912 /nfs/dbraw/zinc/26/09/12/1424260912.db2.gz ZIVVPSRKDVJALF-UYAOXDASSA-N 2 1 388.556 3.355 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000159057574 1424407012 /nfs/dbraw/zinc/40/70/12/1424407012.db2.gz HUKVBUICGLLHMS-QFBILLFUSA-N 2 1 389.588 3.340 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000159057574 1424407015 /nfs/dbraw/zinc/40/70/15/1424407015.db2.gz HUKVBUICGLLHMS-QFBILLFUSA-N 2 1 389.588 3.340 20 0 GGADMP C[C@H](C[C@@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000160477165 1424606876 /nfs/dbraw/zinc/60/68/76/1424606876.db2.gz UIKZPJJKXFVSMI-MOPGFXCFSA-N 2 1 397.604 3.381 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)C1CC[NH+](C(C)C)CC1 ZINC000161596938 1424720488 /nfs/dbraw/zinc/72/04/88/1424720488.db2.gz IDQGXVODNRJPFU-OAQYLSRUSA-N 2 1 387.568 3.326 20 0 GGADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1 ZINC000161644413 1424731530 /nfs/dbraw/zinc/73/15/30/1424731530.db2.gz QZWYGGKUJBLNME-GOSISDBHSA-N 2 1 393.597 3.386 20 0 GGADMP COC(C)(C)C[C@H](C)NC(=O)N(C)[C@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000161687003 1424740721 /nfs/dbraw/zinc/74/07/21/1424740721.db2.gz SUJOISHYFNQGEF-IHPCNDPISA-N 2 1 396.620 3.169 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H](C)c3cccc(N4CCOC4=O)c3)CC2)nc(C)[nH+]1 ZINC000162266658 1424832603 /nfs/dbraw/zinc/83/26/03/1424832603.db2.gz PFJZKNDYOXHTGH-INIZCTEOSA-N 2 1 395.507 3.370 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000162512525 1424860801 /nfs/dbraw/zinc/86/08/01/1424860801.db2.gz DRRFJKRMGYTROF-MSOLQXFVSA-N 2 1 378.586 3.162 20 0 GGADMP C[NH+](C)CCOc1cccc(CNC2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000162551236 1424865087 /nfs/dbraw/zinc/86/50/87/1424865087.db2.gz XCXGREHVURQNDY-UHFFFAOYSA-N 2 1 381.564 3.424 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc1)C1CC1 ZINC000162638971 1424874512 /nfs/dbraw/zinc/87/45/12/1424874512.db2.gz HCQVVCKZCIMLSU-UHFFFAOYSA-N 2 1 378.520 3.337 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc1)C1CC1 ZINC000162638971 1424874515 /nfs/dbraw/zinc/87/45/15/1424874515.db2.gz HCQVVCKZCIMLSU-UHFFFAOYSA-N 2 1 378.520 3.337 20 0 GGADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000162745599 1424887433 /nfs/dbraw/zinc/88/74/33/1424887433.db2.gz ARBMFENRHAFLAL-QGZVFWFLSA-N 2 1 375.538 3.231 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]C3CCN(Cc4cccnc4)CC3)CC2)oc1C ZINC000162790777 1424890492 /nfs/dbraw/zinc/89/04/92/1424890492.db2.gz XRLPLFSXPKVLOA-UHFFFAOYSA-N 2 1 397.567 3.153 20 0 GGADMP CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000162841587 1424895707 /nfs/dbraw/zinc/89/57/07/1424895707.db2.gz GQNCKGITMVNAPO-NRFANRHFSA-N 2 1 399.583 3.204 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3CCN(CC(F)(F)F)C3)CC2)cc1 ZINC000163136381 1424948122 /nfs/dbraw/zinc/94/81/22/1424948122.db2.gz WJMUVGCZBHEHKA-KRWDZBQOSA-N 2 1 387.465 3.306 20 0 GGADMP Cn1cc([C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c2cccc(F)c2)cn1 ZINC000180151839 1429764157 /nfs/dbraw/zinc/76/41/57/1429764157.db2.gz KFMASHGYZMCOJZ-JOCHJYFZSA-N 2 1 382.483 3.379 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc(C[NH+](C)C)cc1 ZINC000163789257 1425044053 /nfs/dbraw/zinc/04/40/53/1425044053.db2.gz KDZMWTWSEMNGMQ-AVRDEDQJSA-N 2 1 380.536 3.068 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000163813659 1425047135 /nfs/dbraw/zinc/04/71/35/1425047135.db2.gz KWEIAHOISZKIJG-OAQYLSRUSA-N 2 1 387.572 3.060 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000163957335 1425062199 /nfs/dbraw/zinc/06/21/99/1425062199.db2.gz XZXMNKVCDZTIAM-AVRDEDQJSA-N 2 1 380.536 3.068 20 0 GGADMP CC[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)[C@H]1CCOC1 ZINC000163968528 1425063422 /nfs/dbraw/zinc/06/34/22/1425063422.db2.gz ZMLYIQMNBNCOSJ-UGKGYDQZSA-N 2 1 376.541 3.081 20 0 GGADMP C[N@@H+](CCOc1cccc(C[NH2+]C2Cc3ccccc3C2)c1)C1CCOCC1 ZINC000163966129 1425064068 /nfs/dbraw/zinc/06/40/68/1425064068.db2.gz AQHGFVAXDQMOHR-UHFFFAOYSA-N 2 1 380.532 3.433 20 0 GGADMP O=C(CC1CC[NH2+]CC1)N1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000163994204 1425066348 /nfs/dbraw/zinc/06/63/48/1425066348.db2.gz NKQUTRRXRANPLB-UHFFFAOYSA-N 2 1 383.458 3.129 20 0 GGADMP CCC[NH+]1CCC([NH2+]Cc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)CC1 ZINC000163995702 1425066541 /nfs/dbraw/zinc/06/65/41/1425066541.db2.gz PWBIDICMKGWQLH-GOSISDBHSA-N 2 1 393.597 3.071 20 0 GGADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)CC1 ZINC000164025573 1425069388 /nfs/dbraw/zinc/06/93/88/1425069388.db2.gz NVZYTYAPXOCPBN-SFHVURJKSA-N 2 1 393.597 3.070 20 0 GGADMP CN(C)C(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000180164636 1429776176 /nfs/dbraw/zinc/77/61/76/1429776176.db2.gz KUNALMCVSJDXSO-XQUALCHDSA-N 2 1 391.559 3.186 20 0 GGADMP CN(C)C(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000180164636 1429776192 /nfs/dbraw/zinc/77/61/92/1429776192.db2.gz KUNALMCVSJDXSO-XQUALCHDSA-N 2 1 391.559 3.186 20 0 GGADMP COc1cccc2c1OC[C@H]([NH2+]C1CC[NH+](CCc3ccc(F)cc3)CC1)C2 ZINC000164535332 1425120841 /nfs/dbraw/zinc/12/08/41/1425120841.db2.gz VESODNFXOITYEC-OAQYLSRUSA-N 2 1 384.495 3.435 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)C2([NH3+])Cc3ccccc3C2)cc1 ZINC000164585589 1425126395 /nfs/dbraw/zinc/12/63/95/1425126395.db2.gz VPBPGKLKJDVROS-SFHVURJKSA-N 2 1 377.532 3.174 20 0 GGADMP C[N@@H+]1CCC[C@H]2C[NH+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@@H]21 ZINC000164607381 1425128762 /nfs/dbraw/zinc/12/87/62/1425128762.db2.gz GAEXGASHAYNGFB-YOEHRIQHSA-N 2 1 390.325 3.138 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@@H]21 ZINC000164607381 1425128767 /nfs/dbraw/zinc/12/87/67/1425128767.db2.gz GAEXGASHAYNGFB-YOEHRIQHSA-N 2 1 390.325 3.138 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@@H]21 ZINC000164607381 1425128773 /nfs/dbraw/zinc/12/87/73/1425128773.db2.gz GAEXGASHAYNGFB-YOEHRIQHSA-N 2 1 390.325 3.138 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@@H]21 ZINC000164607381 1425128781 /nfs/dbraw/zinc/12/87/81/1425128781.db2.gz GAEXGASHAYNGFB-YOEHRIQHSA-N 2 1 390.325 3.138 20 0 GGADMP Cc1ccc([C@@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)N2CCOCC2)o1 ZINC000164630010 1425130852 /nfs/dbraw/zinc/13/08/52/1425130852.db2.gz XRDKBFXANMPHQS-HSZRJFAPSA-N 2 1 397.563 3.258 20 0 GGADMP COc1cc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCC2)ccc1S(=O)(=O)C(F)F ZINC000165309980 1425174233 /nfs/dbraw/zinc/17/42/33/1425174233.db2.gz JNWSJZSQGYJWFD-KBPBESRZSA-N 2 1 390.496 3.074 20 0 GGADMP O=C(c1ccoc1)N1CCC([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000165297476 1425174306 /nfs/dbraw/zinc/17/43/06/1425174306.db2.gz QFWIPKSDYZPZJO-HXUWFJFHSA-N 2 1 381.520 3.038 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000165343194 1425176154 /nfs/dbraw/zinc/17/61/54/1425176154.db2.gz OECMQKPORDXYMM-AZUAARDMSA-N 2 1 386.561 3.305 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000165343194 1425176162 /nfs/dbraw/zinc/17/61/62/1425176162.db2.gz OECMQKPORDXYMM-AZUAARDMSA-N 2 1 386.561 3.305 20 0 GGADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+]C3CCN(Cc4cccnc4)CC3)C2)cc1 ZINC000165345836 1425176290 /nfs/dbraw/zinc/17/62/90/1425176290.db2.gz VAFLBNPSYZAJIF-HSZRJFAPSA-N 2 1 378.564 3.200 20 0 GGADMP C[C@@H](CC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)C1CC[NH2+]CC1 ZINC000165479046 1425180767 /nfs/dbraw/zinc/18/07/67/1425180767.db2.gz WAPHOMRNPSZLBR-HNNXBMFYSA-N 2 1 379.495 3.071 20 0 GGADMP C[C@H]1C[C@@H](NCc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)CC[N@H+]1C ZINC000165579781 1425186340 /nfs/dbraw/zinc/18/63/40/1425186340.db2.gz HRFHGQVQMILADD-YJBOKZPZSA-N 2 1 384.490 3.030 20 0 GGADMP CCC[NH+]1CCC([NH2+]Cc2cccc(NC(=O)NCc3ccncc3)c2)CC1 ZINC000167293225 1425224036 /nfs/dbraw/zinc/22/40/36/1425224036.db2.gz APYTUASTXCKKNU-UHFFFAOYSA-N 2 1 381.524 3.367 20 0 GGADMP COc1ccccc1[C@H]([NH3+])C(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000167308123 1425224689 /nfs/dbraw/zinc/22/46/89/1425224689.db2.gz SCMHHJYDDFETBM-QFIPXVFZSA-N 2 1 381.520 3.066 20 0 GGADMP COc1ccccc1[C@H]([NH3+])C(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000167308123 1425224700 /nfs/dbraw/zinc/22/47/00/1425224700.db2.gz SCMHHJYDDFETBM-QFIPXVFZSA-N 2 1 381.520 3.066 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000167361630 1425224754 /nfs/dbraw/zinc/22/47/54/1425224754.db2.gz SOULHRBMGXRUBT-LLGFUMIMSA-N 2 1 381.524 3.222 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000167361630 1425224764 /nfs/dbraw/zinc/22/47/64/1425224764.db2.gz SOULHRBMGXRUBT-LLGFUMIMSA-N 2 1 381.524 3.222 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000167361514 1425225195 /nfs/dbraw/zinc/22/51/95/1425225195.db2.gz SOULHRBMGXRUBT-CBGDNZLLSA-N 2 1 381.524 3.222 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000167361514 1425225200 /nfs/dbraw/zinc/22/52/00/1425225200.db2.gz SOULHRBMGXRUBT-CBGDNZLLSA-N 2 1 381.524 3.222 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)C2(c3ccccc3)CC[NH2+]CC2)CC[N@H+]1Cc1ccccc1 ZINC000167544504 1425227254 /nfs/dbraw/zinc/22/72/54/1425227254.db2.gz BYJBROYEWCWUPE-OFNKIYASSA-N 2 1 391.559 3.477 20 0 GGADMP C[C@H](c1ccc(NC(=O)C2(c3ccccc3)CC[NH2+]CC2)cc1)[NH+]1CCOCC1 ZINC000167679922 1425230427 /nfs/dbraw/zinc/23/04/27/1425230427.db2.gz UGVFBQYXNYREHB-LJQANCHMSA-N 2 1 393.531 3.340 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@@H]3CCCCCC[C@H]3[NH3+])CC2)cs1 ZINC000168630488 1425239777 /nfs/dbraw/zinc/23/97/77/1425239777.db2.gz SIAMDQZQNQZAMV-RTBURBONSA-N 2 1 392.613 3.331 20 0 GGADMP C[C@@H](CC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)C1CC[NH2+]CC1 ZINC000168953637 1425240968 /nfs/dbraw/zinc/24/09/68/1425240968.db2.gz NGAUQFHOXTYNCW-HNAYVOBHSA-N 2 1 397.485 3.422 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)Nc1ccc(OCC[NH+]2CCCC2)c(C)c1 ZINC000169092331 1425242409 /nfs/dbraw/zinc/24/24/09/1425242409.db2.gz MKQLDDKGRAKCAT-OAQYLSRUSA-N 2 1 383.492 3.117 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)C[C@@H]2CCC[NH2+]2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000169140145 1425243911 /nfs/dbraw/zinc/24/39/11/1425243911.db2.gz RUENYUQZGAIKEY-AYBZRNKSSA-N 2 1 383.458 3.347 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)CCCC[NH+]2CCOCC2)c2cccs2)CC1 ZINC000170693217 1425303262 /nfs/dbraw/zinc/30/32/62/1425303262.db2.gz COAXAQKYHVPQFH-IBGZPJMESA-N 2 1 393.597 3.140 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)CC2)cs1 ZINC000170693151 1425303279 /nfs/dbraw/zinc/30/32/79/1425303279.db2.gz CJSPDZABAIYBFJ-FQEVSTJZSA-N 2 1 386.565 3.083 20 0 GGADMP CCCO[C@@H]1CCC[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000170989145 1425425490 /nfs/dbraw/zinc/42/54/90/1425425490.db2.gz PYXUDXGYVXHSLC-JOCHJYFZSA-N 2 1 387.568 3.180 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CN2C(=O)NC3(CCCCC3)C2=O)CC1 ZINC000171041670 1425451384 /nfs/dbraw/zinc/45/13/84/1425451384.db2.gz REKDPNCOWDLGOO-UHFFFAOYSA-N 2 1 398.551 3.043 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CN2C(=O)NC3(CCCCC3)C2=O)CC1 ZINC000171041670 1425451388 /nfs/dbraw/zinc/45/13/88/1425451388.db2.gz REKDPNCOWDLGOO-UHFFFAOYSA-N 2 1 398.551 3.043 20 0 GGADMP C[NH+](C)Cc1cccc(NC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000171138948 1425502930 /nfs/dbraw/zinc/50/29/30/1425502930.db2.gz UJGWBICMWMUFKG-OAQYLSRUSA-N 2 1 380.536 3.434 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000171168498 1425523419 /nfs/dbraw/zinc/52/34/19/1425523419.db2.gz WFYLNJRANQKQIL-UHFFFAOYSA-N 2 1 390.597 3.060 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000171168498 1425523426 /nfs/dbraw/zinc/52/34/26/1425523426.db2.gz WFYLNJRANQKQIL-UHFFFAOYSA-N 2 1 390.597 3.060 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@@H](c1ccc(C)cc1)[NH+]1CCCC1 ZINC000171211908 1425542600 /nfs/dbraw/zinc/54/26/00/1425542600.db2.gz UNNGGLCEHRSLQU-NQIIRXRSSA-N 2 1 383.540 3.272 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000171212600 1425542616 /nfs/dbraw/zinc/54/26/16/1425542616.db2.gz BVVMNRBVLSIYSC-FUHWJXTLSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000171212600 1425542619 /nfs/dbraw/zinc/54/26/19/1425542619.db2.gz BVVMNRBVLSIYSC-FUHWJXTLSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NCCCNc2ccc(C)c[nH+]2)[NH+]2CCCC2)o1 ZINC000171227709 1425550888 /nfs/dbraw/zinc/55/08/88/1425550888.db2.gz BIRQYDWPMULDEN-GOSISDBHSA-N 2 1 385.512 3.230 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000171296520 1425601616 /nfs/dbraw/zinc/60/16/16/1425601616.db2.gz NSOPXBDJMMFAOR-UHFFFAOYSA-N 2 1 386.584 3.416 20 0 GGADMP Cc1cccc(NC(=O)[C@H](C)[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c1C ZINC000171304681 1425605487 /nfs/dbraw/zinc/60/54/87/1425605487.db2.gz PGSYYZILSXQECF-GGPKGHCWSA-N 2 1 387.568 3.452 20 0 GGADMP CC(C)N(C(=O)C[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1 ZINC000171306541 1425606545 /nfs/dbraw/zinc/60/65/45/1425606545.db2.gz LLHVPOHYQSWEMM-WOJBJXKFSA-N 2 1 387.568 3.249 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000171362703 1425641109 /nfs/dbraw/zinc/64/11/09/1425641109.db2.gz BXCVTISWSBCYJF-QUCCMNQESA-N 2 1 375.561 3.125 20 0 GGADMP COc1ccc(C[N@H+](C)CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)cc1C ZINC000171391182 1425657178 /nfs/dbraw/zinc/65/71/78/1425657178.db2.gz VAQXNVIMRIHTNP-UHFFFAOYSA-N 2 1 395.547 3.348 20 0 GGADMP COc1ccc(C[N@@H+](C)CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)cc1C ZINC000171391182 1425657182 /nfs/dbraw/zinc/65/71/82/1425657182.db2.gz VAQXNVIMRIHTNP-UHFFFAOYSA-N 2 1 395.547 3.348 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000171863231 1425837527 /nfs/dbraw/zinc/83/75/27/1425837527.db2.gz IDRKWDJABVCFJY-HXUWFJFHSA-N 2 1 391.559 3.257 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000171863231 1425837530 /nfs/dbraw/zinc/83/75/30/1425837530.db2.gz IDRKWDJABVCFJY-HXUWFJFHSA-N 2 1 391.559 3.257 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](C)[C@@H](C)c2cccc(O)c2)CC1 ZINC000171939045 1425857613 /nfs/dbraw/zinc/85/76/13/1425857613.db2.gz UOQDVHIBGLSAKD-IBGZPJMESA-N 2 1 395.547 3.474 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+](C)[C@@H](C)c2cccc(O)c2)CC1 ZINC000171939045 1425857617 /nfs/dbraw/zinc/85/76/17/1425857617.db2.gz UOQDVHIBGLSAKD-IBGZPJMESA-N 2 1 395.547 3.474 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CCC[C@H]2Cc2ccccc2Cl)CC1 ZINC000172246955 1425965139 /nfs/dbraw/zinc/96/51/39/1425965139.db2.gz RZYULYYJCUNDME-IBGZPJMESA-N 2 1 377.960 3.336 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@H]2Cc2ccccc2Cl)CC1 ZINC000172246955 1425965144 /nfs/dbraw/zinc/96/51/44/1425965144.db2.gz RZYULYYJCUNDME-IBGZPJMESA-N 2 1 377.960 3.336 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000172258471 1425970886 /nfs/dbraw/zinc/97/08/86/1425970886.db2.gz ZXOSRQXNYBZZOL-SFHVURJKSA-N 2 1 383.540 3.134 20 0 GGADMP C[C@H]1C[C@H](N(C)C(=O)CCCC[NH+]2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000172411819 1426030454 /nfs/dbraw/zinc/03/04/54/1426030454.db2.gz KNCVNKKELPKMCC-RBBKRZOGSA-N 2 1 387.568 3.000 20 0 GGADMP C[C@H]1C[C@H](N(C)C(=O)CCCC[NH+]2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000172411819 1426030462 /nfs/dbraw/zinc/03/04/62/1426030462.db2.gz KNCVNKKELPKMCC-RBBKRZOGSA-N 2 1 387.568 3.000 20 0 GGADMP C[C@@H](CNC(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1)C[NH+]1CCOCC1 ZINC000172460302 1426049220 /nfs/dbraw/zinc/04/92/20/1426049220.db2.gz JWCDIXPKZJDOGP-FQEVSTJZSA-N 2 1 395.547 3.017 20 0 GGADMP C[C@@H](CNC(=O)c1cccc(C[N@@H+](C)Cc2ccccc2)c1)C[NH+]1CCOCC1 ZINC000172460302 1426049231 /nfs/dbraw/zinc/04/92/31/1426049231.db2.gz JWCDIXPKZJDOGP-FQEVSTJZSA-N 2 1 395.547 3.017 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@@H+](C2CCCC2)CC1)[NH+]1CCc2sccc2C1 ZINC000172550483 1426082554 /nfs/dbraw/zinc/08/25/54/1426082554.db2.gz FCPVKOIROYHNGS-QGZVFWFLSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)[NH+]1CCc2sccc2C1 ZINC000172550483 1426082563 /nfs/dbraw/zinc/08/25/63/1426082563.db2.gz FCPVKOIROYHNGS-QGZVFWFLSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@H](CNC(=O)N1CCC[NH+](C2CCCC2)CC1)[N@@H+]1CCc2sccc2C1 ZINC000172550483 1426082572 /nfs/dbraw/zinc/08/25/72/1426082572.db2.gz FCPVKOIROYHNGS-QGZVFWFLSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@H](CNC(=O)N1CCC[NH+](C2CCCC2)CC1)[N@H+]1CCc2sccc2C1 ZINC000172550483 1426082579 /nfs/dbraw/zinc/08/25/79/1426082579.db2.gz FCPVKOIROYHNGS-QGZVFWFLSA-N 2 1 390.597 3.155 20 0 GGADMP C(=C/CN1CCC[N@H+](C2CCCC2)CC1)\CN1CCC[NH+](C2CCCC2)CC1 ZINC000172585860 1426099185 /nfs/dbraw/zinc/09/91/85/1426099185.db2.gz NEXJPFVDVHEKQU-AATRIKPKSA-N 2 1 388.644 3.443 20 0 GGADMP C[C@H](NC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)C(C)(C)C[NH+](C)C ZINC000173057345 1426326033 /nfs/dbraw/zinc/32/60/33/1426326033.db2.gz GQFIDUNJUSERLT-KURKYZTESA-N 2 1 375.557 3.002 20 0 GGADMP C[C@H](c1ccc(NC(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)cc1)[NH+]1CCOCC1 ZINC000173136859 1426359139 /nfs/dbraw/zinc/35/91/39/1426359139.db2.gz GGIJJTQCICSDIP-WIYYLYMNSA-N 2 1 388.556 3.418 20 0 GGADMP C[C@H](c1ccc(NC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1)[NH+]1CCOCC1 ZINC000173136859 1426359146 /nfs/dbraw/zinc/35/91/46/1426359146.db2.gz GGIJJTQCICSDIP-WIYYLYMNSA-N 2 1 388.556 3.418 20 0 GGADMP COc1cc(NC(=O)CC[NH+]2CCC([NH2+]C(C)C)CC2)c(OC)cc1Cl ZINC000173309868 1426493339 /nfs/dbraw/zinc/49/33/39/1426493339.db2.gz PGCGRDQFFHAXSE-UHFFFAOYSA-N 2 1 383.920 3.148 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@@H](C)[NH+]3CCCCCC3)CC2)cs1 ZINC000173328001 1426509549 /nfs/dbraw/zinc/50/95/49/1426509549.db2.gz UNOZEAGDBFZMHX-QGZVFWFLSA-N 2 1 392.613 3.298 20 0 GGADMP C[NH+]1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000173407439 1426590589 /nfs/dbraw/zinc/59/05/89/1426590589.db2.gz ILRUSESPLZCCGB-LJQANCHMSA-N 2 1 388.556 3.150 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000173415893 1426598525 /nfs/dbraw/zinc/59/85/25/1426598525.db2.gz APEALCAWCLEXEH-ROUUACIJSA-N 2 1 378.586 3.258 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000173416740 1426599852 /nfs/dbraw/zinc/59/98/52/1426599852.db2.gz JLMMMDIDAMSHSJ-MSOLQXFVSA-N 2 1 378.586 3.401 20 0 GGADMP COc1cc(NC(=O)CC[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(OC)cc1Cl ZINC000173494846 1426666444 /nfs/dbraw/zinc/66/64/44/1426666444.db2.gz QNRIYNHHRLVXEU-OAHLLOKOSA-N 2 1 395.931 3.104 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173602191 1426773159 /nfs/dbraw/zinc/77/31/59/1426773159.db2.gz YTBPXSSEHUXMCF-ZVDOUQERSA-N 2 1 387.568 3.100 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173602191 1426773179 /nfs/dbraw/zinc/77/31/79/1426773179.db2.gz YTBPXSSEHUXMCF-ZVDOUQERSA-N 2 1 387.568 3.100 20 0 GGADMP C[N@H+](CC(=O)N1CCC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1)C1CCC1 ZINC000173614833 1426792695 /nfs/dbraw/zinc/79/26/95/1426792695.db2.gz YTUPHQQBADQQNQ-UHFFFAOYSA-N 2 1 383.458 3.224 20 0 GGADMP C[N@@H+](CC(=O)N1CCC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1)C1CCC1 ZINC000173614833 1426792720 /nfs/dbraw/zinc/79/27/20/1426792720.db2.gz YTUPHQQBADQQNQ-UHFFFAOYSA-N 2 1 383.458 3.224 20 0 GGADMP C[NH+](CC(=O)N1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1)C1CCC1 ZINC000173614833 1426792731 /nfs/dbraw/zinc/79/27/31/1426792731.db2.gz YTUPHQQBADQQNQ-UHFFFAOYSA-N 2 1 383.458 3.224 20 0 GGADMP C[NH+](CC(=O)N1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2)CC1)C1CCC1 ZINC000173614833 1426792749 /nfs/dbraw/zinc/79/27/49/1426792749.db2.gz YTUPHQQBADQQNQ-UHFFFAOYSA-N 2 1 383.458 3.224 20 0 GGADMP C[N@H+](CCc1cccs1)CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000173759793 1426842661 /nfs/dbraw/zinc/84/26/61/1426842661.db2.gz GNBJIDJMRAXYLH-UHFFFAOYSA-N 2 1 389.590 3.410 20 0 GGADMP C[N@@H+](CCc1cccs1)CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000173759793 1426842664 /nfs/dbraw/zinc/84/26/64/1426842664.db2.gz GNBJIDJMRAXYLH-UHFFFAOYSA-N 2 1 389.590 3.410 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173819220 1426859406 /nfs/dbraw/zinc/85/94/06/1426859406.db2.gz LCYKQLKZFOCKAW-ZVDOUQERSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173819220 1426859407 /nfs/dbraw/zinc/85/94/07/1426859407.db2.gz LCYKQLKZFOCKAW-ZVDOUQERSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173819220 1426859409 /nfs/dbraw/zinc/85/94/09/1426859409.db2.gz LCYKQLKZFOCKAW-ZVDOUQERSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173819220 1426859411 /nfs/dbraw/zinc/85/94/11/1426859411.db2.gz LCYKQLKZFOCKAW-ZVDOUQERSA-N 2 1 387.568 3.100 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)Nc1ccn(CC[NH+](C)C)n1 ZINC000173912960 1426890020 /nfs/dbraw/zinc/89/00/20/1426890020.db2.gz SSUFHFFIUKSDSD-GOSISDBHSA-N 2 1 398.555 3.141 20 0 GGADMP CC(C)[C@@H](NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000173946677 1426904014 /nfs/dbraw/zinc/90/40/14/1426904014.db2.gz FNLHYBGFJZVSQD-HSZRJFAPSA-N 2 1 387.568 3.077 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CC[NH+](C2CC2)C1 ZINC000173959257 1426910372 /nfs/dbraw/zinc/91/03/72/1426910372.db2.gz DPWNARDASBYRPT-SFHVURJKSA-N 2 1 396.535 3.195 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CC[NH+](C2CC2)C1 ZINC000173959257 1426910380 /nfs/dbraw/zinc/91/03/80/1426910380.db2.gz DPWNARDASBYRPT-SFHVURJKSA-N 2 1 396.535 3.195 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000173959257 1426910386 /nfs/dbraw/zinc/91/03/86/1426910386.db2.gz DPWNARDASBYRPT-SFHVURJKSA-N 2 1 396.535 3.195 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000173959257 1426910392 /nfs/dbraw/zinc/91/03/92/1426910392.db2.gz DPWNARDASBYRPT-SFHVURJKSA-N 2 1 396.535 3.195 20 0 GGADMP COc1ccc(-c2nc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)co2)cc1 ZINC000173962466 1426911515 /nfs/dbraw/zinc/91/15/15/1426911515.db2.gz FTURPQPMLIGOEK-UHFFFAOYSA-N 2 1 385.508 3.427 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1Cl ZINC000173961469 1426912322 /nfs/dbraw/zinc/91/23/22/1426912322.db2.gz MLNNSSHKIAMUQM-QGZVFWFLSA-N 2 1 393.959 3.094 20 0 GGADMP CSc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000173962806 1426912949 /nfs/dbraw/zinc/91/29/49/1426912949.db2.gz YONGRZYMAUYHHX-QGZVFWFLSA-N 2 1 391.581 3.312 20 0 GGADMP COc1cccc(NC(=O)CC[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000173980440 1426923752 /nfs/dbraw/zinc/92/37/52/1426923752.db2.gz UBYJQPYAZPTNSX-FQEVSTJZSA-N 2 1 381.520 3.478 20 0 GGADMP COc1cccc(NC(=O)CC[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000173980440 1426923757 /nfs/dbraw/zinc/92/37/57/1426923757.db2.gz UBYJQPYAZPTNSX-FQEVSTJZSA-N 2 1 381.520 3.478 20 0 GGADMP COc1cccc(NC(=O)CC[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000173980440 1426923761 /nfs/dbraw/zinc/92/37/61/1426923761.db2.gz UBYJQPYAZPTNSX-FQEVSTJZSA-N 2 1 381.520 3.478 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccn2)CC1)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000174017801 1426945806 /nfs/dbraw/zinc/94/58/06/1426945806.db2.gz FPCLDPUAZNTOII-QHCPKHFHSA-N 2 1 392.547 3.217 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)c1ccccc1Cl ZINC000174119530 1427010474 /nfs/dbraw/zinc/01/04/74/1427010474.db2.gz BPGAXQTUATXXNG-VQIMIIECSA-N 2 1 378.948 3.070 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C(=O)NCC(F)(F)F ZINC000174154976 1427024283 /nfs/dbraw/zinc/02/42/83/1427024283.db2.gz OGYCOOFGCIQQQX-CQSZACIVSA-N 2 1 383.414 3.068 20 0 GGADMP CN(C(=O)NC1CC[NH+](CC2CC2)CC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174185283 1427037830 /nfs/dbraw/zinc/03/78/30/1427037830.db2.gz GLYXPUWCCKABNU-QFIPXVFZSA-N 2 1 384.568 3.167 20 0 GGADMP Cn1c2ccc(Cl)cc2nc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174238298 1427064388 /nfs/dbraw/zinc/06/43/88/1427064388.db2.gz OJKAAFUQCBKLPY-UHFFFAOYSA-N 2 1 376.932 3.304 20 0 GGADMP COc1ccc(C[NH+]2CCC(CNC(=O)CCn3cc[nH+]c3C(C)C)CC2)cc1 ZINC000174357502 1427117843 /nfs/dbraw/zinc/11/78/43/1427117843.db2.gz OSQVZWWRIQZZPD-UHFFFAOYSA-N 2 1 398.551 3.434 20 0 GGADMP C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174398416 1427138244 /nfs/dbraw/zinc/13/82/44/1427138244.db2.gz OLAGETUGFMUXTD-HXUWFJFHSA-N 2 1 391.515 3.127 20 0 GGADMP C[NH+](CCCN1C(=O)c2ccccc2C1=O)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174398416 1427138249 /nfs/dbraw/zinc/13/82/49/1427138249.db2.gz OLAGETUGFMUXTD-HXUWFJFHSA-N 2 1 391.515 3.127 20 0 GGADMP C[NH+](CCCN1C(=O)c2ccccc2C1=O)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174398416 1427138254 /nfs/dbraw/zinc/13/82/54/1427138254.db2.gz OLAGETUGFMUXTD-HXUWFJFHSA-N 2 1 391.515 3.127 20 0 GGADMP C[N@@H+](CCC(=O)N1CCc2ccccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174403448 1427141890 /nfs/dbraw/zinc/14/18/90/1427141890.db2.gz KRWHTQPUCMTGTK-OAQYLSRUSA-N 2 1 377.532 3.420 20 0 GGADMP C[NH+](CCC(=O)N1CCc2ccccc21)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174403448 1427141895 /nfs/dbraw/zinc/14/18/95/1427141895.db2.gz KRWHTQPUCMTGTK-OAQYLSRUSA-N 2 1 377.532 3.420 20 0 GGADMP C[NH+](CCC(=O)N1CCc2ccccc21)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174403448 1427141906 /nfs/dbraw/zinc/14/19/06/1427141906.db2.gz KRWHTQPUCMTGTK-OAQYLSRUSA-N 2 1 377.532 3.420 20 0 GGADMP C[N@@H+](CCC(=O)N1CCc2ccccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174403435 1427141944 /nfs/dbraw/zinc/14/19/44/1427141944.db2.gz KRWHTQPUCMTGTK-NRFANRHFSA-N 2 1 377.532 3.420 20 0 GGADMP C[NH+](CCC(=O)N1CCc2ccccc21)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174403435 1427141949 /nfs/dbraw/zinc/14/19/49/1427141949.db2.gz KRWHTQPUCMTGTK-NRFANRHFSA-N 2 1 377.532 3.420 20 0 GGADMP C[NH+](CCC(=O)N1CCc2ccccc21)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174403435 1427141956 /nfs/dbraw/zinc/14/19/56/1427141956.db2.gz KRWHTQPUCMTGTK-NRFANRHFSA-N 2 1 377.532 3.420 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@H](c1ccc(C)cc1)[NH+]1CCCC1 ZINC000174453579 1427162192 /nfs/dbraw/zinc/16/21/92/1427162192.db2.gz QAZKCTGPOBQVDS-OAQYLSRUSA-N 2 1 383.540 3.416 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000174455561 1427163676 /nfs/dbraw/zinc/16/36/76/1427163676.db2.gz KWOCVVQUDZGGAV-LJQANCHMSA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000174460408 1427167388 /nfs/dbraw/zinc/16/73/88/1427167388.db2.gz SFVCHDVQAAXZBM-RBUKOAKNSA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000174460408 1427167395 /nfs/dbraw/zinc/16/73/95/1427167395.db2.gz SFVCHDVQAAXZBM-RBUKOAKNSA-N 2 1 392.613 3.476 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000174460408 1427167400 /nfs/dbraw/zinc/16/74/00/1427167400.db2.gz SFVCHDVQAAXZBM-RBUKOAKNSA-N 2 1 392.613 3.476 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000174485368 1427176859 /nfs/dbraw/zinc/17/68/59/1427176859.db2.gz RAAXCUOCKOKDEZ-JOCHJYFZSA-N 2 1 384.568 3.215 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@H+](C)CC34CCCCC4)cc2)C[C@H](C)O1 ZINC000174573871 1427233876 /nfs/dbraw/zinc/23/38/76/1427233876.db2.gz BWWQNZRCRMVOPI-PMACEKPBSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@@H+](C)CC34CCCCC4)cc2)C[C@H](C)O1 ZINC000174573871 1427233880 /nfs/dbraw/zinc/23/38/80/1427233880.db2.gz BWWQNZRCRMVOPI-PMACEKPBSA-N 2 1 399.579 3.386 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000174598560 1427249136 /nfs/dbraw/zinc/24/91/36/1427249136.db2.gz MRZJOBZJZYCJIP-LJQANCHMSA-N 2 1 387.572 3.085 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCCC1CC[NH+](C)CC1 ZINC000174712857 1427324942 /nfs/dbraw/zinc/32/49/42/1427324942.db2.gz HFWIKQXYFIOPES-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1 ZINC000174797865 1427373990 /nfs/dbraw/zinc/37/39/90/1427373990.db2.gz SZPZOEVQDHEXMY-UHFFFAOYSA-N 2 1 383.540 3.108 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000174797865 1427373995 /nfs/dbraw/zinc/37/39/95/1427373995.db2.gz SZPZOEVQDHEXMY-UHFFFAOYSA-N 2 1 383.540 3.108 20 0 GGADMP CN(Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CCC[N@@H+](C)C1 ZINC000174805197 1427378126 /nfs/dbraw/zinc/37/81/26/1427378126.db2.gz OKTGDRFLWUNTHG-GOSISDBHSA-N 2 1 384.524 3.053 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CCC[NH+](C)C1 ZINC000174805197 1427378136 /nfs/dbraw/zinc/37/81/36/1427378136.db2.gz OKTGDRFLWUNTHG-GOSISDBHSA-N 2 1 384.524 3.053 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CCC[NH+](C)C1 ZINC000174805197 1427378143 /nfs/dbraw/zinc/37/81/43/1427378143.db2.gz OKTGDRFLWUNTHG-GOSISDBHSA-N 2 1 384.524 3.053 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CCC[N@H+](C)C1 ZINC000174805197 1427378148 /nfs/dbraw/zinc/37/81/48/1427378148.db2.gz OKTGDRFLWUNTHG-GOSISDBHSA-N 2 1 384.524 3.053 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@H]1CCC[N@@H+](C)C1 ZINC000174805197 1427378156 /nfs/dbraw/zinc/37/81/56/1427378156.db2.gz OKTGDRFLWUNTHG-GOSISDBHSA-N 2 1 384.524 3.053 20 0 GGADMP CN(Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CCC[N@@H+](C)C1 ZINC000174805211 1427378557 /nfs/dbraw/zinc/37/85/57/1427378557.db2.gz OKTGDRFLWUNTHG-SFHVURJKSA-N 2 1 384.524 3.053 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CCC[NH+](C)C1 ZINC000174805211 1427378563 /nfs/dbraw/zinc/37/85/63/1427378563.db2.gz OKTGDRFLWUNTHG-SFHVURJKSA-N 2 1 384.524 3.053 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CCC[NH+](C)C1 ZINC000174805211 1427378569 /nfs/dbraw/zinc/37/85/69/1427378569.db2.gz OKTGDRFLWUNTHG-SFHVURJKSA-N 2 1 384.524 3.053 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CCC[N@H+](C)C1 ZINC000174805211 1427378572 /nfs/dbraw/zinc/37/85/72/1427378572.db2.gz OKTGDRFLWUNTHG-SFHVURJKSA-N 2 1 384.524 3.053 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)NC[C@@H]1CCC[N@@H+](C)C1 ZINC000174805211 1427378578 /nfs/dbraw/zinc/37/85/78/1427378578.db2.gz OKTGDRFLWUNTHG-SFHVURJKSA-N 2 1 384.524 3.053 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(C)c(OC)c1C ZINC000174900790 1427435082 /nfs/dbraw/zinc/43/50/82/1427435082.db2.gz LVYKYDKQJKRULM-SFHVURJKSA-N 2 1 376.545 3.192 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)c1 ZINC000174998176 1427487231 /nfs/dbraw/zinc/48/72/31/1427487231.db2.gz CKDNYYWPCZPMRD-JOCHJYFZSA-N 2 1 397.494 3.264 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4ccc(F)cc43)c2)C1 ZINC000175008943 1427494916 /nfs/dbraw/zinc/49/49/16/1427494916.db2.gz ZKXTZSVEYQXHEV-DENIHFKCSA-N 2 1 381.495 3.300 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000175011304 1427495872 /nfs/dbraw/zinc/49/58/72/1427495872.db2.gz OXUISJNFOVMLCH-HSZRJFAPSA-N 2 1 394.563 3.412 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000175351829 1427699256 /nfs/dbraw/zinc/69/92/56/1427699256.db2.gz YURHHTQBZPFUPK-OAQYLSRUSA-N 2 1 386.584 3.270 20 0 GGADMP CCOc1ccc(NC(=O)N(CC[NH+](C)C)C[C@@H]2CCC[N@H+]2CC)cc1F ZINC000175404810 1427735765 /nfs/dbraw/zinc/73/57/65/1427735765.db2.gz WDASQGAZGNMXSU-KRWDZBQOSA-N 2 1 380.508 3.104 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000175462698 1427768194 /nfs/dbraw/zinc/76/81/94/1427768194.db2.gz IBTXOMVAUZYQBM-HXUWFJFHSA-N 2 1 375.561 3.125 20 0 GGADMP C[N@@H+](CCNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)Cc1ccc(F)cc1 ZINC000175515548 1427800246 /nfs/dbraw/zinc/80/02/46/1427800246.db2.gz PABCALIRMOOFIO-UHFFFAOYSA-N 2 1 398.526 3.221 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000175632459 1427838396 /nfs/dbraw/zinc/83/83/96/1427838396.db2.gz STNZSXQEGHTJMS-KSEOMHKRSA-N 2 1 384.568 3.167 20 0 GGADMP O=C(NC1CC[NH+](C2CCCC2)CC1)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000175636691 1427839908 /nfs/dbraw/zinc/83/99/08/1427839908.db2.gz JFDNXYGTVJCDLU-OAQYLSRUSA-N 2 1 384.568 3.357 20 0 GGADMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CCC(OCCC[NH+](C)C)CC2)C1 ZINC000175754035 1427879358 /nfs/dbraw/zinc/87/93/58/1427879358.db2.gz VXYDKZMHGXNJNR-IBGZPJMESA-N 2 1 396.620 3.029 20 0 GGADMP CC[NH+](CC)[C@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000175768872 1427885821 /nfs/dbraw/zinc/88/58/21/1427885821.db2.gz DQTMJLAOULTGPL-SFHVURJKSA-N 2 1 376.570 3.183 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCC(C)(C)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000175963831 1428001138 /nfs/dbraw/zinc/00/11/38/1428001138.db2.gz RMTARQQEYDTYPQ-SCTDSRPQSA-N 2 1 375.561 3.122 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCC(C)(C)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000175963831 1428001143 /nfs/dbraw/zinc/00/11/43/1428001143.db2.gz RMTARQQEYDTYPQ-SCTDSRPQSA-N 2 1 375.561 3.122 20 0 GGADMP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000176012385 1428026920 /nfs/dbraw/zinc/02/69/20/1428026920.db2.gz CCOZURRJIBQYII-UHFFFAOYSA-N 2 1 384.568 3.311 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(CSC)cc1 ZINC000176012849 1428026962 /nfs/dbraw/zinc/02/69/62/1428026962.db2.gz JMDFAUGLNLXJRH-LJQANCHMSA-N 2 1 378.586 3.429 20 0 GGADMP C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000176013948 1428027617 /nfs/dbraw/zinc/02/76/17/1428027617.db2.gz KWKLTEVWMHKNCA-IBGZPJMESA-N 2 1 384.568 3.309 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000176013948 1428027620 /nfs/dbraw/zinc/02/76/20/1428027620.db2.gz KWKLTEVWMHKNCA-IBGZPJMESA-N 2 1 384.568 3.309 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)NC2CC[NH+](C3CCCC3)CC2)CC1 ZINC000176029781 1428035428 /nfs/dbraw/zinc/03/54/28/1428035428.db2.gz PMFARHUOOKZHON-UHFFFAOYSA-N 2 1 384.568 3.229 20 0 GGADMP CC[NH+](CC)[C@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000176129091 1428101726 /nfs/dbraw/zinc/10/17/26/1428101726.db2.gz UZJMZEBCIXYLID-ROUUACIJSA-N 2 1 378.586 3.086 20 0 GGADMP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)C1 ZINC000176189513 1428153096 /nfs/dbraw/zinc/15/30/96/1428153096.db2.gz TYKNCYNOVDFIGL-RTBURBONSA-N 2 1 375.561 3.266 20 0 GGADMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)C1 ZINC000176189513 1428153102 /nfs/dbraw/zinc/15/31/02/1428153102.db2.gz TYKNCYNOVDFIGL-RTBURBONSA-N 2 1 375.561 3.266 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)cn1 ZINC000180176810 1429781752 /nfs/dbraw/zinc/78/17/52/1429781752.db2.gz WEWRNZPAHGWFPD-ZWKOTPCHSA-N 2 1 385.512 3.359 20 0 GGADMP C[N@@H+](CCCNC(=O)NCC1CCN(c2cc[nH+]cc2)CC1)C1CCCCC1 ZINC000180291808 1429826635 /nfs/dbraw/zinc/82/66/35/1429826635.db2.gz CHJVAUSEOXXWTP-UHFFFAOYSA-N 2 1 387.572 3.252 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]C2CCC(NC(=O)OC(C)(C)C)CC2)C[C@H](C)O1 ZINC000180312243 1429833576 /nfs/dbraw/zinc/83/35/76/1429833576.db2.gz XKOCSEAXMFSBFJ-LPOKXYRGSA-N 2 1 383.577 3.301 20 0 GGADMP CCC[C@H]1CN(C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000180383571 1429852249 /nfs/dbraw/zinc/85/22/49/1429852249.db2.gz DGFCJBQHFRQQIW-UNMCSNQZSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[C@H]1CN(C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000180383571 1429852250 /nfs/dbraw/zinc/85/22/50/1429852250.db2.gz DGFCJBQHFRQQIW-UNMCSNQZSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[C@H]1CN(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000180383571 1429852251 /nfs/dbraw/zinc/85/22/51/1429852251.db2.gz DGFCJBQHFRQQIW-UNMCSNQZSA-N 2 1 384.568 3.167 20 0 GGADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1 ZINC000180404552 1429859158 /nfs/dbraw/zinc/85/91/58/1429859158.db2.gz BVNVLIOUBMJCLB-GOSISDBHSA-N 2 1 393.597 3.385 20 0 GGADMP Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000180526487 1429890264 /nfs/dbraw/zinc/89/02/64/1429890264.db2.gz WEXKCHZFUQSQAE-OAQYLSRUSA-N 2 1 395.551 3.076 20 0 GGADMP Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000180526487 1429890265 /nfs/dbraw/zinc/89/02/65/1429890265.db2.gz WEXKCHZFUQSQAE-OAQYLSRUSA-N 2 1 395.551 3.076 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[N@@H+](C)C[C@@H]1C(C)C ZINC000180622132 1429938003 /nfs/dbraw/zinc/93/80/03/1429938003.db2.gz IRCDJQCALBXOCG-LJQANCHMSA-N 2 1 376.545 3.211 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H](c3cnn(C)c3)c3cccc(F)c3)CC2)nc(C)[nH+]1 ZINC000180724048 1430001592 /nfs/dbraw/zinc/00/15/92/1430001592.db2.gz XSEZFBKXRGGTRW-JOCHJYFZSA-N 2 1 394.498 3.314 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]CC2([NH+]3CCCCC3)CCOCC2)cc1 ZINC000180741251 1430011286 /nfs/dbraw/zinc/01/12/86/1430011286.db2.gz BZRAWYXHCARDNN-SFHVURJKSA-N 2 1 389.540 3.037 20 0 GGADMP COc1cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000180783089 1430037033 /nfs/dbraw/zinc/03/70/33/1430037033.db2.gz FLOJCGBZOHSDIV-UYAOXDASSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000180783089 1430037038 /nfs/dbraw/zinc/03/70/38/1430037038.db2.gz FLOJCGBZOHSDIV-UYAOXDASSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000180783089 1430037044 /nfs/dbraw/zinc/03/70/44/1430037044.db2.gz FLOJCGBZOHSDIV-UYAOXDASSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000180783089 1430037055 /nfs/dbraw/zinc/03/70/55/1430037055.db2.gz FLOJCGBZOHSDIV-UYAOXDASSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(-c2noc(CCCCC[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)n2)ccc1O ZINC000180865406 1430076390 /nfs/dbraw/zinc/07/63/90/1430076390.db2.gz FBXKTNYYVGZLGL-RDJZCZTQSA-N 2 1 388.512 3.236 20 0 GGADMP C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180879528 1430084822 /nfs/dbraw/zinc/08/48/22/1430084822.db2.gz RQUHNENUWIOMLN-RTBURBONSA-N 2 1 395.588 3.257 20 0 GGADMP CC(C)(C)OC(=O)C1CCC([NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)CC1 ZINC000180993664 1430157345 /nfs/dbraw/zinc/15/73/45/1430157345.db2.gz KUSXFAQKGLLSFJ-FBPXKMNZSA-N 2 1 388.552 3.243 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1nc2c(s1)CCCC2 ZINC000180996807 1430158618 /nfs/dbraw/zinc/15/86/18/1430158618.db2.gz YLFDPHXVTPEZJS-OAHLLOKOSA-N 2 1 386.565 3.164 20 0 GGADMP COc1ccc(C[N@H+](CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)C2CC2)cc1 ZINC000181276529 1430261244 /nfs/dbraw/zinc/26/12/44/1430261244.db2.gz JEBULHCJEVTILZ-JOCHJYFZSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccc(C[N@@H+](CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)C2CC2)cc1 ZINC000181276529 1430261248 /nfs/dbraw/zinc/26/12/48/1430261248.db2.gz JEBULHCJEVTILZ-JOCHJYFZSA-N 2 1 381.520 3.079 20 0 GGADMP COCCc1nc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCOCC2)s1 ZINC000181371657 1430283459 /nfs/dbraw/zinc/28/34/59/1430283459.db2.gz ZPBLZDLFILYQKL-MRXNPFEDSA-N 2 1 389.565 3.323 20 0 GGADMP C[C@H](NC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000181414008 1430291916 /nfs/dbraw/zinc/29/19/16/1430291916.db2.gz DTPOUCLTEWPRBV-TZYHBYERSA-N 2 1 389.584 3.046 20 0 GGADMP C[C@@H](NC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000181414457 1430292154 /nfs/dbraw/zinc/29/21/54/1430292154.db2.gz VIXWHEDKERUVPB-LEOXJPRUSA-N 2 1 389.584 3.046 20 0 GGADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCN(C)S(=O)(=O)c3cccs3)CC2)C1 ZINC000181504729 1430311719 /nfs/dbraw/zinc/31/17/19/1430311719.db2.gz DQVNCFKSEUOHGP-SJLPKXTDSA-N 2 1 399.626 3.001 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000181525659 1430315017 /nfs/dbraw/zinc/31/50/17/1430315017.db2.gz MJBSHSNZKIATHC-CXAGYDPISA-N 2 1 380.414 3.385 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000181576537 1430322482 /nfs/dbraw/zinc/32/24/82/1430322482.db2.gz LSMPXYZXVDKJLW-JTDSTZFVSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000181576537 1430322483 /nfs/dbraw/zinc/32/24/83/1430322483.db2.gz LSMPXYZXVDKJLW-JTDSTZFVSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000181630898 1430330884 /nfs/dbraw/zinc/33/08/84/1430330884.db2.gz RIWIABCTJKDPQM-XKCSPQBFSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000181630898 1430330888 /nfs/dbraw/zinc/33/08/88/1430330888.db2.gz RIWIABCTJKDPQM-XKCSPQBFSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000181630898 1430330893 /nfs/dbraw/zinc/33/08/93/1430330893.db2.gz RIWIABCTJKDPQM-XKCSPQBFSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181630898 1430330900 /nfs/dbraw/zinc/33/09/00/1430330900.db2.gz RIWIABCTJKDPQM-XKCSPQBFSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@@H](NC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000181630950 1430331384 /nfs/dbraw/zinc/33/13/84/1430331384.db2.gz RIWIABCTJKDPQM-UNWVZKJWSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@@H](NC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000181630950 1430331389 /nfs/dbraw/zinc/33/13/89/1430331389.db2.gz RIWIABCTJKDPQM-UNWVZKJWSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@@H](NC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000181630950 1430331394 /nfs/dbraw/zinc/33/13/94/1430331394.db2.gz RIWIABCTJKDPQM-UNWVZKJWSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@@H](NC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181630950 1430331399 /nfs/dbraw/zinc/33/13/99/1430331399.db2.gz RIWIABCTJKDPQM-UNWVZKJWSA-N 2 1 399.579 3.047 20 0 GGADMP CC(C)(C[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1ccccc1 ZINC000181656341 1430335878 /nfs/dbraw/zinc/33/58/78/1430335878.db2.gz ZJICMDDHJYURBC-UHFFFAOYSA-N 2 1 395.547 3.415 20 0 GGADMP CCO[C@@H]1C[C@H]([NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)C12CCCC2 ZINC000181726365 1430348533 /nfs/dbraw/zinc/34/85/33/1430348533.db2.gz IUORWBNAALIMBA-FDFHNCONSA-N 2 1 399.579 3.211 20 0 GGADMP COc1ccc([C@H]2CCC[N@@H+]2CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1 ZINC000182013191 1430396252 /nfs/dbraw/zinc/39/62/52/1430396252.db2.gz LCEWCNQKFWCBDQ-YADHBBJMSA-N 2 1 381.520 3.251 20 0 GGADMP COc1ccc([C@H]2CCC[N@H+]2CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1 ZINC000182013191 1430396256 /nfs/dbraw/zinc/39/62/56/1430396256.db2.gz LCEWCNQKFWCBDQ-YADHBBJMSA-N 2 1 381.520 3.251 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc(-n2cncn2)cc1 ZINC000182225466 1430433100 /nfs/dbraw/zinc/43/31/00/1430433100.db2.gz QAPAYXJMDIJOIR-WZONZLPQSA-N 2 1 391.519 3.075 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc([S@](C)=O)cc1 ZINC000182235366 1430434503 /nfs/dbraw/zinc/43/45/03/1430434503.db2.gz BRWLWVHTOQOPDS-XADOIVSYSA-N 2 1 386.561 3.232 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc2c(c1)OCCO2 ZINC000182247117 1430436499 /nfs/dbraw/zinc/43/64/99/1430436499.db2.gz UVYNAUBBVGZJNP-LAUBAEHRSA-N 2 1 382.504 3.265 20 0 GGADMP CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)c1 ZINC000182251920 1430437449 /nfs/dbraw/zinc/43/74/49/1430437449.db2.gz ILJKVACNWLROTC-GAJHUEQPSA-N 2 1 381.520 3.453 20 0 GGADMP COc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1OC ZINC000182258867 1430438654 /nfs/dbraw/zinc/43/86/54/1430438654.db2.gz SXIPFLQPDNZNDH-PXNSSMCTSA-N 2 1 384.520 3.430 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000182265796 1430439818 /nfs/dbraw/zinc/43/98/18/1430439818.db2.gz ASBNTNXPIKKESZ-CVDCTZTESA-N 3 1 397.563 3.044 20 0 GGADMP COc1cccc(C[C@H]([NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)C2CC2)c1 ZINC000182267361 1430440115 /nfs/dbraw/zinc/44/01/15/1430440115.db2.gz VTMKPQORWPKLGR-UPVQGACJSA-N 2 1 380.532 3.373 20 0 GGADMP COCCc1nc(C)c([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)s1 ZINC000182269810 1430440377 /nfs/dbraw/zinc/44/03/77/1430440377.db2.gz URGRADMOZXVWTI-KXBFYZLASA-N 2 1 389.565 3.058 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc2c(c1)OCCCO2 ZINC000182272434 1430440653 /nfs/dbraw/zinc/44/06/53/1430440653.db2.gz BNJZKCNXLAWCRQ-UTKZUKDTSA-N 2 1 382.504 3.265 20 0 GGADMP CC[C@@H]([NH2+]CC(=O)N1CCC[N@H+](Cc2ccccc2C)CC1)c1c(C)noc1C ZINC000182392849 1430458820 /nfs/dbraw/zinc/45/88/20/1430458820.db2.gz ADZCTCRSRXSHRC-OAQYLSRUSA-N 2 1 398.551 3.375 20 0 GGADMP CC[C@@H]([NH2+]CC(=O)N1CCC[N@@H+](Cc2ccccc2C)CC1)c1c(C)noc1C ZINC000182392849 1430458824 /nfs/dbraw/zinc/45/88/24/1430458824.db2.gz ADZCTCRSRXSHRC-OAQYLSRUSA-N 2 1 398.551 3.375 20 0 GGADMP CC[C@H]([NH2+]CC(=O)N1CCC[N@H+](Cc2ccccc2C)CC1)c1c(C)noc1C ZINC000182392833 1430458945 /nfs/dbraw/zinc/45/89/45/1430458945.db2.gz ADZCTCRSRXSHRC-NRFANRHFSA-N 2 1 398.551 3.375 20 0 GGADMP CC[C@H]([NH2+]CC(=O)N1CCC[N@@H+](Cc2ccccc2C)CC1)c1c(C)noc1C ZINC000182392833 1430458949 /nfs/dbraw/zinc/45/89/49/1430458949.db2.gz ADZCTCRSRXSHRC-NRFANRHFSA-N 2 1 398.551 3.375 20 0 GGADMP CC[C@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1c(C)noc1C ZINC000182397440 1430459704 /nfs/dbraw/zinc/45/97/04/1430459704.db2.gz ZSWHYGIRIKDRLX-DBVUQKKJSA-N 2 1 384.524 3.111 20 0 GGADMP CC[C@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(C)noc1C ZINC000182397440 1430459711 /nfs/dbraw/zinc/45/97/11/1430459711.db2.gz ZSWHYGIRIKDRLX-DBVUQKKJSA-N 2 1 384.524 3.111 20 0 GGADMP CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1c(C)noc1C ZINC000182397478 1430459743 /nfs/dbraw/zinc/45/97/43/1430459743.db2.gz ZSWHYGIRIKDRLX-AHRSYUTCSA-N 2 1 384.524 3.111 20 0 GGADMP CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(C)noc1C ZINC000182397478 1430459744 /nfs/dbraw/zinc/45/97/44/1430459744.db2.gz ZSWHYGIRIKDRLX-AHRSYUTCSA-N 2 1 384.524 3.111 20 0 GGADMP C[NH+](C)[C@H](C(=O)NCCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1 ZINC000182400345 1430460405 /nfs/dbraw/zinc/46/04/05/1430460405.db2.gz XMSPLXVHXIARJN-QHCPKHFHSA-N 2 1 395.547 3.123 20 0 GGADMP C[C@@H](NC(=O)NCCCC[NH+]1CCC(C)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182407137 1430462176 /nfs/dbraw/zinc/46/21/76/1430462176.db2.gz IRVZCTBEJWLUBK-WOJBJXKFSA-N 2 1 378.605 3.451 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000182471948 1430473399 /nfs/dbraw/zinc/47/33/99/1430473399.db2.gz ASJKDXKRYWIISZ-FGZHOGPDSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccc(F)cc1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182546755 1430488151 /nfs/dbraw/zinc/48/81/51/1430488151.db2.gz PORBOAVREVCTPW-CDXJDZJCSA-N 2 1 390.547 3.381 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cn1 ZINC000182548539 1430488737 /nfs/dbraw/zinc/48/87/37/1430488737.db2.gz XYZXATPSLISNIG-LPHOPBHVSA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cn1 ZINC000182548539 1430488740 /nfs/dbraw/zinc/48/87/40/1430488740.db2.gz XYZXATPSLISNIG-LPHOPBHVSA-N 2 1 396.539 3.028 20 0 GGADMP C[C@@H](NC(=O)NCC[N@@H+]1CCc2sccc2C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182555080 1430490939 /nfs/dbraw/zinc/49/09/39/1430490939.db2.gz AMGGUULHLBAFRA-SJORKVTESA-N 2 1 390.597 3.058 20 0 GGADMP C[C@@H](NC(=O)NCC[N@H+]1CCc2sccc2C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182555080 1430490940 /nfs/dbraw/zinc/49/09/40/1430490940.db2.gz AMGGUULHLBAFRA-SJORKVTESA-N 2 1 390.597 3.058 20 0 GGADMP C[C@@H](NC(=O)NCC[NH+]1CCc2sccc2C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182555080 1430490941 /nfs/dbraw/zinc/49/09/41/1430490941.db2.gz AMGGUULHLBAFRA-SJORKVTESA-N 2 1 390.597 3.058 20 0 GGADMP C[C@@H](NC(=O)NCC[NH+]1CCc2sccc2C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182555080 1430490943 /nfs/dbraw/zinc/49/09/43/1430490943.db2.gz AMGGUULHLBAFRA-SJORKVTESA-N 2 1 390.597 3.058 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(-c2ncco2)cc1 ZINC000182578184 1430496355 /nfs/dbraw/zinc/49/63/55/1430496355.db2.gz OUQPBGSYWPQDHL-IBGZPJMESA-N 2 1 385.512 3.221 20 0 GGADMP C[C@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)[C@H]1CCCCN1C(=O)OC(C)(C)C ZINC000182633490 1430506260 /nfs/dbraw/zinc/50/62/60/1430506260.db2.gz OEXPTPMYNZOSEU-AZUAARDMSA-N 2 1 396.620 3.028 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182678943 1430515995 /nfs/dbraw/zinc/51/59/95/1430515995.db2.gz JUXWGAOLWHMVRL-YSIASYRMSA-N 2 1 376.589 3.203 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[NH+](CC2CCCC2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182678943 1430515997 /nfs/dbraw/zinc/51/59/97/1430515997.db2.gz JUXWGAOLWHMVRL-YSIASYRMSA-N 2 1 376.589 3.203 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[NH+](CC2CCCC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182678943 1430516001 /nfs/dbraw/zinc/51/60/01/1430516001.db2.gz JUXWGAOLWHMVRL-YSIASYRMSA-N 2 1 376.589 3.203 20 0 GGADMP C[C@@H](NC(=O)NCC[N@@H+](C)Cc1ccc(F)cc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182689851 1430518206 /nfs/dbraw/zinc/51/82/06/1430518206.db2.gz GIRVAHAKTUDLJP-IEBWSBKVSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@@H](NC(=O)NCC[NH+](C)Cc1ccc(F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182689851 1430518209 /nfs/dbraw/zinc/51/82/09/1430518209.db2.gz GIRVAHAKTUDLJP-IEBWSBKVSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@@H](NC(=O)NCC[NH+](C)Cc1ccc(F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182689851 1430518215 /nfs/dbraw/zinc/51/82/15/1430518215.db2.gz GIRVAHAKTUDLJP-IEBWSBKVSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@@H](NC(=O)NC1CC[NH+](C2CCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182690278 1430518318 /nfs/dbraw/zinc/51/83/18/1430518318.db2.gz FKOJFQJVKCJZTA-MSOLQXFVSA-N 2 1 376.589 3.346 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182780048 1430538575 /nfs/dbraw/zinc/53/85/75/1430538575.db2.gz MCSNBCXAGIQPQP-SVFBPWRDSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182780048 1430538582 /nfs/dbraw/zinc/53/85/82/1430538582.db2.gz MCSNBCXAGIQPQP-SVFBPWRDSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182780048 1430538587 /nfs/dbraw/zinc/53/85/87/1430538587.db2.gz MCSNBCXAGIQPQP-SVFBPWRDSA-N 2 1 386.584 3.459 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+](CC(=O)Nc2ccc(NC(C)=O)cc2)CC1 ZINC000182783351 1430539160 /nfs/dbraw/zinc/53/91/60/1430539160.db2.gz MEWYAIYWBXBYAH-UHFFFAOYSA-N 2 1 388.556 3.418 20 0 GGADMP C[C@H](NC(=O)N1CCC[N@H+](C2CCCC2)CC1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182835839 1430550166 /nfs/dbraw/zinc/55/01/66/1430550166.db2.gz TXOQEVWJNNZXGP-RBUKOAKNSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCC[NH+](C2CCCC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182835839 1430550170 /nfs/dbraw/zinc/55/01/70/1430550170.db2.gz TXOQEVWJNNZXGP-RBUKOAKNSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCC[NH+](C2CCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182835839 1430550179 /nfs/dbraw/zinc/55/01/79/1430550179.db2.gz TXOQEVWJNNZXGP-RBUKOAKNSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCC[N@H+](C2CCCC2)CC1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182835880 1430550316 /nfs/dbraw/zinc/55/03/16/1430550316.db2.gz TXOQEVWJNNZXGP-OALUTQOASA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCC[NH+](C2CCCC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182835880 1430550318 /nfs/dbraw/zinc/55/03/18/1430550318.db2.gz TXOQEVWJNNZXGP-OALUTQOASA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCC[NH+](C2CCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182835880 1430550319 /nfs/dbraw/zinc/55/03/19/1430550319.db2.gz TXOQEVWJNNZXGP-OALUTQOASA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182856937 1430554829 /nfs/dbraw/zinc/55/48/29/1430554829.db2.gz TVPOXAKYTNPZJL-MOPGFXCFSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182869689 1430557750 /nfs/dbraw/zinc/55/77/50/1430557750.db2.gz GBHLWHCWLAZWHG-FPOVZHCZSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1ccco1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182930813 1430574315 /nfs/dbraw/zinc/57/43/15/1430574315.db2.gz HDRURKBZHWHPGZ-ZWKOTPCHSA-N 2 1 376.545 3.006 20 0 GGADMP C[C@H](NC(=O)N1CCC(CCC[NH+](C)C)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182939344 1430576454 /nfs/dbraw/zinc/57/64/54/1430576454.db2.gz PLBVHVNOSRMCPV-ICSRJNTNSA-N 2 1 378.605 3.403 20 0 GGADMP C[C@@H](NC(=O)N1CCC(CCC[NH+](C)C)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182939362 1430576518 /nfs/dbraw/zinc/57/65/18/1430576518.db2.gz PLBVHVNOSRMCPV-QUCCMNQESA-N 2 1 378.605 3.403 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)CC1 ZINC000182951297 1430579364 /nfs/dbraw/zinc/57/93/64/1430579364.db2.gz UUCMURUJYKVNOL-CBQOVEMMSA-N 2 1 384.568 3.338 20 0 GGADMP COC[C@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccc(F)c(F)c1 ZINC000183082476 1430608400 /nfs/dbraw/zinc/60/84/00/1430608400.db2.gz SAUMCAWSNVVKOO-IBGZPJMESA-N 2 1 376.451 3.318 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183128772 1430622850 /nfs/dbraw/zinc/62/28/50/1430622850.db2.gz GVZHGFXDBFAOOF-DSNGMDLFSA-N 3 1 398.639 3.294 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183128772 1430622862 /nfs/dbraw/zinc/62/28/62/1430622862.db2.gz GVZHGFXDBFAOOF-DSNGMDLFSA-N 3 1 398.639 3.294 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183128772 1430622873 /nfs/dbraw/zinc/62/28/73/1430622873.db2.gz GVZHGFXDBFAOOF-DSNGMDLFSA-N 3 1 398.639 3.294 20 0 GGADMP COCCC[NH+]1CCC(N[C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183135943 1430625608 /nfs/dbraw/zinc/62/56/08/1430625608.db2.gz FZZGPPMUTWQUDF-YFNKSVMNSA-N 2 1 385.596 3.378 20 0 GGADMP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183135943 1430625618 /nfs/dbraw/zinc/62/56/18/1430625618.db2.gz FZZGPPMUTWQUDF-YFNKSVMNSA-N 3 1 385.596 3.378 20 0 GGADMP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183135943 1430625628 /nfs/dbraw/zinc/62/56/28/1430625628.db2.gz FZZGPPMUTWQUDF-YFNKSVMNSA-N 3 1 385.596 3.378 20 0 GGADMP CS(=O)(=O)C1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183152904 1430630518 /nfs/dbraw/zinc/63/05/18/1430630518.db2.gz VYSNOKXFUBBUGS-RGCMJDONSA-N 2 1 390.593 3.233 20 0 GGADMP CS(=O)(=O)C1CCC([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183152904 1430630522 /nfs/dbraw/zinc/63/05/22/1430630522.db2.gz VYSNOKXFUBBUGS-RGCMJDONSA-N 2 1 390.593 3.233 20 0 GGADMP COc1cc([C@@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000183184556 1430641868 /nfs/dbraw/zinc/64/18/68/1430641868.db2.gz OYNNFVDVHWSWKE-JFIYKMOQSA-N 2 1 394.581 3.402 20 0 GGADMP COc1cc([C@@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000183184556 1430641872 /nfs/dbraw/zinc/64/18/72/1430641872.db2.gz OYNNFVDVHWSWKE-JFIYKMOQSA-N 2 1 394.581 3.402 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(NS(C)(=O)=O)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183191344 1430643815 /nfs/dbraw/zinc/64/38/15/1430643815.db2.gz NTQOREFCAJXEKV-LZLYRXPVSA-N 2 1 379.570 3.362 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000183197596 1430645445 /nfs/dbraw/zinc/64/54/45/1430645445.db2.gz DRYPZUBVQCTVNF-ZIFCJYIRSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000183197596 1430645449 /nfs/dbraw/zinc/64/54/49/1430645449.db2.gz DRYPZUBVQCTVNF-ZIFCJYIRSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC[C@H]3C[NH+](C)CC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC000183224346 1430651966 /nfs/dbraw/zinc/65/19/66/1430651966.db2.gz MPCRDZLYZVQIAG-QESAQDPVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000183224346 1430651968 /nfs/dbraw/zinc/65/19/68/1430651968.db2.gz MPCRDZLYZVQIAG-QESAQDPVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000183224346 1430651970 /nfs/dbraw/zinc/65/19/70/1430651970.db2.gz MPCRDZLYZVQIAG-QESAQDPVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H]3C[NH+](C)CC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC000183224324 1430652256 /nfs/dbraw/zinc/65/22/56/1430652256.db2.gz MPCRDZLYZVQIAG-GBAJDQEWSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000183224324 1430652259 /nfs/dbraw/zinc/65/22/59/1430652259.db2.gz MPCRDZLYZVQIAG-GBAJDQEWSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000183224324 1430652262 /nfs/dbraw/zinc/65/22/62/1430652262.db2.gz MPCRDZLYZVQIAG-GBAJDQEWSA-N 2 1 384.568 3.165 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCC[C@H](C2(C)OCCO2)C1)C1CC[NH+](C)CC1 ZINC000183237505 1430656477 /nfs/dbraw/zinc/65/64/77/1430656477.db2.gz VZKGOFVOUXZBKO-FQEVSTJZSA-N 2 1 387.568 3.192 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+]([C@H](C)CCc3cccc(F)c3)CC2)CC1 ZINC000183270360 1430665775 /nfs/dbraw/zinc/66/57/75/1430665775.db2.gz SRDNLANWQVCQSM-LJQANCHMSA-N 2 1 389.559 3.413 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@@H]4C[N@@H+](C)CC[C@@H]43)CC2)CC1 ZINC000183376410 1430694530 /nfs/dbraw/zinc/69/45/30/1430694530.db2.gz SJVVISBRHXMHLZ-UEKLYDJUSA-N 2 1 376.589 3.155 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@H]4C[N@@H+](C)CC[C@@H]43)CC2)CC1 ZINC000183376387 1430694776 /nfs/dbraw/zinc/69/47/76/1430694776.db2.gz SJVVISBRHXMHLZ-HAMDTZRPSA-N 2 1 376.589 3.155 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cn1 ZINC000183433406 1430710923 /nfs/dbraw/zinc/71/09/23/1430710923.db2.gz PXTZQRHRJYQCSE-SFHVURJKSA-N 2 1 385.512 3.455 20 0 GGADMP CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000183504492 1430730078 /nfs/dbraw/zinc/73/00/78/1430730078.db2.gz VYQXIZNJCCTOCM-BBRMVZONSA-N 2 1 395.569 3.190 20 0 GGADMP CC(C)OCC[NH+]1CCC([NH2+][C@H]2CCCN(C(=O)OC(C)(C)C)CC2)CC1 ZINC000183543216 1430738944 /nfs/dbraw/zinc/73/89/44/1430738944.db2.gz IHAGSOVXTUBDET-SFHVURJKSA-N 2 1 383.577 3.255 20 0 GGADMP CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]CC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC000183600875 1430751651 /nfs/dbraw/zinc/75/16/51/1430751651.db2.gz UQHJFCLGSIQUEP-LJQANCHMSA-N 2 1 395.588 3.401 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cn(-c2ccccc2)nc1C ZINC000183737612 1430784197 /nfs/dbraw/zinc/78/41/97/1430784197.db2.gz LULXLJZWVNOTHA-FQEVSTJZSA-N 2 1 398.555 3.061 20 0 GGADMP C[C@H](C[N@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1nccs1 ZINC000183978082 1430822061 /nfs/dbraw/zinc/82/20/61/1430822061.db2.gz PBKOCPNDWQJOCR-QGZVFWFLSA-N 2 1 386.565 3.091 20 0 GGADMP C[C@H](C[N@@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1nccs1 ZINC000183978082 1430822064 /nfs/dbraw/zinc/82/20/64/1430822064.db2.gz PBKOCPNDWQJOCR-QGZVFWFLSA-N 2 1 386.565 3.091 20 0 GGADMP Cc1ccccc1[C@H](C[NH+]1CCOCC1)Nc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000183989987 1430824701 /nfs/dbraw/zinc/82/47/01/1430824701.db2.gz CTDBVCWDOLCWDN-DEOSSOPVSA-N 2 1 394.563 3.232 20 0 GGADMP Cc1ccccc1[C@@H](C[NH+]1CCOCC1)Nc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000183989967 1430824707 /nfs/dbraw/zinc/82/47/07/1430824707.db2.gz CTDBVCWDOLCWDN-XMMPIXPASA-N 2 1 394.563 3.232 20 0 GGADMP CC[N@H+](C)[C@@H](C(=O)Nc1cccc(N2CC[NH+](CC)CC2)c1)c1ccccc1 ZINC000184261355 1430863978 /nfs/dbraw/zinc/86/39/78/1430863978.db2.gz WZVIAEIJRSQRNU-JOCHJYFZSA-N 2 1 380.536 3.460 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)Nc1cccc(N2CC[NH+](CC)CC2)c1)c1ccccc1 ZINC000184261355 1430863981 /nfs/dbraw/zinc/86/39/81/1430863981.db2.gz WZVIAEIJRSQRNU-JOCHJYFZSA-N 2 1 380.536 3.460 20 0 GGADMP COc1ccccc1S(=O)(=O)CCC[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000184405336 1430883872 /nfs/dbraw/zinc/88/38/72/1430883872.db2.gz PHDBSGMEJXMNQV-ROUUACIJSA-N 2 1 394.581 3.102 20 0 GGADMP COc1ccccc1S(=O)(=O)CCC[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000184405336 1430883874 /nfs/dbraw/zinc/88/38/74/1430883874.db2.gz PHDBSGMEJXMNQV-ROUUACIJSA-N 2 1 394.581 3.102 20 0 GGADMP COc1ccccc1S(=O)(=O)CCC[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000184405303 1430883915 /nfs/dbraw/zinc/88/39/15/1430883915.db2.gz PHDBSGMEJXMNQV-ZWKOTPCHSA-N 2 1 394.581 3.102 20 0 GGADMP COc1ccccc1S(=O)(=O)CCC[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000184405303 1430883917 /nfs/dbraw/zinc/88/39/17/1430883917.db2.gz PHDBSGMEJXMNQV-ZWKOTPCHSA-N 2 1 394.581 3.102 20 0 GGADMP C[C@H](CC[NH2+][C@H](C)c1cccc(N2CCCS2(=O)=O)c1)[NH+]1CCCCC1 ZINC000184502533 1430895855 /nfs/dbraw/zinc/89/58/55/1430895855.db2.gz LVCCRPWOVWLTII-QZTJIDSGSA-N 2 1 379.570 3.142 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]CC(C)(C)c3cccc(Cl)c3F)cn2)CC1 ZINC000184527898 1430898584 /nfs/dbraw/zinc/89/85/84/1430898584.db2.gz HIIORPGIEJPTTE-UHFFFAOYSA-N 2 1 391.922 3.088 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C[NH+]1CCC(Nc2ccc(F)cc2)CC1)c1ccccc1 ZINC000184600163 1430915140 /nfs/dbraw/zinc/91/51/40/1430915140.db2.gz SYUUNJLRAQPRFJ-JOCHJYFZSA-N 2 1 398.526 3.121 20 0 GGADMP O=C1C[C@@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)CN1Cc1ccccc1C(F)(F)F ZINC000184670721 1430937366 /nfs/dbraw/zinc/93/73/66/1430937366.db2.gz YKSNBGJCLBUYRV-GVDBMIGSSA-N 2 1 381.442 3.023 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)NC(=O)Nc1ccccc1 ZINC000184740269 1430960794 /nfs/dbraw/zinc/96/07/94/1430960794.db2.gz CKANSMQURBJSSK-ROUUACIJSA-N 2 1 394.519 3.081 20 0 GGADMP Cc1cccn2c(=O)cc(C[NH2+]C3[C@H](C)C[NH+](Cc4ccccc4)C[C@H]3C)nc12 ZINC000184748458 1430964894 /nfs/dbraw/zinc/96/48/94/1430964894.db2.gz SIOHSLDVISNJFE-RTBURBONSA-N 2 1 390.531 3.249 20 0 GGADMP COc1ccc(NC(=O)C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000184751471 1430965284 /nfs/dbraw/zinc/96/52/84/1430965284.db2.gz JYGSUSNTIFIUIK-ROUUACIJSA-N 2 1 381.520 3.380 20 0 GGADMP Cc1csc2nc(C[NH2+]C3[C@@H](C)C[NH+](Cc4ccccc4)C[C@@H]3C)cc(=O)n12 ZINC000184753236 1430966509 /nfs/dbraw/zinc/96/65/09/1430966509.db2.gz VYQRVXYXUNMJPK-HOTGVXAUSA-N 2 1 396.560 3.311 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)NCc1ccc(F)cc1 ZINC000184754522 1430967216 /nfs/dbraw/zinc/96/72/16/1430967216.db2.gz WCIYKPCDMCNKGL-ROUUACIJSA-N 2 1 383.511 3.188 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C[N@H+](Cc1cccc(O)c1)CC1CC1)c1ccccc1 ZINC000184970597 1431033240 /nfs/dbraw/zinc/03/32/40/1431033240.db2.gz OMUBMZODHXJYGT-QFIPXVFZSA-N 2 1 381.520 3.023 20 0 GGADMP CC(C)O[C@@H]1C[C@H]([NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)C1(C)C ZINC000185222968 1431088488 /nfs/dbraw/zinc/08/84/88/1431088488.db2.gz VPAHZDDEQDMTTO-PCCBWWKXSA-N 2 1 387.568 3.066 20 0 GGADMP Cc1cnc([C@H]([NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C2CC2)s1 ZINC000185274597 1431097930 /nfs/dbraw/zinc/09/79/30/1431097930.db2.gz FHYXXUOZOIWZDS-OAQYLSRUSA-N 2 1 398.576 3.404 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000185309751 1431109362 /nfs/dbraw/zinc/10/93/62/1431109362.db2.gz AGOVUPLAEOIOGX-UWJYYQICSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000185309751 1431109369 /nfs/dbraw/zinc/10/93/69/1431109369.db2.gz AGOVUPLAEOIOGX-UWJYYQICSA-N 2 1 383.540 3.037 20 0 GGADMP CCC[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccnc1 ZINC000185400389 1431136685 /nfs/dbraw/zinc/13/66/85/1431136685.db2.gz MJHYGCQAOLHKMB-VXKWHMMOSA-N 2 1 380.536 3.410 20 0 GGADMP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000185400447 1431136718 /nfs/dbraw/zinc/13/67/18/1431136718.db2.gz WDXOMUGOLJWYKR-XLIONFOSSA-N 2 1 381.520 3.249 20 0 GGADMP C[NH+](C)CC1(CNC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CCCC1 ZINC000185563985 1431171373 /nfs/dbraw/zinc/17/13/73/1431171373.db2.gz LOISEIISDDNCQF-SFHVURJKSA-N 2 1 392.613 3.381 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NC[C@@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000185613180 1431184208 /nfs/dbraw/zinc/18/42/08/1431184208.db2.gz YZTVOGMCENJSLZ-KXBFYZLASA-N 2 1 396.938 3.208 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000185613180 1431184212 /nfs/dbraw/zinc/18/42/12/1431184212.db2.gz YZTVOGMCENJSLZ-KXBFYZLASA-N 2 1 396.938 3.208 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000185613180 1431184217 /nfs/dbraw/zinc/18/42/17/1431184217.db2.gz YZTVOGMCENJSLZ-KXBFYZLASA-N 2 1 396.938 3.208 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NC[C@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000185613159 1431184367 /nfs/dbraw/zinc/18/43/67/1431184367.db2.gz YZTVOGMCENJSLZ-BEFAXECRSA-N 2 1 396.938 3.208 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NC[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000185613159 1431184377 /nfs/dbraw/zinc/18/43/77/1431184377.db2.gz YZTVOGMCENJSLZ-BEFAXECRSA-N 2 1 396.938 3.208 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000185613159 1431184381 /nfs/dbraw/zinc/18/43/81/1431184381.db2.gz YZTVOGMCENJSLZ-BEFAXECRSA-N 2 1 396.938 3.208 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCc1ccc(Cl)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185660018 1431198556 /nfs/dbraw/zinc/19/85/56/1431198556.db2.gz RYZHOOUNSQYIDE-WMZOPIPTSA-N 2 1 377.960 3.241 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185660018 1431198562 /nfs/dbraw/zinc/19/85/62/1431198562.db2.gz RYZHOOUNSQYIDE-WMZOPIPTSA-N 2 1 377.960 3.241 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185677396 1431203096 /nfs/dbraw/zinc/20/30/96/1431203096.db2.gz YCZJAZLPVJNQJP-IXDOHACOSA-N 2 1 387.524 3.027 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185677396 1431203099 /nfs/dbraw/zinc/20/30/99/1431203099.db2.gz YCZJAZLPVJNQJP-IXDOHACOSA-N 2 1 387.524 3.027 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000185680149 1431203841 /nfs/dbraw/zinc/20/38/41/1431203841.db2.gz OYENDEQUBMLSLI-BJLQDIEVSA-N 2 1 396.579 3.458 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000185680149 1431203850 /nfs/dbraw/zinc/20/38/50/1431203850.db2.gz OYENDEQUBMLSLI-BJLQDIEVSA-N 2 1 396.579 3.458 20 0 GGADMP COc1ccc(Cl)cc1CNC(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185683546 1431205082 /nfs/dbraw/zinc/20/50/82/1431205082.db2.gz OVVBUGQOOWJRDI-HOTGVXAUSA-N 2 1 393.959 3.207 20 0 GGADMP COc1ccc(Cl)cc1CNC(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185683546 1431205085 /nfs/dbraw/zinc/20/50/85/1431205085.db2.gz OVVBUGQOOWJRDI-HOTGVXAUSA-N 2 1 393.959 3.207 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185685944 1431205949 /nfs/dbraw/zinc/20/59/49/1431205949.db2.gz ZVWKEIDVTDQFRP-RTBURBONSA-N 2 1 384.568 3.468 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185685944 1431205955 /nfs/dbraw/zinc/20/59/55/1431205955.db2.gz ZVWKEIDVTDQFRP-RTBURBONSA-N 2 1 384.568 3.468 20 0 GGADMP COc1ccc2c(c1)CCCN2C(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185689462 1431206700 /nfs/dbraw/zinc/20/67/00/1431206700.db2.gz VNCZXYPTDNETJF-HKUYNNGSSA-N 2 1 385.552 3.217 20 0 GGADMP COc1ccc2c(c1)CCCN2C(=O)C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185689462 1431206710 /nfs/dbraw/zinc/20/67/10/1431206710.db2.gz VNCZXYPTDNETJF-HKUYNNGSSA-N 2 1 385.552 3.217 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C(=O)N(C)Cc1cccc(F)c1 ZINC000185704240 1431210803 /nfs/dbraw/zinc/21/08/03/1431210803.db2.gz NSJZFVXDGYUWLT-JENIJYKNSA-N 2 1 375.532 3.415 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C(=O)N(C)Cc1cccc(F)c1 ZINC000185704240 1431210812 /nfs/dbraw/zinc/21/08/12/1431210812.db2.gz NSJZFVXDGYUWLT-JENIJYKNSA-N 2 1 375.532 3.415 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N(C)Cc1cccc(F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185704259 1431210877 /nfs/dbraw/zinc/21/08/77/1431210877.db2.gz NSJZFVXDGYUWLT-ZIFCJYIRSA-N 2 1 375.532 3.415 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N(C)Cc1cccc(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185704259 1431210886 /nfs/dbraw/zinc/21/08/86/1431210886.db2.gz NSJZFVXDGYUWLT-ZIFCJYIRSA-N 2 1 375.532 3.415 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)C(=O)N(C)Cc1cccc(F)c1 ZINC000185704276 1431211038 /nfs/dbraw/zinc/21/10/38/1431211038.db2.gz NSJZFVXDGYUWLT-LNLFQRSKSA-N 2 1 375.532 3.415 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C(=O)N(C)Cc1cccc(F)c1 ZINC000185704276 1431211042 /nfs/dbraw/zinc/21/10/42/1431211042.db2.gz NSJZFVXDGYUWLT-LNLFQRSKSA-N 2 1 375.532 3.415 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCc1ccc(OC(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185708069 1431211654 /nfs/dbraw/zinc/21/16/54/1431211654.db2.gz JYMAOUBJDQBADV-WBVHZDCISA-N 2 1 395.494 3.147 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCc1ccc(OC(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185708069 1431211664 /nfs/dbraw/zinc/21/16/64/1431211664.db2.gz JYMAOUBJDQBADV-WBVHZDCISA-N 2 1 395.494 3.147 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185707866 1431211714 /nfs/dbraw/zinc/21/17/14/1431211714.db2.gz HQOMYDICJQFICE-UONOGXRCSA-N 2 1 395.450 3.189 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185707866 1431211720 /nfs/dbraw/zinc/21/17/20/1431211720.db2.gz HQOMYDICJQFICE-UONOGXRCSA-N 2 1 395.450 3.189 20 0 GGADMP CCOCc1ccccc1CNC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185711902 1431212707 /nfs/dbraw/zinc/21/27/07/1431212707.db2.gz LWTDUIQSCSIJGM-AZUAARDMSA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccccc1CNC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185711902 1431212709 /nfs/dbraw/zinc/21/27/09/1431212709.db2.gz LWTDUIQSCSIJGM-AZUAARDMSA-N 2 1 387.568 3.082 20 0 GGADMP CCCOc1ccc(CNC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185711984 1431212972 /nfs/dbraw/zinc/21/29/72/1431212972.db2.gz CDDGVDPAYANFPC-AZUAARDMSA-N 2 1 387.568 3.334 20 0 GGADMP CCCOc1ccc(CNC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185711984 1431212975 /nfs/dbraw/zinc/21/29/75/1431212975.db2.gz CDDGVDPAYANFPC-AZUAARDMSA-N 2 1 387.568 3.334 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)Nc1ccccc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185714787 1431213929 /nfs/dbraw/zinc/21/39/29/1431213929.db2.gz YWYKCGSAUVKCDK-OWCLPIDISA-N 2 1 390.503 3.105 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)Nc1ccccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185714787 1431213943 /nfs/dbraw/zinc/21/39/43/1431213943.db2.gz YWYKCGSAUVKCDK-OWCLPIDISA-N 2 1 390.503 3.105 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C(=O)NCCc1ccc(F)cc1 ZINC000185720206 1431215170 /nfs/dbraw/zinc/21/51/70/1431215170.db2.gz BSPMAYAFMBHEDY-JENIJYKNSA-N 2 1 375.532 3.116 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C(=O)NCCc1ccc(F)cc1 ZINC000185720206 1431215175 /nfs/dbraw/zinc/21/51/75/1431215175.db2.gz BSPMAYAFMBHEDY-JENIJYKNSA-N 2 1 375.532 3.116 20 0 GGADMP C[C@@H]([NH2+]CCCOc1ccc(S(C)(=O)=O)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185724006 1431216096 /nfs/dbraw/zinc/21/60/96/1431216096.db2.gz CBFYSAHZDCWYIS-QZTJIDSGSA-N 2 1 394.581 3.102 20 0 GGADMP C[C@H]([NH2+]C[C@H](O)COCc1ccccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185733337 1431218638 /nfs/dbraw/zinc/21/86/38/1431218638.db2.gz NUMPTASHWXBNDB-QKLQHJQFSA-N 2 1 380.960 3.460 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000185741919 1431220774 /nfs/dbraw/zinc/22/07/74/1431220774.db2.gz MIINHHASKUSBMM-ULQDDVLXSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1OC ZINC000185741919 1431220782 /nfs/dbraw/zinc/22/07/82/1431220782.db2.gz MIINHHASKUSBMM-ULQDDVLXSA-N 2 1 389.540 3.273 20 0 GGADMP Cc1ccc(S(=O)(=O)CCC[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185743978 1431221597 /nfs/dbraw/zinc/22/15/97/1431221597.db2.gz QOVSAFGHCMIUGO-RBUKOAKNSA-N 2 1 378.582 3.401 20 0 GGADMP Cc1ccc(S(=O)(=O)CCC[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185743978 1431221600 /nfs/dbraw/zinc/22/16/00/1431221600.db2.gz QOVSAFGHCMIUGO-RBUKOAKNSA-N 2 1 378.582 3.401 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185748047 1431222661 /nfs/dbraw/zinc/22/26/61/1431222661.db2.gz GQCLEYNUFOQIKX-BMQTXXJKSA-N 2 1 385.552 3.258 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185748047 1431222664 /nfs/dbraw/zinc/22/26/64/1431222664.db2.gz GQCLEYNUFOQIKX-BMQTXXJKSA-N 2 1 385.552 3.258 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCOc1ccc(Cl)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185757686 1431226949 /nfs/dbraw/zinc/22/69/49/1431226949.db2.gz BNJXUZQNJGSUIA-IRXDYDNUSA-N 2 1 393.959 3.078 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCOc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185757686 1431226956 /nfs/dbraw/zinc/22/69/56/1431226956.db2.gz BNJXUZQNJGSUIA-IRXDYDNUSA-N 2 1 393.959 3.078 20 0 GGADMP Cc1cc2ncn(C[C@@H](O)C[NH2+][C@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)c2cc1C ZINC000185761199 1431227436 /nfs/dbraw/zinc/22/74/36/1431227436.db2.gz FYDFOTOHFTWOOG-SBHAEUEKSA-N 2 1 384.568 3.257 20 0 GGADMP Cc1cc2ncn(C[C@H](O)C[NH2+][C@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)c2cc1C ZINC000185761183 1431227605 /nfs/dbraw/zinc/22/76/05/1431227605.db2.gz FYDFOTOHFTWOOG-SFHLNBCPSA-N 2 1 384.568 3.257 20 0 GGADMP Cc1cc(NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)n(C(C)(C)C)n1 ZINC000185762716 1431227849 /nfs/dbraw/zinc/22/78/49/1431227849.db2.gz PLPCZMZZRSAMQS-IAGOWNOFSA-N 2 1 375.561 3.128 20 0 GGADMP Cc1cc(NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)n(C(C)(C)C)n1 ZINC000185762716 1431227853 /nfs/dbraw/zinc/22/78/53/1431227853.db2.gz PLPCZMZZRSAMQS-IAGOWNOFSA-N 2 1 375.561 3.128 20 0 GGADMP Cc1cc(NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)n(C(C)(C)C)n1 ZINC000185762697 1431228065 /nfs/dbraw/zinc/22/80/65/1431228065.db2.gz PLPCZMZZRSAMQS-DLBZAZTESA-N 2 1 375.561 3.128 20 0 GGADMP Cc1cc(NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)n(C(C)(C)C)n1 ZINC000185762697 1431228069 /nfs/dbraw/zinc/22/80/69/1431228069.db2.gz PLPCZMZZRSAMQS-DLBZAZTESA-N 2 1 375.561 3.128 20 0 GGADMP CCCOc1cccc(CNC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185764789 1431228429 /nfs/dbraw/zinc/22/84/29/1431228429.db2.gz VDZPCBYUKSIHCT-QUCCMNQESA-N 2 1 387.568 3.334 20 0 GGADMP CCCOc1cccc(CNC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185764789 1431228438 /nfs/dbraw/zinc/22/84/38/1431228438.db2.gz VDZPCBYUKSIHCT-QUCCMNQESA-N 2 1 387.568 3.334 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(N2CCCCC2)nc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185766661 1431229022 /nfs/dbraw/zinc/22/90/22/1431229022.db2.gz IZSVWLZKLBJOGY-RBUKOAKNSA-N 2 1 399.583 3.253 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(N2CCCCC2)nc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766661 1431229025 /nfs/dbraw/zinc/22/90/25/1431229025.db2.gz IZSVWLZKLBJOGY-RBUKOAKNSA-N 2 1 399.583 3.253 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCCC2)nc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185766683 1431229273 /nfs/dbraw/zinc/22/92/73/1431229273.db2.gz IZSVWLZKLBJOGY-RTBURBONSA-N 2 1 399.583 3.253 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCCC2)nc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766683 1431229278 /nfs/dbraw/zinc/22/92/78/1431229278.db2.gz IZSVWLZKLBJOGY-RTBURBONSA-N 2 1 399.583 3.253 20 0 GGADMP Cc1ccc(NC(=O)CCn2cc[nH+]c2C(C)C)cc1NC(=O)CC[NH+](C)C ZINC000185847340 1431250684 /nfs/dbraw/zinc/25/06/84/1431250684.db2.gz RGOAMURTYNWYAA-UHFFFAOYSA-N 2 1 385.512 3.234 20 0 GGADMP Cc1ccc(NC(=O)[C@H](c2ccccc2)[NH+](C)C)cc1NC(=O)CC[NH+](C)C ZINC000185849525 1431251509 /nfs/dbraw/zinc/25/15/09/1431251509.db2.gz GCQDPJJIRLTJLJ-NRFANRHFSA-N 2 1 382.508 3.127 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000186274003 1431368985 /nfs/dbraw/zinc/36/89/85/1431368985.db2.gz CRWDQLBCIJYXDW-KRWDZBQOSA-N 2 1 390.553 3.205 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000186274003 1431368990 /nfs/dbraw/zinc/36/89/90/1431368990.db2.gz CRWDQLBCIJYXDW-KRWDZBQOSA-N 2 1 390.553 3.205 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000186310880 1431379162 /nfs/dbraw/zinc/37/91/62/1431379162.db2.gz SFQWBMQQJNUHED-ROUUACIJSA-N 2 1 398.551 3.365 20 0 GGADMP Cc1cnn([C@H]2CC[N@@H+](Cc3ccccc3)C2)c1NC(=O)c1ccc(C[NH3+])cc1 ZINC000186472194 1431429342 /nfs/dbraw/zinc/42/93/42/1431429342.db2.gz XAKIAQYHIZKJIH-NRFANRHFSA-N 2 1 389.503 3.350 20 0 GGADMP COC(=O)N1CCC([C@@H](C)[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000186765527 1431511306 /nfs/dbraw/zinc/51/13/06/1431511306.db2.gz NEAVJKHJGXTGDB-QGZVFWFLSA-N 2 1 391.531 3.289 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(F)c(OC)cc1C ZINC000186812915 1431524739 /nfs/dbraw/zinc/52/47/39/1431524739.db2.gz ZNPYJQUZIXZBCV-INIZCTEOSA-N 2 1 380.508 3.023 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)C1CCS(=O)(=O)CC1 ZINC000187004134 1431587135 /nfs/dbraw/zinc/58/71/35/1431587135.db2.gz DIIQLTRNTISGQI-MSOLQXFVSA-N 2 1 378.582 3.221 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)C1CCS(=O)(=O)CC1 ZINC000187010127 1431588823 /nfs/dbraw/zinc/58/88/23/1431588823.db2.gz ADVAKCONGOINCR-ROUUACIJSA-N 2 1 378.582 3.364 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@H](C)C1 ZINC000187012582 1431589440 /nfs/dbraw/zinc/58/94/40/1431589440.db2.gz WNXYUOILIWNNPG-DYXWJJEUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@H](C)C1 ZINC000187012582 1431589442 /nfs/dbraw/zinc/58/94/42/1431589442.db2.gz WNXYUOILIWNNPG-DYXWJJEUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@H](C)C1 ZINC000187012582 1431589445 /nfs/dbraw/zinc/58/94/45/1431589445.db2.gz WNXYUOILIWNNPG-DYXWJJEUSA-N 2 1 375.557 3.357 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)C1CCS(=O)(=O)CC1 ZINC000187013727 1431589810 /nfs/dbraw/zinc/58/98/10/1431589810.db2.gz JHVRCFUJTOIEHK-OTWHNJEPSA-N 2 1 392.609 3.467 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)[C@H](C)C1 ZINC000187013783 1431589879 /nfs/dbraw/zinc/58/98/79/1431589879.db2.gz DJOBNRZJBGPCNU-URVUXULASA-N 2 1 389.584 3.207 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)[C@H](C)C1 ZINC000187013783 1431589883 /nfs/dbraw/zinc/58/98/83/1431589883.db2.gz DJOBNRZJBGPCNU-URVUXULASA-N 2 1 389.584 3.207 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(CC)cc2)[C@@H](C)C1 ZINC000187014722 1431590448 /nfs/dbraw/zinc/59/04/48/1431590448.db2.gz SLGAKIXQQJVSGF-WFXMLNOXSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(CC)cc2)[C@@H](C)C1 ZINC000187014722 1431590450 /nfs/dbraw/zinc/59/04/50/1431590450.db2.gz SLGAKIXQQJVSGF-WFXMLNOXSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000187015350 1431590917 /nfs/dbraw/zinc/59/09/17/1431590917.db2.gz FOCWKZKJJRUUIF-OEMYIYORSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000187015350 1431590921 /nfs/dbraw/zinc/59/09/21/1431590921.db2.gz FOCWKZKJJRUUIF-OEMYIYORSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(OCC)cc2)[C@H](C)C1 ZINC000187018036 1431591260 /nfs/dbraw/zinc/59/12/60/1431591260.db2.gz SPBYHIHVPAELGG-LQWHRVPQSA-N 2 1 391.556 3.139 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(OCC)cc2)[C@H](C)C1 ZINC000187018036 1431591263 /nfs/dbraw/zinc/59/12/63/1431591263.db2.gz SPBYHIHVPAELGG-LQWHRVPQSA-N 2 1 391.556 3.139 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)ccc2C)[C@H](C)C1 ZINC000187024609 1431593525 /nfs/dbraw/zinc/59/35/25/1431593525.db2.gz WIULXYNPLCKKQI-HSALFYBXSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)ccc2C)[C@H](C)C1 ZINC000187024609 1431593529 /nfs/dbraw/zinc/59/35/29/1431593529.db2.gz WIULXYNPLCKKQI-HSALFYBXSA-N 2 1 375.557 3.357 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)C1CCSCC1 ZINC000187186621 1431640762 /nfs/dbraw/zinc/64/07/62/1431640762.db2.gz PMSGVHBNTZJYFB-JXFKEZNVSA-N 2 1 375.582 3.005 20 0 GGADMP CN1c2ccc(C[NH2+]C[C@@H]3CC[N@@H+](CCc4ccccc4)C3)cc2CCC1=O ZINC000187198090 1431644360 /nfs/dbraw/zinc/64/43/60/1431644360.db2.gz LZWIFGDBLUODHX-NRFANRHFSA-N 2 1 377.532 3.250 20 0 GGADMP C[C@H](CNC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)[NH+](C)C)[N@@H+](C)C1CC1 ZINC000187256771 1431668955 /nfs/dbraw/zinc/66/89/55/1431668955.db2.gz BQOIXQRHNUAZFS-CXAGYDPISA-N 2 1 386.462 3.090 20 0 GGADMP CC[NH+]1CCN(c2cccc(NC(=O)[C@H]3CC[N@H+](C4CCCCC4)C3)c2)CC1 ZINC000187405701 1431720949 /nfs/dbraw/zinc/72/09/49/1431720949.db2.gz FJSUOGKKXKYRDH-IBGZPJMESA-N 2 1 384.568 3.422 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CCC[C@H]2C[NH+](C)CC[C@@H]21 ZINC000187482838 1431745149 /nfs/dbraw/zinc/74/51/49/1431745149.db2.gz YQYZZBNBCSXWNB-FKBYEOEOSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@@H]21 ZINC000187482838 1431745154 /nfs/dbraw/zinc/74/51/54/1431745154.db2.gz YQYZZBNBCSXWNB-FKBYEOEOSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21 ZINC000187482838 1431745158 /nfs/dbraw/zinc/74/51/58/1431745158.db2.gz YQYZZBNBCSXWNB-FKBYEOEOSA-N 2 1 386.584 3.269 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)C1CC1 ZINC000187584628 1431772980 /nfs/dbraw/zinc/77/29/80/1431772980.db2.gz YVJFJCVXGVTIRQ-NRFANRHFSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H](Cc1ccccc1F)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000187987446 1431833927 /nfs/dbraw/zinc/83/39/27/1431833927.db2.gz RMBXLPSOIMJHSB-UWJYYQICSA-N 2 1 383.511 3.244 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC(C)(C)CC[NH+]2CCCCCC2)cn1 ZINC000188467234 1431886482 /nfs/dbraw/zinc/88/64/82/1431886482.db2.gz GZAAPLRQZZVZMT-UHFFFAOYSA-N 2 1 398.555 3.420 20 0 GGADMP C[C@]1(Cc2ccccc2)CCN(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)C1=O ZINC000188692269 1431935646 /nfs/dbraw/zinc/93/56/46/1431935646.db2.gz IOVUKZMHGKZCDP-XMMPIXPASA-N 2 1 399.579 3.002 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3ccn(-c4ccccc4F)n3)CC2)C[C@H](C)O1 ZINC000188932346 1432011446 /nfs/dbraw/zinc/01/14/46/1432011446.db2.gz BESUCCCEKAEXOD-HDICACEKSA-N 2 1 386.515 3.333 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3ccn(-c4ccccc4F)n3)CC2)C[C@H](C)O1 ZINC000188932346 1432011454 /nfs/dbraw/zinc/01/14/54/1432011454.db2.gz BESUCCCEKAEXOD-HDICACEKSA-N 2 1 386.515 3.333 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000189004309 1432025301 /nfs/dbraw/zinc/02/53/01/1432025301.db2.gz OPIFPHSJTMQZTJ-VIQWUECVSA-N 2 1 383.536 3.448 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(Cl)cc2F)CC1 ZINC000189039635 1432032391 /nfs/dbraw/zinc/03/23/91/1432032391.db2.gz LMIDKMDFUKSDSI-UHFFFAOYSA-N 2 1 383.939 3.395 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000189581386 1432166157 /nfs/dbraw/zinc/16/61/57/1432166157.db2.gz VKLUTGCVEYRBQS-LJQANCHMSA-N 2 1 388.556 3.420 20 0 GGADMP CN(CC1([NH+](C)C)CCC1)C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000189691876 1432206208 /nfs/dbraw/zinc/20/62/08/1432206208.db2.gz BESWBCWNHRNQAP-UHFFFAOYSA-N 2 1 394.510 3.055 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)NC[C@@H](C)[N@@H+]1CCc2sccc2C1 ZINC000190129755 1432324730 /nfs/dbraw/zinc/32/47/30/1432324730.db2.gz WPKPTPAYBYYAOO-QGZVFWFLSA-N 2 1 378.586 3.012 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)NC[C@@H](C)[N@H+]1CCc2sccc2C1 ZINC000190129755 1432324735 /nfs/dbraw/zinc/32/47/35/1432324735.db2.gz WPKPTPAYBYYAOO-QGZVFWFLSA-N 2 1 378.586 3.012 20 0 GGADMP CC[N@@H+](CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)Cc1c[nH]c2ccccc12 ZINC000190480128 1432389566 /nfs/dbraw/zinc/38/95/66/1432389566.db2.gz YXCBVXRYOFJQPR-JOCHJYFZSA-N 2 1 378.520 3.409 20 0 GGADMP Cc1cc(C)c(N2CC[C@@H]([NH+]3CCC(OCC[NH+]4CCCC4)CC3)C2=O)c(C)c1 ZINC000190619404 1432422673 /nfs/dbraw/zinc/42/26/73/1432422673.db2.gz APNYAXUXSFSACN-JOCHJYFZSA-N 2 1 399.579 3.294 20 0 GGADMP COCCN(C)c1ccc(C[NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)cn1 ZINC000190870240 1432514258 /nfs/dbraw/zinc/51/42/58/1432514258.db2.gz PQTZROFISIHHGR-UHFFFAOYSA-N 2 1 383.471 3.087 20 0 GGADMP COCCN(C)c1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)cn1 ZINC000190910563 1432527100 /nfs/dbraw/zinc/52/71/00/1432527100.db2.gz MDQVFEYQLRITCD-IBGZPJMESA-N 2 1 388.581 3.228 20 0 GGADMP COCCN(C)c1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cn1 ZINC000190910563 1432527106 /nfs/dbraw/zinc/52/71/06/1432527106.db2.gz MDQVFEYQLRITCD-IBGZPJMESA-N 2 1 388.581 3.228 20 0 GGADMP COCCN(C)c1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)cn1 ZINC000190910582 1432527175 /nfs/dbraw/zinc/52/71/75/1432527175.db2.gz MDQVFEYQLRITCD-LJQANCHMSA-N 2 1 388.581 3.228 20 0 GGADMP COCCN(C)c1ccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)cn1 ZINC000190910582 1432527181 /nfs/dbraw/zinc/52/71/81/1432527181.db2.gz MDQVFEYQLRITCD-LJQANCHMSA-N 2 1 388.581 3.228 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3nccn3-c3ccccc3)CC2)oc1C ZINC000191010652 1432549500 /nfs/dbraw/zinc/54/95/00/1432549500.db2.gz PJMAZKRIMMWNDS-UHFFFAOYSA-N 2 1 379.508 3.479 20 0 GGADMP Cc1cc(C)c(N2CC[C@H]([N@H+]3CCC[C@H](Cc4nccn4C)C3)C2=O)c(C)c1 ZINC000191019564 1432551089 /nfs/dbraw/zinc/55/10/89/1432551089.db2.gz JGNOSLMWTSWSJE-UXHICEINSA-N 2 1 380.536 3.405 20 0 GGADMP Cc1cc(C)c(N2CC[C@H]([N@@H+]3CCC[C@H](Cc4[nH+]ccn4C)C3)C2=O)c(C)c1 ZINC000191019564 1432551093 /nfs/dbraw/zinc/55/10/93/1432551093.db2.gz JGNOSLMWTSWSJE-UXHICEINSA-N 2 1 380.536 3.405 20 0 GGADMP COCCN(C)c1ccc(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)cn1 ZINC000191092051 1432565988 /nfs/dbraw/zinc/56/59/88/1432565988.db2.gz USIRZNULPQWSOL-IBGZPJMESA-N 2 1 382.552 3.479 20 0 GGADMP C[C@@H](C[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000191154296 1432577338 /nfs/dbraw/zinc/57/73/38/1432577338.db2.gz KOICONFZYCSIAB-HNNXBMFYSA-N 2 1 393.457 3.141 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CCN(Cc3cccc4ccccc43)CC2)CC1 ZINC000191418018 1432657851 /nfs/dbraw/zinc/65/78/51/1432657851.db2.gz OUWIRWSDHYLWJU-UHFFFAOYSA-N 2 1 394.607 3.374 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)NC(=O)Nc1ccccc1F ZINC000191472469 1432668157 /nfs/dbraw/zinc/66/81/57/1432668157.db2.gz HTOHEEUAIGVNJE-HNNXBMFYSA-N 2 1 389.475 3.033 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)NC(=O)Nc1ccccc1F ZINC000191472469 1432668160 /nfs/dbraw/zinc/66/81/60/1432668160.db2.gz HTOHEEUAIGVNJE-HNNXBMFYSA-N 2 1 389.475 3.033 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)Nc1ccc(OC(F)F)cc1 ZINC000191491398 1432671044 /nfs/dbraw/zinc/67/10/44/1432671044.db2.gz NLACDMJYYCKLPV-UHFFFAOYSA-N 2 1 380.439 3.398 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)Nc1ccc(OC(F)F)cc1 ZINC000191491398 1432671048 /nfs/dbraw/zinc/67/10/48/1432671048.db2.gz NLACDMJYYCKLPV-UHFFFAOYSA-N 2 1 380.439 3.398 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@H](C(=O)c3ccc(F)cc3)C2)CC1 ZINC000191504651 1432674743 /nfs/dbraw/zinc/67/47/43/1432674743.db2.gz PZSDJTVAROUEFM-FQEVSTJZSA-N 2 1 375.532 3.137 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)Nc1cc(OC)ccc1OC ZINC000191513563 1432676320 /nfs/dbraw/zinc/67/63/20/1432676320.db2.gz AXRRXSHGXRHTKP-MRXNPFEDSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)Nc1cc(OC)ccc1OC ZINC000191513563 1432676325 /nfs/dbraw/zinc/67/63/25/1432676325.db2.gz AXRRXSHGXRHTKP-MRXNPFEDSA-N 2 1 388.512 3.202 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537953 1432680004 /nfs/dbraw/zinc/68/00/04/1432680004.db2.gz KUFNDFXEFFAVKG-LADGPHEKSA-N 2 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537953 1432680008 /nfs/dbraw/zinc/68/00/08/1432680008.db2.gz KUFNDFXEFFAVKG-LADGPHEKSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537953 1432680013 /nfs/dbraw/zinc/68/00/13/1432680013.db2.gz KUFNDFXEFFAVKG-LADGPHEKSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537953 1432680019 /nfs/dbraw/zinc/68/00/19/1432680019.db2.gz KUFNDFXEFFAVKG-LADGPHEKSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537953 1432680023 /nfs/dbraw/zinc/68/00/23/1432680023.db2.gz KUFNDFXEFFAVKG-LADGPHEKSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537980 1432680110 /nfs/dbraw/zinc/68/01/10/1432680110.db2.gz KUFNDFXEFFAVKG-UPVQGACJSA-N 2 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537980 1432680113 /nfs/dbraw/zinc/68/01/13/1432680113.db2.gz KUFNDFXEFFAVKG-UPVQGACJSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537980 1432680115 /nfs/dbraw/zinc/68/01/15/1432680115.db2.gz KUFNDFXEFFAVKG-UPVQGACJSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537980 1432680117 /nfs/dbraw/zinc/68/01/17/1432680117.db2.gz KUFNDFXEFFAVKG-UPVQGACJSA-N 3 1 386.628 3.387 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000191537980 1432680120 /nfs/dbraw/zinc/68/01/20/1432680120.db2.gz KUFNDFXEFFAVKG-UPVQGACJSA-N 3 1 386.628 3.387 20 0 GGADMP CCOC(=O)c1csc(CC[NH2+][C@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000191561826 1432683140 /nfs/dbraw/zinc/68/31/40/1432683140.db2.gz FBYGYJXUZMREGB-FHWLQOOXSA-N 2 1 399.560 3.363 20 0 GGADMP COc1cccc2c1CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)C2 ZINC000192447617 1432845829 /nfs/dbraw/zinc/84/58/29/1432845829.db2.gz MHBHGYQTWPYNLM-FGZHOGPDSA-N 2 1 380.532 3.299 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)CC1 ZINC000192773261 1432888585 /nfs/dbraw/zinc/88/85/85/1432888585.db2.gz LSFVLWSROATTSI-WOJBJXKFSA-N 2 1 396.620 3.028 20 0 GGADMP CCOC(=O)c1oc2c(c1C)[C@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)CCC2 ZINC000192829212 1432895995 /nfs/dbraw/zinc/89/59/95/1432895995.db2.gz GFSUWUYKAPHBDT-GOSISDBHSA-N 2 1 391.556 3.005 20 0 GGADMP Cc1c(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(=O)n(-c2ccccc2)n1C ZINC000192929549 1432909222 /nfs/dbraw/zinc/90/92/22/1432909222.db2.gz PAXIOKGJHWBVNI-NRFANRHFSA-N 2 1 390.531 3.096 20 0 GGADMP Cc1c(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(=O)n(-c2ccccc2)n1C ZINC000192929549 1432909225 /nfs/dbraw/zinc/90/92/25/1432909225.db2.gz PAXIOKGJHWBVNI-NRFANRHFSA-N 2 1 390.531 3.096 20 0 GGADMP COC(=O)COc1c(C)cc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000192934214 1432909860 /nfs/dbraw/zinc/90/98/60/1432909860.db2.gz XHYZKKGLHIFQPF-OAQYLSRUSA-N 2 1 396.531 3.467 20 0 GGADMP Cc1ccc(NCCCNC(=O)NCc2ccccc2C[NH+]2CCCC2)[nH+]c1 ZINC000192988447 1432917822 /nfs/dbraw/zinc/91/78/22/1432917822.db2.gz AIUAOKXNDLXXSG-UHFFFAOYSA-N 2 1 381.524 3.287 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000193005616 1432920776 /nfs/dbraw/zinc/92/07/76/1432920776.db2.gz WPMSPTMESMJMAB-HXUWFJFHSA-N 2 1 399.501 3.495 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000193005616 1432920780 /nfs/dbraw/zinc/92/07/80/1432920780.db2.gz WPMSPTMESMJMAB-HXUWFJFHSA-N 2 1 399.501 3.495 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]Cc2cc(Cl)cs2)c1 ZINC000193014001 1432922397 /nfs/dbraw/zinc/92/23/97/1432922397.db2.gz DJHJKHOVNROMQN-UHFFFAOYSA-N 2 1 393.940 3.352 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccc(C[NH+](C)C)cc1)[N@@H+]1CCc2sccc2C1 ZINC000193187848 1432954001 /nfs/dbraw/zinc/95/40/01/1432954001.db2.gz FDNMAQJOABPOOV-INIZCTEOSA-N 2 1 386.565 3.056 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccc(C[NH+](C)C)cc1)[N@H+]1CCc2sccc2C1 ZINC000193187848 1432954005 /nfs/dbraw/zinc/95/40/05/1432954005.db2.gz FDNMAQJOABPOOV-INIZCTEOSA-N 2 1 386.565 3.056 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)[nH+]c1 ZINC000193274396 1432972627 /nfs/dbraw/zinc/97/26/27/1432972627.db2.gz NPRSDNYHPWUWOO-UHFFFAOYSA-N 2 1 395.551 3.464 20 0 GGADMP CCOC1CC(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)(N2CCOCC2)C1 ZINC000193402846 1432991887 /nfs/dbraw/zinc/99/18/87/1432991887.db2.gz MOUGQFCVSBQAFR-WDGBRCNXSA-N 2 1 398.551 3.101 20 0 GGADMP COc1ccc(C[N@H+](C)CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000193627192 1433030956 /nfs/dbraw/zinc/03/09/56/1433030956.db2.gz MBOGEARJLCYUTI-UHFFFAOYSA-N 2 1 381.520 3.039 20 0 GGADMP COc1ccc(C[N@@H+](C)CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000193627192 1433030957 /nfs/dbraw/zinc/03/09/57/1433030957.db2.gz MBOGEARJLCYUTI-UHFFFAOYSA-N 2 1 381.520 3.039 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2)[nH+]c1 ZINC000193712110 1433045131 /nfs/dbraw/zinc/04/51/31/1433045131.db2.gz PAQMJCKVOMIMGI-UHFFFAOYSA-N 2 1 387.503 3.105 20 0 GGADMP C[C@H](CNC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C)[NH+]1CCc2sccc2C1 ZINC000193757111 1433053550 /nfs/dbraw/zinc/05/35/50/1433053550.db2.gz YIQOGHQQLYXYLN-ZWKOTPCHSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@H](CNC(=O)NCCCC[N@H+]1CCCC[C@@H]1C)[NH+]1CCc2sccc2C1 ZINC000193757111 1433053551 /nfs/dbraw/zinc/05/35/51/1433053551.db2.gz YIQOGHQQLYXYLN-ZWKOTPCHSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCCC[C@@H]1C)[N@@H+]1CCc2sccc2C1 ZINC000193757111 1433053552 /nfs/dbraw/zinc/05/35/52/1433053552.db2.gz YIQOGHQQLYXYLN-ZWKOTPCHSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCCC[C@@H]1C)[N@H+]1CCc2sccc2C1 ZINC000193757111 1433053553 /nfs/dbraw/zinc/05/35/53/1433053553.db2.gz YIQOGHQQLYXYLN-ZWKOTPCHSA-N 2 1 392.613 3.449 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCC[NH+]1Cc1ccccc1 ZINC000193803102 1433062869 /nfs/dbraw/zinc/06/28/69/1433062869.db2.gz KHCMSUMYDUWTHC-GOTSBHOMSA-N 2 1 377.532 3.289 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000193803102 1433062875 /nfs/dbraw/zinc/06/28/75/1433062875.db2.gz KHCMSUMYDUWTHC-GOTSBHOMSA-N 2 1 377.532 3.289 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000193803102 1433062878 /nfs/dbraw/zinc/06/28/78/1433062878.db2.gz KHCMSUMYDUWTHC-GOTSBHOMSA-N 2 1 377.532 3.289 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NC[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)[nH+]c1 ZINC000193809317 1433064568 /nfs/dbraw/zinc/06/45/68/1433064568.db2.gz GWPYIISRPFOJDE-OAQYLSRUSA-N 2 1 392.547 3.245 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NC[C@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)[nH+]c1 ZINC000193809317 1433064571 /nfs/dbraw/zinc/06/45/71/1433064571.db2.gz GWPYIISRPFOJDE-OAQYLSRUSA-N 2 1 392.547 3.245 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[N@@H+]1CCc2sccc2C1 ZINC000193835966 1433069631 /nfs/dbraw/zinc/06/96/31/1433069631.db2.gz XNPCEAMHFMJDRZ-HNNXBMFYSA-N 2 1 378.586 3.057 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[N@H+]1CCc2sccc2C1 ZINC000193835966 1433069634 /nfs/dbraw/zinc/06/96/34/1433069634.db2.gz XNPCEAMHFMJDRZ-HNNXBMFYSA-N 2 1 378.586 3.057 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC[N@H+](Cc3ccccc3)CC2)[nH+]c1 ZINC000193853902 1433073848 /nfs/dbraw/zinc/07/38/48/1433073848.db2.gz SFJAAOVIBOUNAA-UHFFFAOYSA-N 2 1 381.524 3.110 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)[nH+]c1 ZINC000193853902 1433073852 /nfs/dbraw/zinc/07/38/52/1433073852.db2.gz SFJAAOVIBOUNAA-UHFFFAOYSA-N 2 1 381.524 3.110 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000193926494 1433086216 /nfs/dbraw/zinc/08/62/16/1433086216.db2.gz RXDIFRLJCQNKJU-IFMALSPDSA-N 2 1 380.536 3.111 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000194020809 1433102289 /nfs/dbraw/zinc/10/22/89/1433102289.db2.gz LFOYFOSPHLWISN-UNMCSNQZSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000194020809 1433102290 /nfs/dbraw/zinc/10/22/90/1433102290.db2.gz LFOYFOSPHLWISN-UNMCSNQZSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000194020809 1433102291 /nfs/dbraw/zinc/10/22/91/1433102291.db2.gz LFOYFOSPHLWISN-UNMCSNQZSA-N 2 1 386.584 3.320 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000194069717 1433111306 /nfs/dbraw/zinc/11/13/06/1433111306.db2.gz YFPLXTASMAJJRD-KNQAVFIVSA-N 2 1 398.526 3.250 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000194106542 1433118609 /nfs/dbraw/zinc/11/86/09/1433118609.db2.gz FHOQJCHTURJERF-SFTDATJTSA-N 2 1 398.551 3.484 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[NH+](C2CCCC2)CC1 ZINC000194445467 1433179206 /nfs/dbraw/zinc/17/92/06/1433179206.db2.gz DBDIABDUGJVEPT-NRFANRHFSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000194445467 1433179208 /nfs/dbraw/zinc/17/92/08/1433179208.db2.gz DBDIABDUGJVEPT-NRFANRHFSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000194445467 1433179210 /nfs/dbraw/zinc/17/92/10/1433179210.db2.gz DBDIABDUGJVEPT-NRFANRHFSA-N 2 1 384.568 3.168 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)N(C)CC[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)C ZINC000194735145 1433222010 /nfs/dbraw/zinc/22/20/10/1433222010.db2.gz RFOCKROXIMCYCO-KDURUIRLSA-N 2 1 375.557 3.098 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N(C)CC[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)C ZINC000194735145 1433222015 /nfs/dbraw/zinc/22/20/15/1433222015.db2.gz RFOCKROXIMCYCO-KDURUIRLSA-N 2 1 375.557 3.098 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)C ZINC000194735145 1433222018 /nfs/dbraw/zinc/22/20/18/1433222018.db2.gz RFOCKROXIMCYCO-KDURUIRLSA-N 2 1 375.557 3.098 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N(C)CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)C ZINC000194735145 1433222022 /nfs/dbraw/zinc/22/20/22/1433222022.db2.gz RFOCKROXIMCYCO-KDURUIRLSA-N 2 1 375.557 3.098 20 0 GGADMP C[C@H](C(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000194746831 1433223736 /nfs/dbraw/zinc/22/37/36/1433223736.db2.gz KHUKHDLSTZZERB-CTNGQTDRSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@H](C(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000194746831 1433223739 /nfs/dbraw/zinc/22/37/39/1433223739.db2.gz KHUKHDLSTZZERB-CTNGQTDRSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@H](C(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000194746831 1433223743 /nfs/dbraw/zinc/22/37/43/1433223743.db2.gz KHUKHDLSTZZERB-CTNGQTDRSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000194746831 1433223748 /nfs/dbraw/zinc/22/37/48/1433223748.db2.gz KHUKHDLSTZZERB-CTNGQTDRSA-N 2 1 377.532 3.072 20 0 GGADMP COCC[NH+]1CCC(NC(=O)c2cccc(C[N@@H+](C)Cc3ccccc3)c2)CC1 ZINC000194834666 1433244006 /nfs/dbraw/zinc/24/40/06/1433244006.db2.gz UJBUWLYHXQNVIS-UHFFFAOYSA-N 2 1 395.547 3.159 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000194879374 1433254860 /nfs/dbraw/zinc/25/48/60/1433254860.db2.gz CGSWYQZZXWTGDE-NVXWUHKLSA-N 2 1 375.542 3.025 20 0 GGADMP CC(C)[NH+]1CCN(c2ccc(C(=O)NC[C@@H]3CCC[N@H+](C(C)C)C3)cc2)CC1 ZINC000194967625 1433274134 /nfs/dbraw/zinc/27/41/34/1433274134.db2.gz RWNGIAUBMOLKOF-FQEVSTJZSA-N 2 1 386.584 3.067 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000194982214 1433276172 /nfs/dbraw/zinc/27/61/72/1433276172.db2.gz OCRGBTHLSGILCQ-GOSISDBHSA-N 2 1 378.586 3.135 20 0 GGADMP c1c[nH]c([C@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c2cccnc2)n1 ZINC000195002640 1433279430 /nfs/dbraw/zinc/27/94/30/1433279430.db2.gz ZMSCTLHTLWKEOE-JOCHJYFZSA-N 2 1 390.535 3.086 20 0 GGADMP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](c3ncc[nH]3)c3cccnc3)CC2)cc1 ZINC000195012137 1433280666 /nfs/dbraw/zinc/28/06/66/1433280666.db2.gz QJJDLJOTLALTRA-JOCHJYFZSA-N 2 1 391.519 3.405 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000195132815 1433297008 /nfs/dbraw/zinc/29/70/08/1433297008.db2.gz CFLJKGBLKKLFFZ-FUHWJXTLSA-N 2 1 390.524 3.402 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000195132815 1433297012 /nfs/dbraw/zinc/29/70/12/1433297012.db2.gz CFLJKGBLKKLFFZ-FUHWJXTLSA-N 2 1 390.524 3.402 20 0 GGADMP Cc1ccc(NC(=O)C2CC[NH+](C3CC3)CC2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000195388492 1433325154 /nfs/dbraw/zinc/32/51/54/1433325154.db2.gz PSCUMEVETWVCHR-UHFFFAOYSA-N 2 1 398.551 3.232 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(-n3cccn3)cc2)CC1 ZINC000236842980 1433380754 /nfs/dbraw/zinc/38/07/54/1433380754.db2.gz JZHAFKBDYRRAIM-UHFFFAOYSA-N 2 1 389.547 3.300 20 0 GGADMP CC[C@H]([NH3+])C(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)c(Cl)c1 ZINC000236976573 1433384647 /nfs/dbraw/zinc/38/46/47/1433384647.db2.gz NYPBLDLUVNRKHU-IBGZPJMESA-N 2 1 386.927 3.338 20 0 GGADMP CCOc1c(Br)cc(C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1OC ZINC000237005674 1433385724 /nfs/dbraw/zinc/38/57/24/1433385724.db2.gz WPZWLBBIIAKIPV-CYBMUJFWSA-N 2 1 383.330 3.430 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C[C@H](C)[C@H]3CCC[NH2+]C3)CC2)cs1 ZINC000237042883 1433387169 /nfs/dbraw/zinc/38/71/69/1433387169.db2.gz JSPCUTLKRIVRLN-WMZOPIPTSA-N 2 1 392.613 3.060 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCCC[NH2+]2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000237116270 1433389788 /nfs/dbraw/zinc/38/97/88/1433389788.db2.gz KTIVVKVJDUFFCX-SZMVWBNQSA-N 2 1 383.458 3.347 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2cn(-c3ccccc3)nc2-c2cccnc2)CC1 ZINC000237129674 1433390281 /nfs/dbraw/zinc/39/02/81/1433390281.db2.gz CXFCSVOIGDWKDE-UHFFFAOYSA-N 2 1 391.519 3.135 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2cc(Cl)ccc2Br)CC1 ZINC000237157702 1433390905 /nfs/dbraw/zinc/39/09/05/1433390905.db2.gz ITCGEAUZXRCSHP-UHFFFAOYSA-N 2 1 388.781 3.466 20 0 GGADMP C[N@@H+](Cc1ccccc1NC(=O)c1cn(C2CC[NH2+]CC2)nn1)C1CCCCC1 ZINC000237167453 1433391125 /nfs/dbraw/zinc/39/11/25/1433391125.db2.gz OTHCESHDCATYHI-UHFFFAOYSA-N 2 1 396.539 3.219 20 0 GGADMP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]CCCN1CCC[N@H+](C)CC1 ZINC000237172005 1433391426 /nfs/dbraw/zinc/39/14/26/1433391426.db2.gz UKPOKHPCBCJPNT-UHFFFAOYSA-N 2 1 389.975 3.260 20 0 GGADMP COc1cc(Br)c(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1OC ZINC000237186424 1433392079 /nfs/dbraw/zinc/39/20/79/1433392079.db2.gz JSXSLIIYULACMH-GFCCVEGCSA-N 2 1 382.302 3.397 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000237319889 1433397195 /nfs/dbraw/zinc/39/71/95/1433397195.db2.gz KDAFHASKTJBAPK-ROUUACIJSA-N 2 1 389.590 3.044 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000237319889 1433397199 /nfs/dbraw/zinc/39/71/99/1433397199.db2.gz KDAFHASKTJBAPK-ROUUACIJSA-N 2 1 389.590 3.044 20 0 GGADMP C[C@@H](CC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)C1CC[NH2+]CC1 ZINC000237352294 1433398460 /nfs/dbraw/zinc/39/84/60/1433398460.db2.gz ANYLXYNMKKAPIW-KRWDZBQOSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@@H](CC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)C1CC[NH2+]CC1 ZINC000237352294 1433398463 /nfs/dbraw/zinc/39/84/63/1433398463.db2.gz ANYLXYNMKKAPIW-KRWDZBQOSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@@]1(C(=O)NC[C@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CCC[NH2+]C1 ZINC000237377721 1433399879 /nfs/dbraw/zinc/39/98/79/1433399879.db2.gz VQOTXRZJRWXICU-DENIHFKCSA-N 2 1 383.561 3.353 20 0 GGADMP C[C@@]1(C(=O)NC[C@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CCC[NH2+]C1 ZINC000237377721 1433399882 /nfs/dbraw/zinc/39/98/82/1433399882.db2.gz VQOTXRZJRWXICU-DENIHFKCSA-N 2 1 383.561 3.353 20 0 GGADMP C[C@@H](CC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[C@@H]1CCC[NH2+]C1 ZINC000237400577 1433400949 /nfs/dbraw/zinc/40/09/49/1433400949.db2.gz YOIGNGWBDAAUQX-DOTOQJQBSA-N 2 1 379.495 3.071 20 0 GGADMP C[C@@H](C[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1ccccc1 ZINC000237415326 1433401969 /nfs/dbraw/zinc/40/19/69/1433401969.db2.gz NFJUKDZHFVCMBL-IBGZPJMESA-N 2 1 381.520 3.241 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2[NH2+]CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000237479672 1433405322 /nfs/dbraw/zinc/40/53/22/1433405322.db2.gz MAQGMVSYUSUOGM-RZFNWQHOSA-N 2 1 377.532 3.385 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2Cc3ccccc3C[NH2+]2)CC[N@H+]1Cc1ccccc1 ZINC000237490497 1433405829 /nfs/dbraw/zinc/40/58/29/1433405829.db2.gz FEWQFABQGXNARI-YSZBQJHXSA-N 2 1 377.532 3.212 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)[C@@H]3Cc4ccccc4C[NH2+]3)cc2)C1 ZINC000237525938 1433408014 /nfs/dbraw/zinc/40/80/14/1433408014.db2.gz QGOTULVECYVZOH-JPYJTQIMSA-N 2 1 377.532 3.249 20 0 GGADMP Cc1c(C(=O)Nc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)nnn1C1CC[NH2+]CC1 ZINC000237530108 1433408264 /nfs/dbraw/zinc/40/82/64/1433408264.db2.gz GYODPGHQMPYPRS-INIZCTEOSA-N 2 1 396.539 3.138 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]Cc2ccc(OC[C@@H]3CCCO3)cc2)C[C@H](C)O1 ZINC000237609390 1433412149 /nfs/dbraw/zinc/41/21/49/1433412149.db2.gz ZVRBATKKGCSGPL-JQVVWYNYSA-N 2 1 376.541 3.223 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2CNC(=O)C[C@@H]([NH3+])c2ccccc2)C[C@H](C)O1 ZINC000237618334 1433413142 /nfs/dbraw/zinc/41/31/42/1433413142.db2.gz XPGRIGATNADOIG-KGVIQGDOSA-N 2 1 381.520 3.002 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2CNC(=O)C[C@@H]([NH3+])c2ccccc2)C[C@H](C)O1 ZINC000237618334 1433413143 /nfs/dbraw/zinc/41/31/43/1433413143.db2.gz XPGRIGATNADOIG-KGVIQGDOSA-N 2 1 381.520 3.002 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2CNC(=O)C[C@H]([NH3+])c2ccccc2)C[C@H](C)O1 ZINC000237618533 1433413308 /nfs/dbraw/zinc/41/33/08/1433413308.db2.gz XPGRIGATNADOIG-SVMVAKDDSA-N 2 1 381.520 3.002 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2CNC(=O)C[C@H]([NH3+])c2ccccc2)C[C@H](C)O1 ZINC000237618533 1433413312 /nfs/dbraw/zinc/41/33/12/1433413312.db2.gz XPGRIGATNADOIG-SVMVAKDDSA-N 2 1 381.520 3.002 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(CNC(=O)CC[C@@H]([NH3+])c3ccccc3)c2)CCO1 ZINC000237636776 1433414197 /nfs/dbraw/zinc/41/41/97/1433414197.db2.gz LNOVHLUUWAZFRT-PGRDOPGGSA-N 2 1 381.520 3.004 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(CNC(=O)CC[C@@H]([NH3+])c3ccccc3)c2)CCO1 ZINC000237636776 1433414201 /nfs/dbraw/zinc/41/42/01/1433414201.db2.gz LNOVHLUUWAZFRT-PGRDOPGGSA-N 2 1 381.520 3.004 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)C2(c3ccccc3)CC[NH2+]CC2)cc1F ZINC000237649279 1433414955 /nfs/dbraw/zinc/41/49/55/1433414955.db2.gz LFSVNFARQXQNLX-UHFFFAOYSA-N 2 1 392.478 3.257 20 0 GGADMP Cc1ccc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000237700554 1433417977 /nfs/dbraw/zinc/41/79/77/1433417977.db2.gz CJWRCVDNFISCDT-CUWPLCDZSA-N 2 1 398.551 3.279 20 0 GGADMP C[C@H]1CCN(C(=O)C2(c3ccccc3)CC[NH2+]CC2)CC[N@H+]1Cc1ccccc1 ZINC000237702559 1433417999 /nfs/dbraw/zinc/41/79/99/1433417999.db2.gz AEYGAZGLRMFVCO-NRFANRHFSA-N 2 1 391.559 3.431 20 0 GGADMP O=C(C[NH2+]C1CC1)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)c(Cl)c1 ZINC000237706679 1433418150 /nfs/dbraw/zinc/41/81/50/1433418150.db2.gz OAJPKCVKUGOOTL-UHFFFAOYSA-N 2 1 398.938 3.353 20 0 GGADMP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[N@H+]1CCC[C@@H]1CO ZINC000237720052 1433418966 /nfs/dbraw/zinc/41/89/66/1433418966.db2.gz HEOOCVJLLBHHJE-HXUWFJFHSA-N 2 1 390.959 3.469 20 0 GGADMP O=C(CCC1CC[NH2+]CC1)N[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000237879366 1433431104 /nfs/dbraw/zinc/43/11/04/1433431104.db2.gz AKCDZYUZODMMOW-GOSISDBHSA-N 2 1 383.458 3.176 20 0 GGADMP [NH3+][C@@H](CC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000237901146 1433432886 /nfs/dbraw/zinc/43/28/86/1433432886.db2.gz DCSJESLGTHGDPA-OALUTQOASA-N 2 1 391.437 3.486 20 0 GGADMP O=C(N1CCC[N@@H+](CC2CCCCC2)CC1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000237903824 1433433300 /nfs/dbraw/zinc/43/33/00/1433433300.db2.gz ZSWLBEUAENTVSF-UHFFFAOYSA-N 2 1 383.580 3.422 20 0 GGADMP O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1Cc2ccccc2C[NH2+]1 ZINC000237973407 1433437861 /nfs/dbraw/zinc/43/78/61/1433437861.db2.gz YNLQMTCFEATEBF-GLCCWIKHSA-N 2 1 375.516 3.013 20 0 GGADMP N[C@H](C(=O)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1ccccc1 ZINC000238037789 1433440311 /nfs/dbraw/zinc/44/03/11/1433440311.db2.gz FXLXTKXVNRVFFA-HKUYNNGSSA-N 2 1 375.875 3.260 20 0 GGADMP O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000238131725 1433443796 /nfs/dbraw/zinc/44/37/96/1433443796.db2.gz XCJAJXNMJPHXMX-JOCHJYFZSA-N 2 1 377.532 3.089 20 0 GGADMP OC1CC[NH+](CCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000238159201 1433444674 /nfs/dbraw/zinc/44/46/74/1433444674.db2.gz MOAMYZBFYRDHEM-UHFFFAOYSA-N 2 1 390.531 3.476 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N3CC[C@@H]([NH+]4CCCC4)C3)cc2)C1 ZINC000245395711 1433459844 /nfs/dbraw/zinc/45/98/44/1433459844.db2.gz IRBSYHWWCCCIET-DENIHFKCSA-N 2 1 384.568 3.298 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N2CC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000245395609 1433460002 /nfs/dbraw/zinc/46/00/02/1433460002.db2.gz IDYKZMZFZZAPSN-SIKLNZKXSA-N 2 1 384.568 3.298 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245413132 1433463210 /nfs/dbraw/zinc/46/32/10/1433463210.db2.gz AXWGBXDOSSGVSX-PZJWPPBQSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245413132 1433463211 /nfs/dbraw/zinc/46/32/11/1433463211.db2.gz AXWGBXDOSSGVSX-PZJWPPBQSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000245413132 1433463212 /nfs/dbraw/zinc/46/32/12/1433463212.db2.gz AXWGBXDOSSGVSX-PZJWPPBQSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000245413132 1433463213 /nfs/dbraw/zinc/46/32/13/1433463213.db2.gz AXWGBXDOSSGVSX-PZJWPPBQSA-N 2 1 375.532 3.371 20 0 GGADMP CC(C)[C@@H]1C[N@H+]([C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CCS1 ZINC000245441196 1433468379 /nfs/dbraw/zinc/46/83/79/1433468379.db2.gz HDFANKXAOOHWAH-NQIIRXRSSA-N 2 1 389.609 3.229 20 0 GGADMP C[C@@H](C(=O)N(C)Cc1ccccc1)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000245462676 1433472892 /nfs/dbraw/zinc/47/28/92/1433472892.db2.gz XBCYVFUUSDQYKQ-NZQKXSOJSA-N 2 1 379.548 3.487 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccccc2OCC(=O)N(C)C)C1 ZINC000245554433 1433484363 /nfs/dbraw/zinc/48/43/63/1433484363.db2.gz GWXGCLMCVPSOQE-PMACEKPBSA-N 2 1 387.568 3.240 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2C[C@@H](O)CN2Cc2ccccc2)cc1 ZINC000245588792 1433488395 /nfs/dbraw/zinc/48/83/95/1433488395.db2.gz KMNJXZCSPPVDQP-GKVQRAMASA-N 2 1 390.531 3.467 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN([C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)C1 ZINC000245610538 1433490743 /nfs/dbraw/zinc/49/07/43/1433490743.db2.gz JYXAQPOPZWCBBZ-MJGOQNOKSA-N 2 1 397.485 3.470 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1)[NH+](C)C1CC1 ZINC000245644798 1433494869 /nfs/dbraw/zinc/49/48/69/1433494869.db2.gz AWYPVXYCHJLCEE-MUKKUYKPSA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1)[N@H+](C)C1CC1 ZINC000245644798 1433494872 /nfs/dbraw/zinc/49/48/72/1433494872.db2.gz AWYPVXYCHJLCEE-MUKKUYKPSA-N 2 1 396.938 3.254 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1)[N@@H+](C)C1CC1 ZINC000245644798 1433494874 /nfs/dbraw/zinc/49/48/74/1433494874.db2.gz AWYPVXYCHJLCEE-MUKKUYKPSA-N 2 1 396.938 3.254 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000245669964 1433497417 /nfs/dbraw/zinc/49/74/17/1433497417.db2.gz FGLUUYIMZAFCJX-RZUBCFFCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000245669964 1433497419 /nfs/dbraw/zinc/49/74/19/1433497419.db2.gz FGLUUYIMZAFCJX-RZUBCFFCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000245669964 1433497421 /nfs/dbraw/zinc/49/74/21/1433497421.db2.gz FGLUUYIMZAFCJX-RZUBCFFCSA-N 2 1 386.584 3.270 20 0 GGADMP CC[C@@H]1C[N@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)CC[C@H]1c1ccccc1 ZINC000245698696 1433502138 /nfs/dbraw/zinc/50/21/38/1433502138.db2.gz CRWUUVYUFZLMBL-IFMALSPDSA-N 2 1 379.552 3.244 20 0 GGADMP CC[C@@H]1C[N@@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)CC[C@H]1c1ccccc1 ZINC000245698696 1433502140 /nfs/dbraw/zinc/50/21/40/1433502140.db2.gz CRWUUVYUFZLMBL-IFMALSPDSA-N 2 1 379.552 3.244 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)NCC2CC[NH+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245761277 1433513211 /nfs/dbraw/zinc/51/32/11/1433513211.db2.gz ZMRJOUSMLJIHNU-LPHOPBHVSA-N 2 1 396.938 3.113 20 0 GGADMP C[C@H](C(=O)N[C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000245773557 1433515375 /nfs/dbraw/zinc/51/53/75/1433515375.db2.gz KZNYZCCDXMKZKU-XWTMOSNGSA-N 2 1 390.547 3.016 20 0 GGADMP Cn1ccnc1C[C@@H]1CCC[N@@H+](C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000245805698 1433520536 /nfs/dbraw/zinc/52/05/36/1433520536.db2.gz BJMDDSTWCNRBOO-WMZOPIPTSA-N 2 1 381.442 3.297 20 0 GGADMP CCN(C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)[C@@H](C)c1ccc(F)cc1 ZINC000245816914 1433522409 /nfs/dbraw/zinc/52/24/09/1433522409.db2.gz DFBHYJGZDDKFBZ-ROUUACIJSA-N 2 1 386.515 3.423 20 0 GGADMP CCN(C(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1)[C@@H](C)c1ccc(F)cc1 ZINC000245816914 1433522415 /nfs/dbraw/zinc/52/24/15/1433522415.db2.gz DFBHYJGZDDKFBZ-ROUUACIJSA-N 2 1 386.515 3.423 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c(C)c1 ZINC000245837118 1433524297 /nfs/dbraw/zinc/52/42/97/1433524297.db2.gz HHWYICDKZXLJHV-MSOLQXFVSA-N 2 1 397.523 3.028 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c(C)c1 ZINC000245837118 1433524302 /nfs/dbraw/zinc/52/43/02/1433524302.db2.gz HHWYICDKZXLJHV-MSOLQXFVSA-N 2 1 397.523 3.028 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)[C@H](C(C)C)[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000245840029 1433524750 /nfs/dbraw/zinc/52/47/50/1433524750.db2.gz YMKDUZGUJSBTPI-ZJOUEHCJSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)[C@H](C(C)C)[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000245840029 1433524751 /nfs/dbraw/zinc/52/47/51/1433524751.db2.gz YMKDUZGUJSBTPI-ZJOUEHCJSA-N 2 1 381.605 3.091 20 0 GGADMP CCC[C@H]1CN(C(=O)NC[C@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000245840051 1433524900 /nfs/dbraw/zinc/52/49/00/1433524900.db2.gz DGFCJBQHFRQQIW-IRLDBZIGSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[C@H]1CN(C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000245840051 1433524909 /nfs/dbraw/zinc/52/49/09/1433524909.db2.gz DGFCJBQHFRQQIW-IRLDBZIGSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[C@H]1CN(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000245840051 1433524914 /nfs/dbraw/zinc/52/49/14/1433524914.db2.gz DGFCJBQHFRQQIW-IRLDBZIGSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245857743 1433527776 /nfs/dbraw/zinc/52/77/76/1433527776.db2.gz KJUNIXNEFXXMOO-MOPGFXCFSA-N 2 1 395.551 3.302 20 0 GGADMP C[C@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245857743 1433527783 /nfs/dbraw/zinc/52/77/83/1433527783.db2.gz KJUNIXNEFXXMOO-MOPGFXCFSA-N 2 1 395.551 3.302 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000245859010 1433528206 /nfs/dbraw/zinc/52/82/06/1433528206.db2.gz BJKZDVFHVXGWJO-PDGJWGCVSA-N 2 1 384.568 3.308 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000245859010 1433528210 /nfs/dbraw/zinc/52/82/10/1433528210.db2.gz BJKZDVFHVXGWJO-PDGJWGCVSA-N 2 1 384.568 3.308 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000245859010 1433528219 /nfs/dbraw/zinc/52/82/19/1433528219.db2.gz BJKZDVFHVXGWJO-PDGJWGCVSA-N 2 1 384.568 3.308 20 0 GGADMP CCO[C@@H]1C[C@H]([NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)C12CCCC2 ZINC000245866936 1433530412 /nfs/dbraw/zinc/53/04/12/1433530412.db2.gz IUORWBNAALIMBA-BHIFYINESA-N 2 1 399.579 3.211 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1[C@@H]2CC[C@H]1C[N@@H+](CC)CC2)c1ccsc1 ZINC000245886267 1433533723 /nfs/dbraw/zinc/53/37/23/1433533723.db2.gz LUFLYFMJYBDLAG-CEXWTWQISA-N 2 1 378.586 3.399 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)[C@H]2CCn3ccnc3C2)C1 ZINC000245923688 1433544402 /nfs/dbraw/zinc/54/44/02/1433544402.db2.gz HBSLUAPMWLTEDG-OTWHNJEPSA-N 2 1 380.536 3.240 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000245934463 1433546912 /nfs/dbraw/zinc/54/69/12/1433546912.db2.gz IUVAVILXLFFPFL-WSTZPKSXSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CC[C@@H]2[C@@H](CCCN2C(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000245934463 1433546920 /nfs/dbraw/zinc/54/69/20/1433546920.db2.gz IUVAVILXLFFPFL-WSTZPKSXSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CC[C@@H]2[C@@H](CCCN2C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000245934463 1433546924 /nfs/dbraw/zinc/54/69/24/1433546924.db2.gz IUVAVILXLFFPFL-WSTZPKSXSA-N 2 1 390.597 3.086 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000245943436 1433548141 /nfs/dbraw/zinc/54/81/41/1433548141.db2.gz KEVIEGDNYSIAGQ-AZUAARDMSA-N 2 1 390.597 3.086 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]3C[NH+](C)CC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC000245960771 1433551184 /nfs/dbraw/zinc/55/11/84/1433551184.db2.gz MPCRDZLYZVQIAG-NMIHRBCNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000245960771 1433551189 /nfs/dbraw/zinc/55/11/89/1433551189.db2.gz MPCRDZLYZVQIAG-NMIHRBCNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000245960771 1433551193 /nfs/dbraw/zinc/55/11/93/1433551193.db2.gz MPCRDZLYZVQIAG-NMIHRBCNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)CC1 ZINC000245981305 1433552893 /nfs/dbraw/zinc/55/28/93/1433552893.db2.gz YKKIXZIVCFCVGK-CEXWTWQISA-N 2 1 387.572 3.027 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@H]3CCCC[C@@H]3S(C)(=O)=O)cc2)C1 ZINC000246026490 1433559288 /nfs/dbraw/zinc/55/92/88/1433559288.db2.gz LBKBJDCSOYJVDL-QMMLZNLJSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@H]3CCCC[C@H]3S(C)(=O)=O)cc2)C1 ZINC000246026484 1433559394 /nfs/dbraw/zinc/55/93/94/1433559394.db2.gz LBKBJDCSOYJVDL-JRGCBEDISA-N 2 1 378.582 3.364 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[NH+]2C ZINC000246113347 1433570539 /nfs/dbraw/zinc/57/05/39/1433570539.db2.gz HWYXEQDRFPUNDD-BWAGFHJFSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000246113347 1433570543 /nfs/dbraw/zinc/57/05/43/1433570543.db2.gz HWYXEQDRFPUNDD-BWAGFHJFSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000246113347 1433570546 /nfs/dbraw/zinc/57/05/46/1433570546.db2.gz HWYXEQDRFPUNDD-BWAGFHJFSA-N 2 1 384.568 3.439 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@H](c2ccc(C)o2)[NH+]2CCCC2)C1 ZINC000246113469 1433570696 /nfs/dbraw/zinc/57/06/96/1433570696.db2.gz HXFMMUOFAYEEQR-RBUKOAKNSA-N 2 1 376.545 3.098 20 0 GGADMP c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246123483 1433571702 /nfs/dbraw/zinc/57/17/02/1433571702.db2.gz KMKIEBSNHHPUTJ-FXAWDEMLSA-N 2 1 394.519 3.297 20 0 GGADMP Cn1cc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000246124848 1433571995 /nfs/dbraw/zinc/57/19/95/1433571995.db2.gz KNUNDOCINJKVCB-AZUAARDMSA-N 2 1 396.535 3.165 20 0 GGADMP C[C@@H]1CN(Cc2ccccc2NC(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)C[C@H](C)O1 ZINC000246146440 1433574655 /nfs/dbraw/zinc/57/46/55/1433574655.db2.gz LLQIJLMIDUORQG-OTWHNJEPSA-N 2 1 388.556 3.101 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@H](C)c1ccc(F)cc1F ZINC000246148677 1433574803 /nfs/dbraw/zinc/57/48/03/1433574803.db2.gz KAWFHBNQZQASNK-NVXWUHKLSA-N 2 1 382.499 3.083 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000246150517 1433575140 /nfs/dbraw/zinc/57/51/40/1433575140.db2.gz KEVGMETXLRVZNQ-UYAOXDASSA-N 2 1 375.561 3.268 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000246150517 1433575145 /nfs/dbraw/zinc/57/51/45/1433575145.db2.gz KEVGMETXLRVZNQ-UYAOXDASSA-N 2 1 375.561 3.268 20 0 GGADMP C[C@H](C(=O)NC1CCCCC1)[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000246160613 1433576431 /nfs/dbraw/zinc/57/64/31/1433576431.db2.gz IPVBLJQOWQKTQS-CEXWTWQISA-N 2 1 379.589 3.035 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000246182690 1433578929 /nfs/dbraw/zinc/57/89/29/1433578929.db2.gz HJPSXTBIHDFVHK-OXQOHEQNSA-N 2 1 392.975 3.286 20 0 GGADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246219961 1433583423 /nfs/dbraw/zinc/58/34/23/1433583423.db2.gz BGCCFBFQQHCBSA-FIRLOTFOSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[NH+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246219961 1433583425 /nfs/dbraw/zinc/58/34/25/1433583425.db2.gz BGCCFBFQQHCBSA-FIRLOTFOSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[NH+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246219961 1433583426 /nfs/dbraw/zinc/58/34/26/1433583426.db2.gz BGCCFBFQQHCBSA-FIRLOTFOSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246219973 1433583492 /nfs/dbraw/zinc/58/34/92/1433583492.db2.gz BGCCFBFQQHCBSA-NJYSJTHYSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[NH+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246219973 1433583495 /nfs/dbraw/zinc/58/34/95/1433583495.db2.gz BGCCFBFQQHCBSA-NJYSJTHYSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[NH+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246219973 1433583498 /nfs/dbraw/zinc/58/34/98/1433583498.db2.gz BGCCFBFQQHCBSA-NJYSJTHYSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000246273455 1433588411 /nfs/dbraw/zinc/58/84/11/1433588411.db2.gz BFLDKNWQXIRDIL-MOPGFXCFSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000246273455 1433588414 /nfs/dbraw/zinc/58/84/14/1433588414.db2.gz BFLDKNWQXIRDIL-MOPGFXCFSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000246273455 1433588417 /nfs/dbraw/zinc/58/84/17/1433588417.db2.gz BFLDKNWQXIRDIL-MOPGFXCFSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000246273455 1433588420 /nfs/dbraw/zinc/58/84/20/1433588420.db2.gz BFLDKNWQXIRDIL-MOPGFXCFSA-N 2 1 383.536 3.259 20 0 GGADMP O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246297372 1433591554 /nfs/dbraw/zinc/59/15/54/1433591554.db2.gz IXKRDIQKOGWCSO-WWNPGLIZSA-N 2 1 396.579 3.482 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000246317078 1433593778 /nfs/dbraw/zinc/59/37/78/1433593778.db2.gz GLRWYKGFNZIYHT-ROUUACIJSA-N 2 1 387.524 3.330 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000246317078 1433593782 /nfs/dbraw/zinc/59/37/82/1433593782.db2.gz GLRWYKGFNZIYHT-ROUUACIJSA-N 2 1 387.524 3.330 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C1 ZINC000246317078 1433593784 /nfs/dbraw/zinc/59/37/84/1433593784.db2.gz GLRWYKGFNZIYHT-ROUUACIJSA-N 2 1 387.524 3.330 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H](C)C[NH+]1CCCC1 ZINC000246324282 1433595094 /nfs/dbraw/zinc/59/50/94/1433595094.db2.gz OCVGQWMZCNANSZ-RBBKRZOGSA-N 2 1 386.584 3.272 20 0 GGADMP O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246324988 1433595297 /nfs/dbraw/zinc/59/52/97/1433595297.db2.gz CMBGZQKEVWIWOM-MDNUFGMLSA-N 2 1 396.579 3.482 20 0 GGADMP C[C@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000246328564 1433595598 /nfs/dbraw/zinc/59/55/98/1433595598.db2.gz KCCGNOJMNUCANL-FGTMMUONSA-N 2 1 399.539 3.404 20 0 GGADMP C[C@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000246328564 1433595601 /nfs/dbraw/zinc/59/56/01/1433595601.db2.gz KCCGNOJMNUCANL-FGTMMUONSA-N 2 1 399.539 3.404 20 0 GGADMP C[C@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000246328580 1433595607 /nfs/dbraw/zinc/59/56/07/1433595607.db2.gz KCCGNOJMNUCANL-KZNAEPCWSA-N 2 1 399.539 3.404 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000246334143 1433596303 /nfs/dbraw/zinc/59/63/03/1433596303.db2.gz HHRGRYUZTGWMQJ-XRYRHKQGSA-N 2 1 386.584 3.315 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@@H]1C)[NH+]1CCSCC1 ZINC000246344745 1433598238 /nfs/dbraw/zinc/59/82/38/1433598238.db2.gz VCSSOSDPJTXILY-ROUUACIJSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[N@H+]1CCCC[C@@H]1C)[NH+]1CCSCC1 ZINC000246344745 1433598242 /nfs/dbraw/zinc/59/82/42/1433598242.db2.gz VCSSOSDPJTXILY-ROUUACIJSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@H]1C)[NH+]1CCSCC1 ZINC000246344731 1433598338 /nfs/dbraw/zinc/59/83/38/1433598338.db2.gz VCSSOSDPJTXILY-MSOLQXFVSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[N@H+]1CCCC[C@H]1C)[NH+]1CCSCC1 ZINC000246344731 1433598343 /nfs/dbraw/zinc/59/83/43/1433598343.db2.gz VCSSOSDPJTXILY-MSOLQXFVSA-N 2 1 375.582 3.115 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246362553 1433600698 /nfs/dbraw/zinc/60/06/98/1433600698.db2.gz NKNTVYUTAUOOGC-DFQSSKMNSA-N 2 1 386.540 3.075 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246364042 1433600908 /nfs/dbraw/zinc/60/09/08/1433600908.db2.gz KNEUPJHIHQLRQB-YUVXSKOASA-N 2 1 386.584 3.126 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246364042 1433600909 /nfs/dbraw/zinc/60/09/09/1433600909.db2.gz KNEUPJHIHQLRQB-YUVXSKOASA-N 2 1 386.584 3.126 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246364042 1433600910 /nfs/dbraw/zinc/60/09/10/1433600910.db2.gz KNEUPJHIHQLRQB-YUVXSKOASA-N 2 1 386.584 3.126 20 0 GGADMP O=C([C@@H]1CCC[N@H+]1Cc1ccc(F)cc1)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246368817 1433602032 /nfs/dbraw/zinc/60/20/32/1433602032.db2.gz HDTMSIQQUGJIIS-NYVOZVTQSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246368817 1433602035 /nfs/dbraw/zinc/60/20/35/1433602035.db2.gz HDTMSIQQUGJIIS-NYVOZVTQSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccc(F)cc1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246368817 1433602041 /nfs/dbraw/zinc/60/20/41/1433602041.db2.gz HDTMSIQQUGJIIS-NYVOZVTQSA-N 2 1 385.527 3.265 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccc(F)cc1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246368817 1433602046 /nfs/dbraw/zinc/60/20/46/1433602046.db2.gz HDTMSIQQUGJIIS-NYVOZVTQSA-N 2 1 385.527 3.265 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000246372406 1433602351 /nfs/dbraw/zinc/60/23/51/1433602351.db2.gz HRGQRJRNNBWUMG-FXAWDEMLSA-N 2 1 378.536 3.096 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)N(C)[C@@H]3CC[N@@H+](C)C[C@H]3C)c2)CC1 ZINC000246372399 1433602420 /nfs/dbraw/zinc/60/24/20/1433602420.db2.gz QYBGMWGKQHTLRN-DENIHFKCSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000246373346 1433602494 /nfs/dbraw/zinc/60/24/94/1433602494.db2.gz MADGUSWQJMOWCA-MMKMLUHNSA-N 2 1 384.568 3.021 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000246373357 1433602567 /nfs/dbraw/zinc/60/25/67/1433602567.db2.gz MADGUSWQJMOWCA-UKAVVXHISA-N 2 1 384.568 3.021 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccco1 ZINC000246379524 1433603854 /nfs/dbraw/zinc/60/38/54/1433603854.db2.gz IDNSRIBHGJZCQB-YSIASYRMSA-N 2 1 388.556 3.321 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H]1CC[NH+](C2CC2)C1 ZINC000246389190 1433605383 /nfs/dbraw/zinc/60/53/83/1433605383.db2.gz QYSWTEDGNFFEOF-RTWAWAEBSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000246389190 1433605388 /nfs/dbraw/zinc/60/53/88/1433605388.db2.gz QYSWTEDGNFFEOF-RTWAWAEBSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000246389190 1433605391 /nfs/dbraw/zinc/60/53/91/1433605391.db2.gz QYSWTEDGNFFEOF-RTWAWAEBSA-N 2 1 384.568 3.024 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246415135 1433609014 /nfs/dbraw/zinc/60/90/14/1433609014.db2.gz LEYICUMXOBBWQZ-BVSLBCMMSA-N 2 1 399.604 3.252 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246415135 1433609018 /nfs/dbraw/zinc/60/90/18/1433609018.db2.gz LEYICUMXOBBWQZ-BVSLBCMMSA-N 2 1 399.604 3.252 20 0 GGADMP COCCc1nc(C)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)s1 ZINC000246466442 1433616942 /nfs/dbraw/zinc/61/69/42/1433616942.db2.gz QFQSKYLHVJGUDZ-JCGIZDLHSA-N 2 1 381.586 3.059 20 0 GGADMP CN(C(=O)NCCc1ccccc1)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000246467353 1433617155 /nfs/dbraw/zinc/61/71/55/1433617155.db2.gz JIXLRLVUNGCHAG-FGZHOGPDSA-N 2 1 386.584 3.208 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]2C[NH+]2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000246477384 1433618725 /nfs/dbraw/zinc/61/87/25/1433618725.db2.gz LAWZJARWWBXULQ-FCEUIQTBSA-N 2 1 384.568 3.309 20 0 GGADMP CCSCC[C@H](C)NC(=O)N(C)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000246528308 1433625843 /nfs/dbraw/zinc/62/58/43/1433625843.db2.gz KXYLJIVANWYABW-DFQSSKMNSA-N 2 1 398.661 3.497 20 0 GGADMP C[C@H](NC1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000246531548 1433626243 /nfs/dbraw/zinc/62/62/43/1433626243.db2.gz VIXWHEDKERUVPB-CDNPAEQRSA-N 2 1 389.584 3.046 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000246542324 1433628012 /nfs/dbraw/zinc/62/80/12/1433628012.db2.gz WNKWDMDQQGUSND-WOJBJXKFSA-N 2 1 390.572 3.474 20 0 GGADMP CS[C@@H]1CCCC[N@H+]([C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000246546052 1433629129 /nfs/dbraw/zinc/62/91/29/1433629129.db2.gz KEDPHPVZERCBKK-GHTZIAJQSA-N 2 1 389.609 3.373 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)N[C@H]2c3ccccc3CC[C@@H]2n2ccnc2)C1 ZINC000246547641 1433629497 /nfs/dbraw/zinc/62/94/97/1433629497.db2.gz DEOSVDMEDKWEHB-QMMLZNLJSA-N 2 1 381.524 3.143 20 0 GGADMP CNc1cc(N2CCC[C@@H]2CNC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)ncn1 ZINC000246553473 1433630227 /nfs/dbraw/zinc/63/02/27/1433630227.db2.gz WRQKAZWPFNHKON-MISYRCLQSA-N 3 1 386.588 3.120 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2c(F)cccc2Cl)CCO1 ZINC000246557384 1433630810 /nfs/dbraw/zinc/63/08/10/1433630810.db2.gz LOSNKHCTFFLPBH-PDOICOKGSA-N 2 1 395.950 3.457 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2c(F)cccc2Cl)CCO1 ZINC000246557384 1433630812 /nfs/dbraw/zinc/63/08/12/1433630812.db2.gz LOSNKHCTFFLPBH-PDOICOKGSA-N 2 1 395.950 3.457 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2c(F)cccc2Cl)CCO1 ZINC000246557372 1433630969 /nfs/dbraw/zinc/63/09/69/1433630969.db2.gz LOSNKHCTFFLPBH-NHAYFPRASA-N 2 1 395.950 3.457 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2c(F)cccc2Cl)CCO1 ZINC000246557372 1433630974 /nfs/dbraw/zinc/63/09/74/1433630974.db2.gz LOSNKHCTFFLPBH-NHAYFPRASA-N 2 1 395.950 3.457 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000246564460 1433631913 /nfs/dbraw/zinc/63/19/13/1433631913.db2.gz YFQZVCKKRDOWEC-RXVVDRJESA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000246564460 1433631915 /nfs/dbraw/zinc/63/19/15/1433631915.db2.gz YFQZVCKKRDOWEC-RXVVDRJESA-N 2 1 383.540 3.276 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@@]2([NH+](C)C)CCC[C@@H](C)C2)C1 ZINC000246712238 1433653482 /nfs/dbraw/zinc/65/34/82/1433653482.db2.gz HFMQZSSJMRBNGA-DBXWQHBBSA-N 2 1 375.561 3.303 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)CC[C@H]21 ZINC000246710686 1433653594 /nfs/dbraw/zinc/65/35/94/1433653594.db2.gz FFDYWEHTGVGFNE-KURKYZTESA-N 2 1 376.570 3.011 20 0 GGADMP CC[C@H](NC(=O)[C@H](C)[C@H]([NH3+])c1ccccc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246714057 1433653987 /nfs/dbraw/zinc/65/39/87/1433653987.db2.gz XCUDSJFZCZNITH-MSYGRNIXSA-N 2 1 395.547 3.118 20 0 GGADMP CC[C@H](NC(=O)[C@H](C)[C@H]([NH3+])c1ccccc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246714057 1433653988 /nfs/dbraw/zinc/65/39/88/1433653988.db2.gz XCUDSJFZCZNITH-MSYGRNIXSA-N 2 1 395.547 3.118 20 0 GGADMP Clc1ccccc1N1CCN(CCC[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000246731061 1433656600 /nfs/dbraw/zinc/65/66/00/1433656600.db2.gz NYFLIZYQNZQXTQ-MOPGFXCFSA-N 2 1 376.976 3.069 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCN(CC(F)(F)F)C1=O ZINC000246782350 1433665424 /nfs/dbraw/zinc/66/54/24/1433665424.db2.gz QKEZPMPJQIIJOT-YJBOKZPZSA-N 2 1 383.458 3.314 20 0 GGADMP C[C@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000246783424 1433665909 /nfs/dbraw/zinc/66/59/09/1433665909.db2.gz BGWDQQGIQUBZKQ-WOJBJXKFSA-N 2 1 386.584 3.413 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000246815990 1433672783 /nfs/dbraw/zinc/67/27/83/1433672783.db2.gz AWIKAMVOLANSEE-BXWFABGCSA-N 2 1 381.948 3.394 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000246815990 1433672784 /nfs/dbraw/zinc/67/27/84/1433672784.db2.gz AWIKAMVOLANSEE-BXWFABGCSA-N 2 1 381.948 3.394 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000246816016 1433673117 /nfs/dbraw/zinc/67/31/17/1433673117.db2.gz AWIKAMVOLANSEE-FCEWJHQRSA-N 2 1 381.948 3.394 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000246816016 1433673122 /nfs/dbraw/zinc/67/31/22/1433673122.db2.gz AWIKAMVOLANSEE-FCEWJHQRSA-N 2 1 381.948 3.394 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000246828175 1433675289 /nfs/dbraw/zinc/67/52/89/1433675289.db2.gz DRRFJKRMGYTROF-ZWKOTPCHSA-N 2 1 378.586 3.162 20 0 GGADMP C(CCN1CCC[C@H]1C[NH+]1CCCC1)CC[N@H+]1CCC[C@H]1CN1CCCC1 ZINC000246853430 1433678604 /nfs/dbraw/zinc/67/86/04/1433678604.db2.gz DDJMYFPGJACHSS-GOTSBHOMSA-N 2 1 376.633 3.277 20 0 GGADMP C(CC[NH+]1CCC[C@H]1CN1CCCC1)CC[N@@H+]1CCC[C@H]1CN1CCCC1 ZINC000246853430 1433678606 /nfs/dbraw/zinc/67/86/06/1433678606.db2.gz DDJMYFPGJACHSS-GOTSBHOMSA-N 2 1 376.633 3.277 20 0 GGADMP C(CC[NH+]1CCC[C@H]1CN1CCCC1)CC[N@H+]1CCC[C@H]1CN1CCCC1 ZINC000246853430 1433678607 /nfs/dbraw/zinc/67/86/07/1433678607.db2.gz DDJMYFPGJACHSS-GOTSBHOMSA-N 2 1 376.633 3.277 20 0 GGADMP CC(C)c1ccc(CCNC(=O)CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000246882215 1433682427 /nfs/dbraw/zinc/68/24/27/1433682427.db2.gz QPBTUCJGAZVTNJ-JTHBVZDNSA-N 2 1 383.580 3.417 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NC[C@H]3CCC[NH+](Cc4cccs4)C3)CC[C@@H]21 ZINC000246894946 1433684092 /nfs/dbraw/zinc/68/40/92/1433684092.db2.gz MDJNCUSCWVZLBW-GGPKGHCWSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CCC[C@@H]2CN(C(=O)NC[C@H]3CCC[N@H+](Cc4cccs4)C3)CC[C@@H]21 ZINC000246894946 1433684094 /nfs/dbraw/zinc/68/40/94/1433684094.db2.gz MDJNCUSCWVZLBW-GGPKGHCWSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CCC[C@@H]2CN(C(=O)NC[C@H]3CCC[N@@H+](Cc4cccs4)C3)CC[C@@H]21 ZINC000246894946 1433684098 /nfs/dbraw/zinc/68/40/98/1433684098.db2.gz MDJNCUSCWVZLBW-GGPKGHCWSA-N 2 1 390.597 3.086 20 0 GGADMP O=C(CCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)NCc1ccccc1Cl ZINC000246919405 1433687577 /nfs/dbraw/zinc/68/75/77/1433687577.db2.gz SKHDHAXHVGGHHP-PXNSSMCTSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)NCc1ccccc1Cl ZINC000246919405 1433687578 /nfs/dbraw/zinc/68/75/78/1433687578.db2.gz SKHDHAXHVGGHHP-PXNSSMCTSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)NCc1ccccc1Cl ZINC000246919405 1433687579 /nfs/dbraw/zinc/68/75/79/1433687579.db2.gz SKHDHAXHVGGHHP-PXNSSMCTSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)NCc1ccccc1Cl ZINC000246919405 1433687580 /nfs/dbraw/zinc/68/75/80/1433687580.db2.gz SKHDHAXHVGGHHP-PXNSSMCTSA-N 2 1 375.944 3.295 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)C1 ZINC000247210468 1433691497 /nfs/dbraw/zinc/69/14/97/1433691497.db2.gz WXBQYRNEVNYWCF-QZTJIDSGSA-N 2 1 381.586 3.100 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000247250148 1433696359 /nfs/dbraw/zinc/69/63/59/1433696359.db2.gz WCWMRTRTRGIDJR-QFBILLFUSA-N 2 1 378.948 3.118 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)cc2)C[C@H](C)O1 ZINC000247328224 1433707181 /nfs/dbraw/zinc/70/71/81/1433707181.db2.gz XZEHIQCVIJCZNF-LVCYWYKZSA-N 2 1 389.584 3.392 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)cc2)C[C@H](C)O1 ZINC000247328224 1433707189 /nfs/dbraw/zinc/70/71/89/1433707189.db2.gz XZEHIQCVIJCZNF-LVCYWYKZSA-N 2 1 389.584 3.392 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247332409 1433708465 /nfs/dbraw/zinc/70/84/65/1433708465.db2.gz JJWFOHCRAWSOQL-FGZHOGPDSA-N 2 1 384.568 3.311 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H](C)C1 ZINC000247342039 1433710399 /nfs/dbraw/zinc/71/03/99/1433710399.db2.gz NWMSURNWAOBDQT-HKUYNNGSSA-N 2 1 383.577 3.113 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247349623 1433711159 /nfs/dbraw/zinc/71/11/59/1433711159.db2.gz LDKQSGDSZNAVAM-DHIUTWEWSA-N 2 1 398.595 3.211 20 0 GGADMP C[C@H](C(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CCOCC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000247406641 1433718163 /nfs/dbraw/zinc/71/81/63/1433718163.db2.gz PVMKMVGPPNATOI-ZGXWSNOMSA-N 2 1 387.568 3.264 20 0 GGADMP COc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000247412411 1433719538 /nfs/dbraw/zinc/71/95/38/1433719538.db2.gz ZISMVNXFCKHMOM-DYESRHJHSA-N 2 1 381.520 3.243 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+][C@H]3CCN(C(=O)OC(C)(C)C)C3)c2)CCO1 ZINC000247434574 1433721541 /nfs/dbraw/zinc/72/15/41/1433721541.db2.gz LKZHTWPUPMKKDJ-PXNSSMCTSA-N 2 1 389.540 3.006 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+][C@H]3CCN(C(=O)OC(C)(C)C)C3)c2)CCO1 ZINC000247434574 1433721554 /nfs/dbraw/zinc/72/15/54/1433721554.db2.gz LKZHTWPUPMKKDJ-PXNSSMCTSA-N 2 1 389.540 3.006 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247460211 1433725416 /nfs/dbraw/zinc/72/54/16/1433725416.db2.gz UIKHWUZJHWTASA-CEMLEFRQSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247460211 1433725429 /nfs/dbraw/zinc/72/54/29/1433725429.db2.gz UIKHWUZJHWTASA-CEMLEFRQSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000247460211 1433725439 /nfs/dbraw/zinc/72/54/39/1433725439.db2.gz UIKHWUZJHWTASA-CEMLEFRQSA-N 2 1 386.584 3.317 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000247465463 1433725810 /nfs/dbraw/zinc/72/58/10/1433725810.db2.gz UTKGLNUPHDSTFQ-RTBURBONSA-N 2 1 392.613 3.237 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000247465463 1433725817 /nfs/dbraw/zinc/72/58/17/1433725817.db2.gz UTKGLNUPHDSTFQ-RTBURBONSA-N 2 1 392.613 3.237 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000247465463 1433725822 /nfs/dbraw/zinc/72/58/22/1433725822.db2.gz UTKGLNUPHDSTFQ-RTBURBONSA-N 2 1 392.613 3.237 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@H]1CN(c2ccccc2)C(=O)O1 ZINC000247485208 1433728510 /nfs/dbraw/zinc/72/85/10/1433728510.db2.gz KMHRTVHXSNUHER-IRLDBZIGSA-N 2 1 379.504 3.466 20 0 GGADMP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C[C@H]1CN(c2ccccc2)C(=O)O1 ZINC000247485208 1433728513 /nfs/dbraw/zinc/72/85/13/1433728513.db2.gz KMHRTVHXSNUHER-IRLDBZIGSA-N 2 1 379.504 3.466 20 0 GGADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C[C@H]1CN(c2ccccc2)C(=O)O1 ZINC000247485208 1433728518 /nfs/dbraw/zinc/72/85/18/1433728518.db2.gz KMHRTVHXSNUHER-IRLDBZIGSA-N 2 1 379.504 3.466 20 0 GGADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C[C@H]1CN(c2ccccc2)C(=O)O1 ZINC000247485208 1433728520 /nfs/dbraw/zinc/72/85/20/1433728520.db2.gz KMHRTVHXSNUHER-IRLDBZIGSA-N 2 1 379.504 3.466 20 0 GGADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@H]1CN(c2ccccc2)C(=O)O1 ZINC000247485208 1433728521 /nfs/dbraw/zinc/72/85/21/1433728521.db2.gz KMHRTVHXSNUHER-IRLDBZIGSA-N 2 1 379.504 3.466 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC[C@H](c2ccccc2Cl)N(C)C)C1 ZINC000247485291 1433728523 /nfs/dbraw/zinc/72/85/23/1433728523.db2.gz WLPSHMXALNDAMV-QFBILLFUSA-N 2 1 380.964 3.220 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000247485291 1433728524 /nfs/dbraw/zinc/72/85/24/1433728524.db2.gz WLPSHMXALNDAMV-QFBILLFUSA-N 2 1 380.964 3.220 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000247485291 1433728525 /nfs/dbraw/zinc/72/85/25/1433728525.db2.gz WLPSHMXALNDAMV-QFBILLFUSA-N 2 1 380.964 3.220 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N[C@H]1CC[NH+](CC2CCCC2)C1 ZINC000247494581 1433729719 /nfs/dbraw/zinc/72/97/19/1433729719.db2.gz WKLHCSWZMUXWSM-PKTZIBPZSA-N 2 1 398.595 3.115 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC000247494581 1433729726 /nfs/dbraw/zinc/72/97/26/1433729726.db2.gz WKLHCSWZMUXWSM-PKTZIBPZSA-N 2 1 398.595 3.115 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000247494581 1433729736 /nfs/dbraw/zinc/72/97/36/1433729736.db2.gz WKLHCSWZMUXWSM-PKTZIBPZSA-N 2 1 398.595 3.115 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCCN(c2ccn(C)n2)C1=O ZINC000247519391 1433732446 /nfs/dbraw/zinc/73/24/46/1433732446.db2.gz ZYZSIBKXAHZHKZ-RXVVDRJESA-N 2 1 395.551 3.080 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1CNC(=O)N[C@@H]1c2ccccc2CC[C@H]1n1ccnc1 ZINC000247529225 1433733955 /nfs/dbraw/zinc/73/39/55/1433733955.db2.gz OUJFPJOFRIKCIB-HMXCVIKNSA-N 2 1 381.524 3.285 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000247621640 1433740935 /nfs/dbraw/zinc/74/09/35/1433740935.db2.gz TWNNQMKIXRTURE-PSHVLCQKSA-N 2 1 397.567 3.283 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000247621640 1433740939 /nfs/dbraw/zinc/74/09/39/1433740939.db2.gz TWNNQMKIXRTURE-PSHVLCQKSA-N 2 1 397.567 3.283 20 0 GGADMP O[C@@H](COc1cccc(C(F)(F)F)c1)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000247640950 1433742128 /nfs/dbraw/zinc/74/21/28/1433742128.db2.gz SXLCWGUWOSLIPC-FUHWJXTLSA-N 2 1 386.458 3.253 20 0 GGADMP O[C@@H](COc1cccc(C(F)(F)F)c1)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000247640950 1433742134 /nfs/dbraw/zinc/74/21/34/1433742134.db2.gz SXLCWGUWOSLIPC-FUHWJXTLSA-N 2 1 386.458 3.253 20 0 GGADMP Cc1cc(NC(=O)CC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)no1 ZINC000247929086 1433756886 /nfs/dbraw/zinc/75/68/86/1433756886.db2.gz BWEQTFVYZLEEPJ-PMACEKPBSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)no1 ZINC000247929086 1433756890 /nfs/dbraw/zinc/75/68/90/1433756890.db2.gz BWEQTFVYZLEEPJ-PMACEKPBSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)no1 ZINC000247929086 1433756897 /nfs/dbraw/zinc/75/68/97/1433756897.db2.gz BWEQTFVYZLEEPJ-PMACEKPBSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)no1 ZINC000247929086 1433756904 /nfs/dbraw/zinc/75/69/04/1433756904.db2.gz BWEQTFVYZLEEPJ-PMACEKPBSA-N 2 1 382.508 3.298 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000247936514 1433757050 /nfs/dbraw/zinc/75/70/50/1433757050.db2.gz CNPAHJPERKAYOI-DYESRHJHSA-N 2 1 381.520 3.243 20 0 GGADMP CC[N@H+]1CC[C@H](NCc2cccc(NC(=O)NCc3ccncc3)c2)[C@@H](C)C1 ZINC000247961433 1433759289 /nfs/dbraw/zinc/75/92/89/1433759289.db2.gz GHGWYXOJGHEKEY-UWJYYQICSA-N 2 1 381.524 3.223 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]Cc2cccc(NC(=O)NCc3ccncc3)c2)[C@@H](C)C1 ZINC000247961433 1433759299 /nfs/dbraw/zinc/75/92/99/1433759299.db2.gz GHGWYXOJGHEKEY-UWJYYQICSA-N 2 1 381.524 3.223 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3cccc(F)c3)C2=O)[C@H](C)C1 ZINC000247963859 1433759611 /nfs/dbraw/zinc/75/96/11/1433759611.db2.gz GORMIXZGSLVEBF-QMMLZNLJSA-N 2 1 391.531 3.048 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3cccc(F)c3)C2=O)[C@H](C)C1 ZINC000247963859 1433759617 /nfs/dbraw/zinc/75/96/17/1433759617.db2.gz GORMIXZGSLVEBF-QMMLZNLJSA-N 2 1 391.531 3.048 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1)[NH+](C)C1CC1 ZINC000248162679 1433776284 /nfs/dbraw/zinc/77/62/84/1433776284.db2.gz SKLQJYCYWXSXNR-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)[N@H+](C)C1CC1 ZINC000248162679 1433776289 /nfs/dbraw/zinc/77/62/89/1433776289.db2.gz SKLQJYCYWXSXNR-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)[N@@H+](C)C1CC1 ZINC000248162679 1433776291 /nfs/dbraw/zinc/77/62/91/1433776291.db2.gz SKLQJYCYWXSXNR-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N2CCC(CC[NH+]3CCCC[C@H]3C)CC2)C1 ZINC000248230218 1433781196 /nfs/dbraw/zinc/78/11/96/1433781196.db2.gz QYCXSYDQURJWAB-CTNGQTDRSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C1 ZINC000248230218 1433781201 /nfs/dbraw/zinc/78/12/01/1433781201.db2.gz QYCXSYDQURJWAB-CTNGQTDRSA-N 2 1 378.605 3.404 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C1 ZINC000248230218 1433781205 /nfs/dbraw/zinc/78/12/05/1433781205.db2.gz QYCXSYDQURJWAB-CTNGQTDRSA-N 2 1 378.605 3.404 20 0 GGADMP NC(=O)c1cccc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000248388852 1433792971 /nfs/dbraw/zinc/79/29/71/1433792971.db2.gz AGICXKDLKSHTFQ-DNVJHFABSA-N 2 1 377.532 3.218 20 0 GGADMP CNC(=O)c1cccc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000248390015 1433793563 /nfs/dbraw/zinc/79/35/63/1433793563.db2.gz BEJUDJGXKRTVJJ-WXFUMESZSA-N 2 1 391.559 3.479 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248396086 1433795064 /nfs/dbraw/zinc/79/50/64/1433795064.db2.gz GVZHGFXDBFAOOF-UBFVSLLYSA-N 3 1 398.639 3.294 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248396086 1433795067 /nfs/dbraw/zinc/79/50/67/1433795067.db2.gz GVZHGFXDBFAOOF-UBFVSLLYSA-N 3 1 398.639 3.294 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248396086 1433795072 /nfs/dbraw/zinc/79/50/72/1433795072.db2.gz GVZHGFXDBFAOOF-UBFVSLLYSA-N 3 1 398.639 3.294 20 0 GGADMP COCCC[NH+]1CCC(N[C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395176 1433795132 /nfs/dbraw/zinc/79/51/32/1433795132.db2.gz FZZGPPMUTWQUDF-QPTUXGOLSA-N 2 1 385.596 3.378 20 0 GGADMP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395176 1433795137 /nfs/dbraw/zinc/79/51/37/1433795137.db2.gz FZZGPPMUTWQUDF-QPTUXGOLSA-N 3 1 385.596 3.378 20 0 GGADMP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395176 1433795143 /nfs/dbraw/zinc/79/51/43/1433795143.db2.gz FZZGPPMUTWQUDF-QPTUXGOLSA-N 3 1 385.596 3.378 20 0 GGADMP CN(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395119 1433795359 /nfs/dbraw/zinc/79/53/59/1433795359.db2.gz FYRTVKQEWXDYRP-UBFVSLLYSA-N 3 1 398.639 3.150 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395119 1433795361 /nfs/dbraw/zinc/79/53/61/1433795361.db2.gz FYRTVKQEWXDYRP-UBFVSLLYSA-N 3 1 398.639 3.150 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248395119 1433795365 /nfs/dbraw/zinc/79/53/65/1433795365.db2.gz FYRTVKQEWXDYRP-UBFVSLLYSA-N 3 1 398.639 3.150 20 0 GGADMP C[C@@H](NC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248397554 1433795867 /nfs/dbraw/zinc/79/58/67/1433795867.db2.gz IAAHUWHAGNLQBV-AQNXPRMDSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@@H](NC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248397554 1433795871 /nfs/dbraw/zinc/79/58/71/1433795871.db2.gz IAAHUWHAGNLQBV-AQNXPRMDSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@@H](NC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248397554 1433795875 /nfs/dbraw/zinc/79/58/75/1433795875.db2.gz IAAHUWHAGNLQBV-AQNXPRMDSA-N 2 1 378.605 3.451 20 0 GGADMP Cc1ccc(CNC(=O)CN[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000248397093 1433795884 /nfs/dbraw/zinc/79/58/84/1433795884.db2.gz LAVIAFKUPLIMEX-GZOXUSKESA-N 2 1 379.548 3.357 20 0 GGADMP Cc1ccc(CNC(=O)C[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000248397093 1433795886 /nfs/dbraw/zinc/79/58/86/1433795886.db2.gz LAVIAFKUPLIMEX-GZOXUSKESA-N 2 1 379.548 3.357 20 0 GGADMP C[C@H](NC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248397553 1433795889 /nfs/dbraw/zinc/79/58/89/1433795889.db2.gz IAAHUWHAGNLQBV-AABGKKOBSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@H](NC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248397553 1433795890 /nfs/dbraw/zinc/79/58/90/1433795890.db2.gz IAAHUWHAGNLQBV-AABGKKOBSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@H](NC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248397553 1433795891 /nfs/dbraw/zinc/79/58/91/1433795891.db2.gz IAAHUWHAGNLQBV-AABGKKOBSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@H](NC(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248401540 1433797681 /nfs/dbraw/zinc/79/76/81/1433797681.db2.gz LVFZBIBWIFVWFQ-YRPNKDGESA-N 2 1 378.605 3.307 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248401540 1433797689 /nfs/dbraw/zinc/79/76/89/1433797689.db2.gz LVFZBIBWIFVWFQ-YRPNKDGESA-N 2 1 378.605 3.307 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248401540 1433797694 /nfs/dbraw/zinc/79/76/94/1433797694.db2.gz LVFZBIBWIFVWFQ-YRPNKDGESA-N 2 1 378.605 3.307 20 0 GGADMP C[C@H](NC(=O)C[C@H]1CN(Cc2ccccc2)CCO1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248405413 1433799063 /nfs/dbraw/zinc/79/90/63/1433799063.db2.gz RIWIABCTJKDPQM-RRPUWOKSSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248405413 1433799070 /nfs/dbraw/zinc/79/90/70/1433799070.db2.gz RIWIABCTJKDPQM-RRPUWOKSSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248405413 1433799075 /nfs/dbraw/zinc/79/90/75/1433799075.db2.gz RIWIABCTJKDPQM-RRPUWOKSSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248405413 1433799082 /nfs/dbraw/zinc/79/90/82/1433799082.db2.gz RIWIABCTJKDPQM-RRPUWOKSSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248405413 1433799087 /nfs/dbraw/zinc/79/90/87/1433799087.db2.gz RIWIABCTJKDPQM-RRPUWOKSSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)N1CC[N@H+](C)C[C@H]1c1ccccc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248403976 1433799228 /nfs/dbraw/zinc/79/92/28/1433799228.db2.gz PIQCLKUTBRCNFC-DWLFOUALSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[N@@H+](C)C[C@H]1c1ccccc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248403976 1433799233 /nfs/dbraw/zinc/79/92/33/1433799233.db2.gz PIQCLKUTBRCNFC-DWLFOUALSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C)C[C@H]1c1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248403976 1433799244 /nfs/dbraw/zinc/79/92/44/1433799244.db2.gz PIQCLKUTBRCNFC-DWLFOUALSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C)C[C@H]1c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248403976 1433799249 /nfs/dbraw/zinc/79/92/49/1433799249.db2.gz PIQCLKUTBRCNFC-DWLFOUALSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[N@H+](C)C[C@H]1c1ccccc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248403977 1433799564 /nfs/dbraw/zinc/79/95/64/1433799564.db2.gz PIQCLKUTBRCNFC-VCOUNFBDSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[N@@H+](C)C[C@H]1c1ccccc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248403977 1433799567 /nfs/dbraw/zinc/79/95/67/1433799567.db2.gz PIQCLKUTBRCNFC-VCOUNFBDSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C)C[C@H]1c1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248403977 1433799571 /nfs/dbraw/zinc/79/95/71/1433799571.db2.gz PIQCLKUTBRCNFC-VCOUNFBDSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C)C[C@H]1c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248403977 1433799575 /nfs/dbraw/zinc/79/95/75/1433799575.db2.gz PIQCLKUTBRCNFC-VCOUNFBDSA-N 2 1 384.568 3.338 20 0 GGADMP OCCOc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000248408322 1433800244 /nfs/dbraw/zinc/80/02/44/1433800244.db2.gz VKBXVYYEZYCPIP-RJGXRXQPSA-N 2 1 380.532 3.448 20 0 GGADMP O=C(NCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccccc1F ZINC000248409070 1433800267 /nfs/dbraw/zinc/80/02/67/1433800267.db2.gz WHOLOVCTEIMLEQ-UNWVZKJWSA-N 2 1 395.522 3.446 20 0 GGADMP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)C[C@@H](C)O1 ZINC000248410734 1433800361 /nfs/dbraw/zinc/80/03/61/1433800361.db2.gz HKUTYWOWULCPFN-PESUVLPXSA-N 3 1 385.596 3.376 20 0 GGADMP CN(C)C(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000248413046 1433800641 /nfs/dbraw/zinc/80/06/41/1433800641.db2.gz KUNALMCVSJDXSO-QPXUXIHVSA-N 2 1 391.559 3.186 20 0 GGADMP CN(C)C(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000248413046 1433800642 /nfs/dbraw/zinc/80/06/42/1433800642.db2.gz KUNALMCVSJDXSO-QPXUXIHVSA-N 2 1 391.559 3.186 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)[NH+](C)Cc1ccccc1 ZINC000248411952 1433800689 /nfs/dbraw/zinc/80/06/89/1433800689.db2.gz ZTWGYCJPLGLTCT-DYXWJJEUSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1)[N@H+](C)Cc1ccccc1 ZINC000248411952 1433800690 /nfs/dbraw/zinc/80/06/90/1433800690.db2.gz ZTWGYCJPLGLTCT-DYXWJJEUSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](CNC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000248411952 1433800692 /nfs/dbraw/zinc/80/06/92/1433800692.db2.gz ZTWGYCJPLGLTCT-DYXWJJEUSA-N 2 1 386.584 3.459 20 0 GGADMP CN(C)C(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248413045 1433800704 /nfs/dbraw/zinc/80/07/04/1433800704.db2.gz KUNALMCVSJDXSO-KEZOAJOQSA-N 2 1 391.559 3.186 20 0 GGADMP CN(C)C(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248413045 1433800705 /nfs/dbraw/zinc/80/07/05/1433800705.db2.gz KUNALMCVSJDXSO-KEZOAJOQSA-N 2 1 391.559 3.186 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C(=O)NCc1ccccc1 ZINC000248416906 1433800996 /nfs/dbraw/zinc/80/09/96/1433800996.db2.gz QIGBSCNXMUICID-XSEFMFLKSA-N 2 1 377.532 3.192 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000248428333 1433801842 /nfs/dbraw/zinc/80/18/42/1433801842.db2.gz ASBNTNXPIKKESZ-AUSIDOKSSA-N 3 1 397.563 3.044 20 0 GGADMP CCO[C@@H]1C[C@H]([NH+](C)CC2(C[N@H+](C)[C@H]3C[C@@H](OCC)C3(C)C)COC2)C1(C)C ZINC000248450578 1433803652 /nfs/dbraw/zinc/80/36/52/1433803652.db2.gz YCWJVJTZZDJGQY-VNTMZGSJSA-N 2 1 396.616 3.274 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cnn(Cc2ccccc2)c1 ZINC000248449904 1433803747 /nfs/dbraw/zinc/80/37/47/1433803747.db2.gz OSWNKEGKTJVTGP-NTKDMRAZSA-N 2 1 390.531 3.349 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)c1ccc(-n2cncn2)cc1 ZINC000248452569 1433803891 /nfs/dbraw/zinc/80/38/91/1433803891.db2.gz QAPAYXJMDIJOIR-JPYJTQIMSA-N 2 1 391.519 3.075 20 0 GGADMP CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)cc1 ZINC000248456662 1433804247 /nfs/dbraw/zinc/80/42/47/1433804247.db2.gz SKJFNDSGNOFIDQ-HXOBKFHXSA-N 2 1 381.520 3.453 20 0 GGADMP COCCOc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000248456323 1433804348 /nfs/dbraw/zinc/80/43/48/1433804348.db2.gz SEVAGGNIWKBGGE-PGRDOPGGSA-N 2 1 384.520 3.129 20 0 GGADMP COc1cccc(C[C@H]([NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)C2CC2)c1 ZINC000248459516 1433804678 /nfs/dbraw/zinc/80/46/78/1433804678.db2.gz VTMKPQORWPKLGR-VWNXMTODSA-N 2 1 380.532 3.373 20 0 GGADMP C[C@H](NCc1ccccc1C[N@H+]1CCC[C@H]1CO)c1nc2ccccc2n1C ZINC000248462743 1433804889 /nfs/dbraw/zinc/80/48/89/1433804889.db2.gz YMAJKVLTQUTUBB-PXNSSMCTSA-N 2 1 378.520 3.381 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1nc2ccccc2n1C ZINC000248462743 1433804890 /nfs/dbraw/zinc/80/48/90/1433804890.db2.gz YMAJKVLTQUTUBB-PXNSSMCTSA-N 2 1 378.520 3.381 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)c1nc2ccccc2n1C ZINC000248462743 1433804891 /nfs/dbraw/zinc/80/48/91/1433804891.db2.gz YMAJKVLTQUTUBB-PXNSSMCTSA-N 2 1 378.520 3.381 20 0 GGADMP CCC[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cccnc1 ZINC000248498623 1433805971 /nfs/dbraw/zinc/80/59/71/1433805971.db2.gz MJHYGCQAOLHKMB-FGZHOGPDSA-N 2 1 380.536 3.410 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000248585912 1433809835 /nfs/dbraw/zinc/80/98/35/1433809835.db2.gz PYYVIVZDRYPLKI-HQRMLTQVSA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000248585912 1433809836 /nfs/dbraw/zinc/80/98/36/1433809836.db2.gz PYYVIVZDRYPLKI-HQRMLTQVSA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000248585912 1433809838 /nfs/dbraw/zinc/80/98/38/1433809838.db2.gz PYYVIVZDRYPLKI-HQRMLTQVSA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000248585914 1433809910 /nfs/dbraw/zinc/80/99/10/1433809910.db2.gz PYYVIVZDRYPLKI-ILZDJORESA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000248585914 1433809911 /nfs/dbraw/zinc/80/99/11/1433809911.db2.gz PYYVIVZDRYPLKI-ILZDJORESA-N 2 1 378.944 3.337 20 0 GGADMP Cc1ccc(Cl)c(OC[C@H](O)C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000248585914 1433809912 /nfs/dbraw/zinc/80/99/12/1433809912.db2.gz PYYVIVZDRYPLKI-ILZDJORESA-N 2 1 378.944 3.337 20 0 GGADMP CC[C@H]([NH2+]CC(=O)NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)[C@@H]1CCCO1 ZINC000248595288 1433810176 /nfs/dbraw/zinc/81/01/76/1433810176.db2.gz MFUZYUMLCMTTRT-ZCNNSNEGSA-N 2 1 393.959 3.140 20 0 GGADMP COc1ccsc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248652072 1433813740 /nfs/dbraw/zinc/81/37/40/1433813740.db2.gz XUMZNSYRSKQPOT-CRAIPNDOSA-N 2 1 387.549 3.305 20 0 GGADMP Cc1c([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cnn1C(C)C ZINC000248688146 1433815387 /nfs/dbraw/zinc/81/53/87/1433815387.db2.gz IBDZSJAGAVMXPS-DYESRHJHSA-N 2 1 397.567 3.321 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+]1Cc1ccccc1 ZINC000248733733 1433818549 /nfs/dbraw/zinc/81/85/49/1433818549.db2.gz KHCMSUMYDUWTHC-XZOQPEGZSA-N 2 1 377.532 3.289 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000248733733 1433818550 /nfs/dbraw/zinc/81/85/50/1433818550.db2.gz KHCMSUMYDUWTHC-XZOQPEGZSA-N 2 1 377.532 3.289 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000248733733 1433818552 /nfs/dbraw/zinc/81/85/52/1433818552.db2.gz KHCMSUMYDUWTHC-XZOQPEGZSA-N 2 1 377.532 3.289 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)C[C@@H]2COCCN2C(=O)OC(C)(C)C)C1 ZINC000248770461 1433821446 /nfs/dbraw/zinc/82/14/46/1433821446.db2.gz XZHFBWIJJYYLOB-CEXWTWQISA-N 2 1 383.577 3.111 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000248770115 1433821551 /nfs/dbraw/zinc/82/15/51/1433821551.db2.gz SLLXNPMJJQPPQC-FGZHOGPDSA-N 2 1 386.584 3.176 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000248770115 1433821552 /nfs/dbraw/zinc/82/15/52/1433821552.db2.gz SLLXNPMJJQPPQC-FGZHOGPDSA-N 2 1 386.584 3.176 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000248770115 1433821555 /nfs/dbraw/zinc/82/15/55/1433821555.db2.gz SLLXNPMJJQPPQC-FGZHOGPDSA-N 2 1 386.584 3.176 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CCCO2)C[C@@H]1C ZINC000248831124 1433824521 /nfs/dbraw/zinc/82/45/21/1433824521.db2.gz LWFXKKXUBHKMEK-JKLQHZFJSA-N 2 1 388.552 3.235 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)C[C@@H]1C ZINC000248831124 1433824522 /nfs/dbraw/zinc/82/45/22/1433824522.db2.gz LWFXKKXUBHKMEK-JKLQHZFJSA-N 2 1 388.552 3.235 20 0 GGADMP CCOC(=O)C1CCC(O)(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)CC1 ZINC000248833041 1433824764 /nfs/dbraw/zinc/82/47/64/1433824764.db2.gz MJLODTVIBUGZMX-NDUMYTTKSA-N 2 1 380.573 3.057 20 0 GGADMP CCOC(=O)C1CCC(O)(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)CC1 ZINC000248833041 1433824767 /nfs/dbraw/zinc/82/47/67/1433824767.db2.gz MJLODTVIBUGZMX-NDUMYTTKSA-N 2 1 380.573 3.057 20 0 GGADMP CCOC(=O)C1CCC(O)(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)CC1 ZINC000248833041 1433824768 /nfs/dbraw/zinc/82/47/68/1433824768.db2.gz MJLODTVIBUGZMX-NDUMYTTKSA-N 2 1 380.573 3.057 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+]([C@H]3CCc4ccccc4NC3=O)CC2)C[C@H](C)O1 ZINC000248892593 1433828117 /nfs/dbraw/zinc/82/81/17/1433828117.db2.gz SLDMVETXVPKMJR-SVMVAKDDSA-N 2 1 385.552 3.151 20 0 GGADMP CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000248917235 1433829496 /nfs/dbraw/zinc/82/94/96/1433829496.db2.gz DKSDJZYKJQPODZ-FCHUYYIVSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1CN([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2c(F)cccc2Cl)CCO1 ZINC000248996358 1433831706 /nfs/dbraw/zinc/83/17/06/1433831706.db2.gz PAVRGLBAFBVEED-XJPIJLSESA-N 2 1 395.950 3.456 20 0 GGADMP C[C@@H]1CN([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2c(F)cccc2Cl)CCO1 ZINC000248996358 1433831707 /nfs/dbraw/zinc/83/17/07/1433831707.db2.gz PAVRGLBAFBVEED-XJPIJLSESA-N 2 1 395.950 3.456 20 0 GGADMP C[C@H]1CN([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2c(F)cccc2Cl)CCO1 ZINC000248996356 1433831760 /nfs/dbraw/zinc/83/17/60/1433831760.db2.gz PAVRGLBAFBVEED-MIGJQELLSA-N 2 1 395.950 3.456 20 0 GGADMP C[C@H]1CN([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2c(F)cccc2Cl)CCO1 ZINC000248996356 1433831762 /nfs/dbraw/zinc/83/17/62/1433831762.db2.gz PAVRGLBAFBVEED-MIGJQELLSA-N 2 1 395.950 3.456 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCCNc4ccccc43)c2)C1 ZINC000249058508 1433833330 /nfs/dbraw/zinc/83/33/30/1433833330.db2.gz ZKGFAVMMVSJWDA-NFBKMPQASA-N 2 1 392.547 3.421 20 0 GGADMP C[C@@H](Cc1ccccc1F)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000249197372 1433838784 /nfs/dbraw/zinc/83/87/84/1433838784.db2.gz RMBXLPSOIMJHSB-LAUBAEHRSA-N 2 1 383.511 3.244 20 0 GGADMP CCN(C(=O)NC[C@H]1CC[NH+](CC(C)C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249271841 1433839999 /nfs/dbraw/zinc/83/99/99/1433839999.db2.gz BLWNSAZSPCUKOL-YADHBBJMSA-N 2 1 386.584 3.270 20 0 GGADMP CN(C)[C@@H](CNC(=O)CN1CCC[C@H]1CC(=O)c1cccs1)c1ccccc1 ZINC000249283189 1433840399 /nfs/dbraw/zinc/84/03/99/1433840399.db2.gz HHDLXAAYKPJPAI-OALUTQOASA-N 2 1 399.560 3.204 20 0 GGADMP CCN(C(=O)NC[C@H](C)Cn1cc[nH+]c1C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000249357591 1433841619 /nfs/dbraw/zinc/84/16/19/1433841619.db2.gz RUHAHXHGKGZDRR-RXVVDRJESA-N 2 1 383.540 3.134 20 0 GGADMP CCN(C(=O)NC[C@H](C)Cn1cc[nH+]c1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249357591 1433841620 /nfs/dbraw/zinc/84/16/20/1433841620.db2.gz RUHAHXHGKGZDRR-RXVVDRJESA-N 2 1 383.540 3.134 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000249406996 1433843001 /nfs/dbraw/zinc/84/30/01/1433843001.db2.gz DJOBNRZJBGPCNU-VWPQPMDRSA-N 2 1 389.584 3.207 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000249406996 1433843002 /nfs/dbraw/zinc/84/30/02/1433843002.db2.gz DJOBNRZJBGPCNU-VWPQPMDRSA-N 2 1 389.584 3.207 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)[C@@H](C)C1 ZINC000249412813 1433843192 /nfs/dbraw/zinc/84/31/92/1433843192.db2.gz FOCWKZKJJRUUIF-OOSNJVJTSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)[C@@H](C)C1 ZINC000249412813 1433843193 /nfs/dbraw/zinc/84/31/93/1433843193.db2.gz FOCWKZKJJRUUIF-OOSNJVJTSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N2CCCc3ccccc32)[C@@H](C)C1 ZINC000249447060 1433844026 /nfs/dbraw/zinc/84/40/26/1433844026.db2.gz NLFDYSMPYNDBCQ-ZJOUEHCJSA-N 2 1 387.568 3.081 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N2CCCc3ccccc32)[C@@H](C)C1 ZINC000249447060 1433844028 /nfs/dbraw/zinc/84/40/28/1433844028.db2.gz NLFDYSMPYNDBCQ-ZJOUEHCJSA-N 2 1 387.568 3.081 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cc(C)ccc2C)[C@H](C)C1 ZINC000249478638 1433844606 /nfs/dbraw/zinc/84/46/06/1433844606.db2.gz WIULXYNPLCKKQI-AQNXPRMDSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cc(C)ccc2C)[C@H](C)C1 ZINC000249478638 1433844607 /nfs/dbraw/zinc/84/46/07/1433844607.db2.gz WIULXYNPLCKKQI-AQNXPRMDSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)cc2C)[C@H](C)C1 ZINC000249479597 1433844634 /nfs/dbraw/zinc/84/46/34/1433844634.db2.gz WNXYUOILIWNNPG-SBHAEUEKSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)cc2C)[C@H](C)C1 ZINC000249479597 1433844635 /nfs/dbraw/zinc/84/46/35/1433844635.db2.gz WNXYUOILIWNNPG-SBHAEUEKSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCC(=O)N[C@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000249486859 1433844813 /nfs/dbraw/zinc/84/48/13/1433844813.db2.gz YITDHCUYZJMTBH-HLIPFELVSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000249486859 1433844814 /nfs/dbraw/zinc/84/48/14/1433844814.db2.gz YITDHCUYZJMTBH-HLIPFELVSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000249486859 1433844815 /nfs/dbraw/zinc/84/48/15/1433844815.db2.gz YITDHCUYZJMTBH-HLIPFELVSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCC(=O)N[C@H](C)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249486539 1433844856 /nfs/dbraw/zinc/84/48/56/1433844856.db2.gz UNJXKVAVGONJTE-QKLQHJQFSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249486539 1433844857 /nfs/dbraw/zinc/84/48/57/1433844857.db2.gz UNJXKVAVGONJTE-QKLQHJQFSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249486539 1433844858 /nfs/dbraw/zinc/84/48/58/1433844858.db2.gz UNJXKVAVGONJTE-QKLQHJQFSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@H](C)c2ccccc2C)[C@@H](C)C1 ZINC000249493290 1433844960 /nfs/dbraw/zinc/84/49/60/1433844960.db2.gz VSBICHTVFQGCMJ-HIUFNZKISA-N 2 1 389.584 3.287 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@H](C)c2ccccc2C)[C@@H](C)C1 ZINC000249493290 1433844961 /nfs/dbraw/zinc/84/49/61/1433844961.db2.gz VSBICHTVFQGCMJ-HIUFNZKISA-N 2 1 389.584 3.287 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@H]3CC[N@H+](C4CC4)C3)cc2)C1 ZINC000249524142 1433846182 /nfs/dbraw/zinc/84/61/82/1433846182.db2.gz QRIPAIRCOJBWFG-WOIUINJBSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C)[NH+]1CCc2sccc2C1 ZINC000249530735 1433846516 /nfs/dbraw/zinc/84/65/16/1433846516.db2.gz YIQOGHQQLYXYLN-ROUUACIJSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@H+]1CCCC[C@@H]1C)[NH+]1CCc2sccc2C1 ZINC000249530735 1433846517 /nfs/dbraw/zinc/84/65/17/1433846517.db2.gz YIQOGHQQLYXYLN-ROUUACIJSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCCC[C@@H]1C)[N@@H+]1CCc2sccc2C1 ZINC000249530735 1433846518 /nfs/dbraw/zinc/84/65/18/1433846518.db2.gz YIQOGHQQLYXYLN-ROUUACIJSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCCC[C@@H]1C)[N@H+]1CCc2sccc2C1 ZINC000249530735 1433846519 /nfs/dbraw/zinc/84/65/19/1433846519.db2.gz YIQOGHQQLYXYLN-ROUUACIJSA-N 2 1 392.613 3.449 20 0 GGADMP CCn1nccc1N1CCC[C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)C1=O ZINC000249655045 1433848649 /nfs/dbraw/zinc/84/86/49/1433848649.db2.gz VEGIQPPRTINBLU-RLLQIKCJSA-N 2 1 387.572 3.031 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000249682324 1433848811 /nfs/dbraw/zinc/84/88/11/1433848811.db2.gz ACWSIEGMYOSOAJ-YLJYHZDGSA-N 2 1 378.536 3.240 20 0 GGADMP CC(C)N(C)c1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)cn1 ZINC000249712725 1433849465 /nfs/dbraw/zinc/84/94/65/1433849465.db2.gz ZDRGDGZXWWYZKO-QFIPXVFZSA-N 2 1 382.552 3.173 20 0 GGADMP Cc1ccc(C[NH+]2CCCN(C(=O)C[N@H+]3CCC[C@H]3c3cccn3C)CC2)cc1 ZINC000249720991 1433849766 /nfs/dbraw/zinc/84/97/66/1433849766.db2.gz MHYSIIKWGODDFZ-QHCPKHFHSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccc(C[NH+]2CCCN(C(=O)C[N@@H+]3CCC[C@H]3c3cccn3C)CC2)cc1 ZINC000249720991 1433849767 /nfs/dbraw/zinc/84/97/67/1433849767.db2.gz MHYSIIKWGODDFZ-QHCPKHFHSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccc(C[N@H+]2CCCN(C(=O)C[NH+]3CCC[C@H]3c3cccn3C)CC2)cc1 ZINC000249720991 1433849770 /nfs/dbraw/zinc/84/97/70/1433849770.db2.gz MHYSIIKWGODDFZ-QHCPKHFHSA-N 2 1 394.563 3.205 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)C[NH+]3CCC[C@H]3c3cccn3C)CC2)cc1 ZINC000249720991 1433849771 /nfs/dbraw/zinc/84/97/71/1433849771.db2.gz MHYSIIKWGODDFZ-QHCPKHFHSA-N 2 1 394.563 3.205 20 0 GGADMP C[N@H+]1CCCN(c2ccc(NC(=O)[C@H]3CCC[NH+]3Cc3ccccc3)cc2)CC1 ZINC000249792836 1433852071 /nfs/dbraw/zinc/85/20/71/1433852071.db2.gz VNQMTZKIBHXMDW-HSZRJFAPSA-N 2 1 392.547 3.432 20 0 GGADMP C[NH+]1CCCN(c2ccc(NC(=O)[C@H]3CCC[N@@H+]3Cc3ccccc3)cc2)CC1 ZINC000249792836 1433852073 /nfs/dbraw/zinc/85/20/73/1433852073.db2.gz VNQMTZKIBHXMDW-HSZRJFAPSA-N 2 1 392.547 3.432 20 0 GGADMP C[NH+]1CCCN(c2ccc(NC(=O)[C@H]3CCC[N@H+]3Cc3ccccc3)cc2)CC1 ZINC000249792836 1433852074 /nfs/dbraw/zinc/85/20/74/1433852074.db2.gz VNQMTZKIBHXMDW-HSZRJFAPSA-N 2 1 392.547 3.432 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)C1CCS(=O)(=O)CC1 ZINC000250120881 1433854682 /nfs/dbraw/zinc/85/46/82/1433854682.db2.gz VGESIBAHMISDCQ-ZWKOTPCHSA-N 2 1 378.582 3.221 20 0 GGADMP COc1ccc(COC[C@H](O)C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000250291410 1433855710 /nfs/dbraw/zinc/85/57/10/1433855710.db2.gz SWFRHLMXGGLLJG-FCHUYYIVSA-N 2 1 390.568 3.017 20 0 GGADMP O=C(N[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000250658163 1433857185 /nfs/dbraw/zinc/85/71/85/1433857185.db2.gz XJUXHTDWBKZYLH-JTHBVZDNSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000250658163 1433857186 /nfs/dbraw/zinc/85/71/86/1433857186.db2.gz XJUXHTDWBKZYLH-JTHBVZDNSA-N 2 1 395.522 3.428 20 0 GGADMP C[NH+](C)C[C@@H]1CCN(C(=O)NC[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)C1 ZINC000251545731 1433858759 /nfs/dbraw/zinc/85/87/59/1433858759.db2.gz GURZXWGTIDHHJU-URLQWDBASA-N 2 1 396.938 3.065 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C)C1)C1CC1 ZINC000251685651 1433859861 /nfs/dbraw/zinc/85/98/61/1433859861.db2.gz OBSVCSBBOGINEA-BHIFYINESA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1)C1CC1 ZINC000251685651 1433859863 /nfs/dbraw/zinc/85/98/63/1433859863.db2.gz OBSVCSBBOGINEA-BHIFYINESA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1)C1CC1 ZINC000251685651 1433859864 /nfs/dbraw/zinc/85/98/64/1433859864.db2.gz OBSVCSBBOGINEA-BHIFYINESA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H](Nc1cccc(C[N@H+]2CCC[C@H]2C(N)=O)c1)c1ccc(-n2ccnc2)cc1 ZINC000252734313 1433864461 /nfs/dbraw/zinc/86/44/61/1433864461.db2.gz GTDZLJHQWHOPHZ-VGSWGCGISA-N 2 1 389.503 3.495 20 0 GGADMP C[C@@H](Nc1cccc(CN2CCC[C@H]2C(N)=O)c1)c1ccc(-n2ccnc2)cc1 ZINC000252734313 1433864463 /nfs/dbraw/zinc/86/44/63/1433864463.db2.gz GTDZLJHQWHOPHZ-VGSWGCGISA-N 2 1 389.503 3.495 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(OC)c1 ZINC000255086052 1433876058 /nfs/dbraw/zinc/87/60/58/1433876058.db2.gz GPURWVWOJANTIQ-WIJUVXSSSA-N 2 1 388.552 3.276 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(OC)c1 ZINC000255086052 1433876059 /nfs/dbraw/zinc/87/60/59/1433876059.db2.gz GPURWVWOJANTIQ-WIJUVXSSSA-N 2 1 388.552 3.276 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)/C=C\c1nc2ccccc2s1 ZINC000255734983 1433888770 /nfs/dbraw/zinc/88/87/70/1433888770.db2.gz HKXFJHMECMVVMJ-WFTPILKQSA-N 2 1 386.565 3.184 20 0 GGADMP C[C@H](CNC(=O)NCc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)C[NH+]1CCCC1 ZINC000255957895 1433892865 /nfs/dbraw/zinc/89/28/65/1433892865.db2.gz JNGDKRKDVGDZLM-VQTJNVASSA-N 2 1 386.584 3.450 20 0 GGADMP [NH3+]C[C@@H]1CN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000261650371 1433898087 /nfs/dbraw/zinc/89/80/87/1433898087.db2.gz GHSUJYWDJABJIE-ZRBLBEILSA-N 2 1 377.532 3.100 20 0 GGADMP [NH3+]C[C@@H]1CN(C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000261650368 1433898096 /nfs/dbraw/zinc/89/80/96/1433898096.db2.gz GHSUJYWDJABJIE-ZLNRFVROSA-N 2 1 377.532 3.100 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1)[C@@H]1CCC[NH2+]1 ZINC000261649457 1433898130 /nfs/dbraw/zinc/89/81/30/1433898130.db2.gz ALFJVIKHNRWAFG-REWPJTCUSA-N 2 1 377.532 3.434 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)C[C@H]1c1ccccc1 ZINC000261747106 1433901144 /nfs/dbraw/zinc/90/11/44/1433901144.db2.gz PUIJPDXRMUMYRS-QUCCMNQESA-N 2 1 390.487 3.022 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)Nc3ccc4c(c3F)CC[NH2+]C4)CC2)cs1 ZINC000261758506 1433902191 /nfs/dbraw/zinc/90/21/91/1433902191.db2.gz QACUQYGVMHWIPW-UHFFFAOYSA-N 2 1 388.512 3.087 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cc1)C1CC1 ZINC000261807438 1433905072 /nfs/dbraw/zinc/90/50/72/1433905072.db2.gz RGMVHCWVNRNCGH-GGAORHGYSA-N 2 1 377.532 3.485 20 0 GGADMP CCOc1cc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)ccc1OCC(=O)Nc1ccccc1 ZINC000261817169 1433905348 /nfs/dbraw/zinc/90/53/48/1433905348.db2.gz XJZFMPYPEAIIGW-QHCPKHFHSA-N 2 1 397.519 3.274 20 0 GGADMP CCOc1cc(C[N@H+]2CC[C@@](C)(C[NH3+])C2)ccc1OCC(=O)Nc1ccccc1 ZINC000261817169 1433905349 /nfs/dbraw/zinc/90/53/49/1433905349.db2.gz XJZFMPYPEAIIGW-QHCPKHFHSA-N 2 1 397.519 3.274 20 0 GGADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000261820221 1433905582 /nfs/dbraw/zinc/90/55/82/1433905582.db2.gz KGLRBUDMGUPJTC-RVKKMQEKSA-N 2 1 399.457 3.226 20 0 GGADMP FC(F)(F)c1cc(C[N@@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)cc(C(F)(F)F)c1 ZINC000261827818 1433905838 /nfs/dbraw/zinc/90/58/38/1433905838.db2.gz AAUITIBLHXIDJN-OAHLLOKOSA-N 2 1 381.364 3.204 20 0 GGADMP FC(F)(F)c1cc(C[N@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)cc(C(F)(F)F)c1 ZINC000261827818 1433905840 /nfs/dbraw/zinc/90/58/40/1433905840.db2.gz AAUITIBLHXIDJN-OAHLLOKOSA-N 2 1 381.364 3.204 20 0 GGADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000261880032 1433909387 /nfs/dbraw/zinc/90/93/87/1433909387.db2.gz PAYJAYBBDAIQEG-RKVPGOIHSA-N 2 1 383.458 3.347 20 0 GGADMP Cc1ccc(-c2nc(C[N@@H+]3CCC[C@@H](CNC(=O)[C@@H]4CCC[NH2+]4)C3)cs2)cc1 ZINC000261897601 1433910430 /nfs/dbraw/zinc/91/04/30/1433910430.db2.gz REZGFOCDMZESPJ-PXNSSMCTSA-N 2 1 398.576 3.199 20 0 GGADMP Cc1ccc(-c2nc(C[N@H+]3CCC[C@@H](CNC(=O)[C@@H]4CCC[NH2+]4)C3)cs2)cc1 ZINC000261897601 1433910436 /nfs/dbraw/zinc/91/04/36/1433910436.db2.gz REZGFOCDMZESPJ-PXNSSMCTSA-N 2 1 398.576 3.199 20 0 GGADMP C[NH2+]CCC1CC[NH+](CC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)CC1 ZINC000261970709 1433918310 /nfs/dbraw/zinc/91/83/10/1433918310.db2.gz CYOUVGBGYWVGGH-UHFFFAOYSA-N 2 1 383.540 3.058 20 0 GGADMP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000261981110 1433919224 /nfs/dbraw/zinc/91/92/24/1433919224.db2.gz RIRWOMXKOBDWFA-YJBOKZPZSA-N 2 1 383.458 3.094 20 0 GGADMP O=C(c1ccc(C[NH+]2CCSCC2)cc1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000261990493 1433919519 /nfs/dbraw/zinc/91/95/19/1433919519.db2.gz OXTKFLVCLPLOEQ-OAQYLSRUSA-N 2 1 399.535 3.161 20 0 GGADMP C[NH2+]CCC1CC[NH+](CC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)CC1 ZINC000261994500 1433920021 /nfs/dbraw/zinc/92/00/21/1433920021.db2.gz NGHCSRKFCGUYLG-NRFANRHFSA-N 2 1 389.540 3.414 20 0 GGADMP [NH3+]CCC(=O)NC[C@H]1CCCC[N@H+]1Cc1ccc(OCc2ccccc2)cc1 ZINC000262015022 1433922377 /nfs/dbraw/zinc/92/23/77/1433922377.db2.gz MQUIIOWOIMPGQE-OAQYLSRUSA-N 2 1 381.520 3.085 20 0 GGADMP C[NH2+]CCC1CC[NH+](CC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)CC1 ZINC000262017364 1433922839 /nfs/dbraw/zinc/92/28/39/1433922839.db2.gz WPIBJFAJUUDWRB-UHFFFAOYSA-N 2 1 381.524 3.010 20 0 GGADMP c1csc(-c2nn(-c3ccccc3)cc2C[N@H+]2CC[C@H](N3CC[NH2+]CC3)C2)c1 ZINC000262074357 1433926008 /nfs/dbraw/zinc/92/60/08/1433926008.db2.gz CWCDUFCFJKACBL-FQEVSTJZSA-N 2 1 393.560 3.080 20 0 GGADMP Clc1ccccc1COc1cccc(C[N@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)c1 ZINC000262102389 1433926933 /nfs/dbraw/zinc/92/69/33/1433926933.db2.gz IWXQHHMRAARAAA-HXUWFJFHSA-N 2 1 385.939 3.399 20 0 GGADMP FC(F)(F)c1ccc(-c2nc(C[N@@H+]3CC[C@@H](N4CC[NH2+]CC4)C3)cs2)cc1 ZINC000262110215 1433927408 /nfs/dbraw/zinc/92/74/08/1433927408.db2.gz KIPKANZZJKEIEU-QGZVFWFLSA-N 2 1 396.482 3.308 20 0 GGADMP FC(F)(F)c1ccc(-c2nc(C[N@H+]3CC[C@@H](N4CC[NH2+]CC4)C3)cs2)cc1 ZINC000262110215 1433927409 /nfs/dbraw/zinc/92/74/09/1433927409.db2.gz KIPKANZZJKEIEU-QGZVFWFLSA-N 2 1 396.482 3.308 20 0 GGADMP c1c(C[N@H+]2CC[C@H](N3CC[NH2+]CC3)C2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000262168419 1433929535 /nfs/dbraw/zinc/92/95/35/1433929535.db2.gz UQEPBMISTQJNBH-QHCPKHFHSA-N 2 1 387.531 3.019 20 0 GGADMP COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)CCC(=O)N2CC[NH2+]CC2)cc1 ZINC000262232216 1433931880 /nfs/dbraw/zinc/93/18/80/1433931880.db2.gz VMJNGGWGZPHGRW-SFHVURJKSA-N 2 1 381.520 3.177 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)C2C[C@H]3CCC[C@@H](C2)C3[NH3+])[C@@H]1c1cccs1 ZINC000262278892 1433933388 /nfs/dbraw/zinc/93/33/88/1433933388.db2.gz LKVKYBCCTMAVKH-MOMQOBQFSA-N 2 1 375.582 3.401 20 0 GGADMP C[C@H]1C[C@@H](C(=O)NC[C@@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CC[NH2+]1 ZINC000262311763 1433934599 /nfs/dbraw/zinc/93/45/99/1433934599.db2.gz BMZNRQLOOMGEFO-QRFRQXIXSA-N 2 1 383.561 3.352 20 0 GGADMP C[C@H]1C[C@@H](C(=O)NC[C@@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CC[NH2+]1 ZINC000262311763 1433934600 /nfs/dbraw/zinc/93/46/00/1433934600.db2.gz BMZNRQLOOMGEFO-QRFRQXIXSA-N 2 1 383.561 3.352 20 0 GGADMP C[C@@H](C(=O)N1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1)C1C[NH2+]C1 ZINC000262409662 1433938219 /nfs/dbraw/zinc/93/82/19/1433938219.db2.gz QNMCOFXLCFUJKW-OAHLLOKOSA-N 2 1 387.524 3.054 20 0 GGADMP CCCN(C(=O)c1csc(CC[NH3+])n1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000262433645 1433938857 /nfs/dbraw/zinc/93/88/57/1433938857.db2.gz WYGHJHJDKBRQFQ-SFHVURJKSA-N 2 1 386.565 3.161 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)N(CCC[NH3+])Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000262492342 1433941265 /nfs/dbraw/zinc/94/12/65/1433941265.db2.gz VIDVBQJYVALHPC-PMACEKPBSA-N 2 1 395.547 3.287 20 0 GGADMP [NH3+]CC1(CC(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)CCCCC1 ZINC000262671941 1433949222 /nfs/dbraw/zinc/94/92/22/1433949222.db2.gz PSRLZOQLYYRJDO-UHFFFAOYSA-N 2 1 379.495 3.345 20 0 GGADMP CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2ccn([C@H]3CCC[NH2+]C3)n2)c1 ZINC000262698282 1433950422 /nfs/dbraw/zinc/95/04/22/1433950422.db2.gz BQOSYHHQSNZFCI-IBGZPJMESA-N 2 1 392.507 3.428 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1(C)C ZINC000262792595 1433956599 /nfs/dbraw/zinc/95/65/99/1433956599.db2.gz OKZYGIQXIQXHDZ-ZJSXRUAMSA-N 2 1 395.547 3.017 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccn([C@@H]4CCC[NH2+]C4)n3)cc2)C1 ZINC000262834195 1433960020 /nfs/dbraw/zinc/96/00/20/1433960020.db2.gz SJRIORMPYKNQTL-YLJYHZDGSA-N 2 1 381.524 3.292 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccn([C@@H]4CCC[NH2+]C4)n3)cc2)C1 ZINC000262834184 1433960147 /nfs/dbraw/zinc/96/01/47/1433960147.db2.gz SJRIORMPYKNQTL-FXAWDEMLSA-N 2 1 381.524 3.292 20 0 GGADMP CN(CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1cccc2c1CCCN2 ZINC000263269555 1433999544 /nfs/dbraw/zinc/99/95/44/1433999544.db2.gz WLENVQQDDJNYKJ-UHFFFAOYSA-N 2 1 398.595 3.313 20 0 GGADMP CCOc1cc(C[NH2+]C2CC[NH+](CCOC)CC2)ccc1OCC(F)(F)F ZINC000263666436 1434017582 /nfs/dbraw/zinc/01/75/82/1434017582.db2.gz IRSBIFICGJOLBF-UHFFFAOYSA-N 2 1 390.446 3.227 20 0 GGADMP CCOc1c(OC)cc(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1OC ZINC000263667981 1434017945 /nfs/dbraw/zinc/01/79/45/1434017945.db2.gz IZPZLMWDWNTLEY-CALCHBBNSA-N 2 1 380.529 3.082 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)NC2CC[NH+](CCCOC)CC2)cc1 ZINC000263811883 1434036658 /nfs/dbraw/zinc/03/66/58/1434036658.db2.gz WVNNJUBSFVKQKV-UHFFFAOYSA-N 2 1 375.557 3.149 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC([NH+]2CCCCC2)CC1 ZINC000264217279 1434083331 /nfs/dbraw/zinc/08/33/31/1434083331.db2.gz STLQBDUYEVGUFX-JOCHJYFZSA-N 2 1 398.595 3.211 20 0 GGADMP C[N@@H+](CCCCCn1cccn1)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000264359330 1434101606 /nfs/dbraw/zinc/10/16/06/1434101606.db2.gz JGEKYPGTCNCEDU-QHCPKHFHSA-N 2 1 384.568 3.431 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc(C[NH+]3CCCC3)cc2)[C@H](C)C1 ZINC000265253581 1434207760 /nfs/dbraw/zinc/20/77/60/1434207760.db2.gz KSZXVJTYPLRYEY-DENIHFKCSA-N 2 1 387.568 3.149 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc(C[NH+]3CCCC3)cc2)[C@H](C)C1 ZINC000265253583 1434208158 /nfs/dbraw/zinc/20/81/58/1434208158.db2.gz KSZXVJTYPLRYEY-KNQAVFIVSA-N 2 1 387.568 3.149 20 0 GGADMP CCOC(=O)CCCC[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000265811090 1434267014 /nfs/dbraw/zinc/26/70/14/1434267014.db2.gz PVKQDHALYJMJSF-OAQYLSRUSA-N 2 1 376.541 3.097 20 0 GGADMP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCn1cc[nH+]c1C ZINC000266611182 1434354250 /nfs/dbraw/zinc/35/42/50/1434354250.db2.gz WAMMZMZQMQWBQA-OAQYLSRUSA-N 2 1 383.540 3.135 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCCCn1cc[nH+]c1C ZINC000266611182 1434354252 /nfs/dbraw/zinc/35/42/52/1434354252.db2.gz WAMMZMZQMQWBQA-OAQYLSRUSA-N 2 1 383.540 3.135 20 0 GGADMP CC[NH+]1CCC(NC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)CC1 ZINC000266665181 1434361014 /nfs/dbraw/zinc/36/10/14/1434361014.db2.gz JGPJPOAFFHTSBT-UHFFFAOYSA-N 2 1 384.524 3.195 20 0 GGADMP CC[NH+]1CCC(NC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)CC1 ZINC000266665181 1434361016 /nfs/dbraw/zinc/36/10/16/1434361016.db2.gz JGPJPOAFFHTSBT-UHFFFAOYSA-N 2 1 384.524 3.195 20 0 GGADMP CC[N@@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)NCCCCn1cc[nH+]c1C ZINC000266738750 1434369667 /nfs/dbraw/zinc/36/96/67/1434369667.db2.gz CLTKNYIGJCIOHV-OAQYLSRUSA-N 2 1 398.555 3.063 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)NCCCCn1cc[nH+]c1C ZINC000266738750 1434369670 /nfs/dbraw/zinc/36/96/70/1434369670.db2.gz CLTKNYIGJCIOHV-OAQYLSRUSA-N 2 1 398.555 3.063 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(CCCc1ccccc1)CC[NH+](C)C ZINC000266912438 1434387715 /nfs/dbraw/zinc/38/77/15/1434387715.db2.gz ZWWVZAUGZMIJCF-UHFFFAOYSA-N 2 1 385.556 3.178 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4c3cccc4F)c2)C1 ZINC000267078597 1434405941 /nfs/dbraw/zinc/40/59/41/1434405941.db2.gz UNPPQRIRBSDWRF-XMSQKQJNSA-N 2 1 381.495 3.300 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000267298167 1434420512 /nfs/dbraw/zinc/42/05/12/1434420512.db2.gz FANNXQFOAZBICX-PGRDOPGGSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000267298159 1434420565 /nfs/dbraw/zinc/42/05/65/1434420565.db2.gz FANNXQFOAZBICX-AVRDEDQJSA-N 2 1 384.568 3.071 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000267323138 1434422843 /nfs/dbraw/zinc/42/28/43/1434422843.db2.gz KPIVWLPEPUQRHS-LVCYWYKZSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000267323138 1434422850 /nfs/dbraw/zinc/42/28/50/1434422850.db2.gz KPIVWLPEPUQRHS-LVCYWYKZSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000267323129 1434422916 /nfs/dbraw/zinc/42/29/16/1434422916.db2.gz KPIVWLPEPUQRHS-DBXWQHBBSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000267323129 1434422917 /nfs/dbraw/zinc/42/29/17/1434422917.db2.gz KPIVWLPEPUQRHS-DBXWQHBBSA-N 2 1 383.540 3.037 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000267325199 1434423030 /nfs/dbraw/zinc/42/30/30/1434423030.db2.gz DYQVKHSDNHDAIO-DENIHFKCSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000267359275 1434425588 /nfs/dbraw/zinc/42/55/88/1434425588.db2.gz IYMWDTFGONLGOZ-DENIHFKCSA-N 2 1 386.584 3.270 20 0 GGADMP CCO[C@@H](CC[NH+](C)C)C[NH2+]Cc1csc(COc2ccc(OC)cc2)n1 ZINC000267866711 1434472180 /nfs/dbraw/zinc/47/21/80/1434472180.db2.gz KJCYMEXIISCOBI-IBGZPJMESA-N 2 1 393.553 3.177 20 0 GGADMP Cc1ccn2cc(C[NH2+]Cc3ccccc3N(C)C3CC[NH+](C)CC3)nc2c1 ZINC000268380792 1434517196 /nfs/dbraw/zinc/51/71/96/1434517196.db2.gz USBKVRYVNJTDDZ-UHFFFAOYSA-N 2 1 377.536 3.463 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]CC3(O)CC[NH+](C(C)C)CC3)cs2)cc1 ZINC000268449521 1434523886 /nfs/dbraw/zinc/52/38/86/1434523886.db2.gz VQMHMEVJRVDFNK-UHFFFAOYSA-N 2 1 389.565 3.355 20 0 GGADMP CC[N@H+](C)[C@H](C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1ccccc1 ZINC000268776574 1434555841 /nfs/dbraw/zinc/55/58/41/1434555841.db2.gz UAGYAQYLPUBPDZ-QFIPXVFZSA-N 2 1 395.551 3.244 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1ccccc1 ZINC000268776574 1434555845 /nfs/dbraw/zinc/55/58/45/1434555845.db2.gz UAGYAQYLPUBPDZ-QFIPXVFZSA-N 2 1 395.551 3.244 20 0 GGADMP COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(C(=O)N2CC[NH+](C)CC2)cc1 ZINC000268800308 1434558707 /nfs/dbraw/zinc/55/87/07/1434558707.db2.gz HJZNZBXBYZIJEI-HSZRJFAPSA-N 2 1 393.531 3.250 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(N2CCOCC2)c1 ZINC000268805815 1434559304 /nfs/dbraw/zinc/55/93/04/1434559304.db2.gz HHPUMPYDGOGQPD-HSALFYBXSA-N 2 1 375.557 3.063 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000268808783 1434559660 /nfs/dbraw/zinc/55/96/60/1434559660.db2.gz CMHUCFOZAFLPIK-FCHUYYIVSA-N 2 1 395.551 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000268808783 1434559664 /nfs/dbraw/zinc/55/96/64/1434559664.db2.gz CMHUCFOZAFLPIK-FCHUYYIVSA-N 2 1 395.551 3.278 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000268808437 1434559854 /nfs/dbraw/zinc/55/98/54/1434559854.db2.gz LMMSHKOKQOVHQC-OFNKIYASSA-N 3 1 384.612 3.188 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000268808437 1434559857 /nfs/dbraw/zinc/55/98/57/1434559857.db2.gz LMMSHKOKQOVHQC-OFNKIYASSA-N 3 1 384.612 3.188 20 0 GGADMP C[C@@H]([NH2+]C[C@@H](O)C[NH+]1CCCC1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000268826560 1434561361 /nfs/dbraw/zinc/56/13/61/1434561361.db2.gz JBGBLYVXHCFWRR-WIYYLYMNSA-N 2 1 394.519 3.021 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2ccc(OCc3nccn3C)cc2)CC1 ZINC000268838617 1434563039 /nfs/dbraw/zinc/56/30/39/1434563039.db2.gz SYMTXWFUHHDZBO-FQEVSTJZSA-N 2 1 399.583 3.067 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(NS(C)(=O)=O)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268839551 1434563344 /nfs/dbraw/zinc/56/33/44/1434563344.db2.gz QMSRHMPWNJLMAT-LAUBAEHRSA-N 2 1 387.549 3.201 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2cccc(CS(C)(=O)=O)c2)CC[N@@H+]1Cc1ccccc1 ZINC000268850759 1434564628 /nfs/dbraw/zinc/56/46/28/1434564628.db2.gz XVWGBTCKFZSICC-PGRDOPGGSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2cccc(CS(C)(=O)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000268850759 1434564633 /nfs/dbraw/zinc/56/46/33/1434564633.db2.gz XVWGBTCKFZSICC-PGRDOPGGSA-N 2 1 386.561 3.374 20 0 GGADMP COc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000268875029 1434566965 /nfs/dbraw/zinc/56/69/65/1434566965.db2.gz GTWFUXVZLQCRDP-UGKGYDQZSA-N 2 1 393.531 3.170 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000268883566 1434567629 /nfs/dbraw/zinc/56/76/29/1434567629.db2.gz IMZZYYPGNYOAQV-XTQVGHSUSA-N 2 1 384.520 3.380 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000268883566 1434567631 /nfs/dbraw/zinc/56/76/31/1434567631.db2.gz IMZZYYPGNYOAQV-XTQVGHSUSA-N 2 1 384.520 3.380 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(N3CCOCC3)c2)[C@H](C)C1 ZINC000268881644 1434567646 /nfs/dbraw/zinc/56/76/46/1434567646.db2.gz HZQRUJGLAUILMO-QTEQDKRBSA-N 2 1 389.584 3.311 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(N3CCOCC3)c2)[C@@H](C)C1 ZINC000268881640 1434567660 /nfs/dbraw/zinc/56/76/60/1434567660.db2.gz HZQRUJGLAUILMO-MZKRTTBSSA-N 2 1 389.584 3.311 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OCCOC)cc2)[C@H](C)C1 ZINC000268901636 1434568927 /nfs/dbraw/zinc/56/89/27/1434568927.db2.gz LHYDZEQPRUQNBC-KNKQGSTJSA-N 2 1 378.557 3.499 20 0 GGADMP O=C1Nc2ccccc2C12CCC([NH2+]CC1([NH+]3CCCC3)CCOCC1)CC2 ZINC000268902705 1434569326 /nfs/dbraw/zinc/56/93/26/1434569326.db2.gz RIFJBVGTVJWVHZ-UHFFFAOYSA-N 2 1 383.536 3.054 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)cc1 ZINC000268921079 1434571302 /nfs/dbraw/zinc/57/13/02/1434571302.db2.gz QEIJHDLSKDYIDW-SFHVURJKSA-N 2 1 389.588 3.141 20 0 GGADMP CNC(=O)[C@H](Cc1c[nH]c2ccccc12)[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC000268928413 1434571860 /nfs/dbraw/zinc/57/18/60/1434571860.db2.gz WVLXRGXXFCOJJV-NYDSKATKSA-N 2 1 396.579 3.458 20 0 GGADMP CNC(=O)[C@H](Cc1c[nH]c2ccccc12)[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000268928411 1434571896 /nfs/dbraw/zinc/57/18/96/1434571896.db2.gz WVLXRGXXFCOJJV-MONBJTKQSA-N 2 1 396.579 3.458 20 0 GGADMP CN(C)C(=O)[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000268959320 1434575802 /nfs/dbraw/zinc/57/58/02/1434575802.db2.gz XFSRRBINUZQYRA-WIYYLYMNSA-N 2 1 375.532 3.069 20 0 GGADMP CN(C)C(=O)[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000268959309 1434575880 /nfs/dbraw/zinc/57/58/80/1434575880.db2.gz XFSRRBINUZQYRA-NQIIRXRSSA-N 2 1 375.532 3.069 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)cc1 ZINC000268972102 1434577146 /nfs/dbraw/zinc/57/71/46/1434577146.db2.gz ZPZOLTBBNIZDQF-FXAWDEMLSA-N 2 1 376.545 3.104 20 0 GGADMP OC[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000268997063 1434579639 /nfs/dbraw/zinc/57/96/39/1434579639.db2.gz NWOYNMRBKNQJNZ-QPPBQGQZSA-N 2 1 379.548 3.128 20 0 GGADMP OC[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000268997063 1434579641 /nfs/dbraw/zinc/57/96/41/1434579641.db2.gz NWOYNMRBKNQJNZ-QPPBQGQZSA-N 2 1 379.548 3.128 20 0 GGADMP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccccc2OCc2cccnc2)CC1 ZINC000268995134 1434579719 /nfs/dbraw/zinc/57/97/19/1434579719.db2.gz XHRAPYUADWKTJW-FCHUYYIVSA-N 2 1 381.520 3.128 20 0 GGADMP OC[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000268997065 1434579731 /nfs/dbraw/zinc/57/97/31/1434579731.db2.gz NWOYNMRBKNQJNZ-XUZZJYLKSA-N 2 1 379.548 3.128 20 0 GGADMP OC[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000268997065 1434579733 /nfs/dbraw/zinc/57/97/33/1434579733.db2.gz NWOYNMRBKNQJNZ-XUZZJYLKSA-N 2 1 379.548 3.128 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H](C)c3cccc(N4CCOCC4)c3)CC2)nc(C)[nH+]1 ZINC000269064708 1434587077 /nfs/dbraw/zinc/58/70/77/1434587077.db2.gz LAZAWAPKZATWJC-GOSISDBHSA-N 2 1 395.551 3.250 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2ccc3c(ccn3CCC[NH3+])c2)C1 ZINC000269269037 1434615915 /nfs/dbraw/zinc/61/59/15/1434615915.db2.gz QUTRWAZLWSPTTK-LJQANCHMSA-N 2 1 379.508 3.226 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N(C)CCCn1cc[nH+]c1C ZINC000269476794 1434651212 /nfs/dbraw/zinc/65/12/12/1434651212.db2.gz FHEJHJJJDDXHNO-UHFFFAOYSA-N 2 1 387.528 3.466 20 0 GGADMP O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C1 ZINC000269716116 1434671346 /nfs/dbraw/zinc/67/13/46/1434671346.db2.gz SFFBYFCHSRDCIQ-HKUYNNGSSA-N 2 1 381.520 3.200 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000270218327 1434714074 /nfs/dbraw/zinc/71/40/74/1434714074.db2.gz MILVXRMHOKWMJA-PTUXOGIPSA-N 2 1 398.595 3.270 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000270246437 1434716247 /nfs/dbraw/zinc/71/62/47/1434716247.db2.gz PWOVBONSOKNCRI-OIBXWCBGSA-N 2 1 398.595 3.413 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1F ZINC000270288772 1434719798 /nfs/dbraw/zinc/71/97/98/1434719798.db2.gz WMDOJEPKNKDBPR-LJQANCHMSA-N 2 1 399.514 3.193 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cnc4ccccc4c3)CC2)CC1 ZINC000271146337 1434804703 /nfs/dbraw/zinc/80/47/03/1434804703.db2.gz AVFNFRXQGVYHJI-UHFFFAOYSA-N 2 1 380.536 3.001 20 0 GGADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000271476199 1434828094 /nfs/dbraw/zinc/82/80/94/1434828094.db2.gz MRKGRZAMXLCWPW-FXAWDEMLSA-N 2 1 383.561 3.133 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000271476199 1434828095 /nfs/dbraw/zinc/82/80/95/1434828095.db2.gz MRKGRZAMXLCWPW-FXAWDEMLSA-N 2 1 383.561 3.133 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(S(N)(=O)=O)c1 ZINC000271611899 1434838967 /nfs/dbraw/zinc/83/89/67/1434838967.db2.gz AVHPJPSWBNESCT-ZWOKBUDYSA-N 2 1 387.549 3.038 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(S(N)(=O)=O)c1 ZINC000271611899 1434838968 /nfs/dbraw/zinc/83/89/68/1434838968.db2.gz AVHPJPSWBNESCT-ZWOKBUDYSA-N 2 1 387.549 3.038 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccc(S(N)(=O)=O)c1 ZINC000271611898 1434839028 /nfs/dbraw/zinc/83/90/28/1434839028.db2.gz AVHPJPSWBNESCT-UWVAXJGDSA-N 2 1 387.549 3.038 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccc(S(N)(=O)=O)c1 ZINC000271611898 1434839030 /nfs/dbraw/zinc/83/90/30/1434839030.db2.gz AVHPJPSWBNESCT-UWVAXJGDSA-N 2 1 387.549 3.038 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](c2nccn2C)C2CC2)cc1OC ZINC000271781399 1434850046 /nfs/dbraw/zinc/85/00/46/1434850046.db2.gz GYUCQEBERLOBND-NRFANRHFSA-N 2 1 386.540 3.390 20 0 GGADMP COC(=O)CCCN1CCC([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)CC1 ZINC000271791751 1434850932 /nfs/dbraw/zinc/85/09/32/1434850932.db2.gz JBVZYDSQJUWDFQ-UHFFFAOYSA-N 2 1 375.557 3.034 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000271859032 1434855391 /nfs/dbraw/zinc/85/53/91/1434855391.db2.gz NPELNZSQWCICCJ-INIZCTEOSA-N 2 1 375.538 3.025 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc(S(N)(=O)=O)c2)c1 ZINC000271866136 1434855825 /nfs/dbraw/zinc/85/58/25/1434855825.db2.gz PCBPMZOCROYTOJ-MRXNPFEDSA-N 2 1 375.538 3.025 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+]Cc2cccc(C(=O)OC(C)(C)C)c2)CC1 ZINC000272191521 1434877062 /nfs/dbraw/zinc/87/70/62/1434877062.db2.gz VNZHSWHANJINJP-UHFFFAOYSA-N 2 1 375.557 3.149 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000272277153 1434883599 /nfs/dbraw/zinc/88/35/99/1434883599.db2.gz FBFGRKNXFGFLGI-HJNYFJLDSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000272277153 1434883601 /nfs/dbraw/zinc/88/36/01/1434883601.db2.gz FBFGRKNXFGFLGI-HJNYFJLDSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000272277153 1434883602 /nfs/dbraw/zinc/88/36/02/1434883602.db2.gz FBFGRKNXFGFLGI-HJNYFJLDSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000272277149 1434883634 /nfs/dbraw/zinc/88/36/34/1434883634.db2.gz FBFGRKNXFGFLGI-BVSLBCMMSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000272277149 1434883636 /nfs/dbraw/zinc/88/36/36/1434883636.db2.gz FBFGRKNXFGFLGI-BVSLBCMMSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000272277149 1434883638 /nfs/dbraw/zinc/88/36/38/1434883638.db2.gz FBFGRKNXFGFLGI-BVSLBCMMSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cnnn2)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272307454 1434885939 /nfs/dbraw/zinc/88/59/39/1434885939.db2.gz IBIIUPNVMYUCCE-WAOWUJCRSA-N 2 1 376.508 3.224 20 0 GGADMP COc1c(O)cccc1C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000272332603 1434887766 /nfs/dbraw/zinc/88/77/66/1434887766.db2.gz WVMCOPNOTJSPLF-JOCHJYFZSA-N 2 1 384.520 3.278 20 0 GGADMP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1ccco1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272341708 1434888514 /nfs/dbraw/zinc/88/85/14/1434888514.db2.gz BWTFKUSJKVNJHX-FPOVZHCZSA-N 2 1 398.551 3.263 20 0 GGADMP C[C@@H]([NH2+]C1CCN(C(=O)c2ccco2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272345894 1434889141 /nfs/dbraw/zinc/88/91/41/1434889141.db2.gz PTABIZQODKBOOA-QUCCMNQESA-N 2 1 381.520 3.384 20 0 GGADMP COCC[C@H]([NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000272508002 1434901775 /nfs/dbraw/zinc/90/17/75/1434901775.db2.gz VOKJADPDHVNYIL-NQIIRXRSSA-N 2 1 399.535 3.116 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000272534806 1434905026 /nfs/dbraw/zinc/90/50/26/1434905026.db2.gz PDWOYLSULQSAJV-PDGJWGCVSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@@H]21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272534806 1434905028 /nfs/dbraw/zinc/90/50/28/1434905028.db2.gz PDWOYLSULQSAJV-PDGJWGCVSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@@H]21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272534806 1434905030 /nfs/dbraw/zinc/90/50/30/1434905030.db2.gz PDWOYLSULQSAJV-PDGJWGCVSA-N 2 1 384.568 3.023 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000272553215 1434907016 /nfs/dbraw/zinc/90/70/16/1434907016.db2.gz SWTQIEULIJWCBK-SFGWALBWSA-N 2 1 384.520 3.237 20 0 GGADMP C[N@H+]1CC=C(C[NH2+][C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000272557441 1434907616 /nfs/dbraw/zinc/90/76/16/1434907616.db2.gz DPVIQJFHKLLOTD-OAQYLSRUSA-N 2 1 388.508 3.170 20 0 GGADMP C[N@@H+]1CC=C(C[NH2+][C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000272557441 1434907617 /nfs/dbraw/zinc/90/76/17/1434907617.db2.gz DPVIQJFHKLLOTD-OAQYLSRUSA-N 2 1 388.508 3.170 20 0 GGADMP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000272564737 1434908362 /nfs/dbraw/zinc/90/83/62/1434908362.db2.gz KHBGWIYSMHSEGE-MSOLQXFVSA-N 2 1 388.556 3.274 20 0 GGADMP Cc1ccc([C@H]([NH2+]CC2=CC[N@@H+](C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000272609119 1434914355 /nfs/dbraw/zinc/91/43/55/1434914355.db2.gz KCWPQTMSUIROEL-QFIPXVFZSA-N 2 1 384.545 3.339 20 0 GGADMP C[C@@H]([NH2+]C1CCN(C(=O)c2ccncc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272659467 1434920594 /nfs/dbraw/zinc/92/05/94/1434920594.db2.gz MPKDFGIKIDMJAL-DENIHFKCSA-N 2 1 392.547 3.186 20 0 GGADMP C[C@H](NC(=O)NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)C1=CC[N@@H+](C)CC1 ZINC000272694801 1434923532 /nfs/dbraw/zinc/92/35/32/1434923532.db2.gz DDBRVKLDSIFPQD-QRVBRYPASA-N 2 1 384.568 3.093 20 0 GGADMP C[C@H](NC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)C1=CC[N@@H+](C)CC1 ZINC000272708746 1434924979 /nfs/dbraw/zinc/92/49/79/1434924979.db2.gz JZZFGPSPDYORDP-KRWDZBQOSA-N 2 1 388.581 3.050 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCN(c4nccs4)CC3)c2)CCO1 ZINC000272739102 1434927135 /nfs/dbraw/zinc/92/71/35/1434927135.db2.gz QMCSAFFNTCTXEO-QGZVFWFLSA-N 2 1 386.565 3.122 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCN(c4nccs4)CC3)c2)CCO1 ZINC000272739102 1434927136 /nfs/dbraw/zinc/92/71/36/1434927136.db2.gz QMCSAFFNTCTXEO-QGZVFWFLSA-N 2 1 386.565 3.122 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCN(CCC(F)(F)F)CC3)c2)CCO1 ZINC000272748401 1434927968 /nfs/dbraw/zinc/92/79/68/1434927968.db2.gz SIHYCJJRWKNFRM-KRWDZBQOSA-N 2 1 399.501 3.414 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCN(CCC(F)(F)F)CC3)c2)CCO1 ZINC000272748401 1434927970 /nfs/dbraw/zinc/92/79/70/1434927970.db2.gz SIHYCJJRWKNFRM-KRWDZBQOSA-N 2 1 399.501 3.414 20 0 GGADMP C[C@H](NC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272837643 1434935096 /nfs/dbraw/zinc/93/50/96/1434935096.db2.gz QUKWBPMHLISRJB-VSYWRSJOSA-N 2 1 385.596 3.255 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272837643 1434935099 /nfs/dbraw/zinc/93/50/99/1434935099.db2.gz QUKWBPMHLISRJB-VSYWRSJOSA-N 3 1 385.596 3.255 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272837643 1434935100 /nfs/dbraw/zinc/93/51/00/1434935100.db2.gz QUKWBPMHLISRJB-VSYWRSJOSA-N 3 1 385.596 3.255 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272846141 1434935606 /nfs/dbraw/zinc/93/56/06/1434935606.db2.gz SWOBNNIWAXVZIA-QFBILLFUSA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000272846141 1434935609 /nfs/dbraw/zinc/93/56/09/1434935609.db2.gz SWOBNNIWAXVZIA-QFBILLFUSA-N 2 1 396.539 3.028 20 0 GGADMP C[C@@H]([NH2+]CCCc1nnc2n1CCCCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272875602 1434938090 /nfs/dbraw/zinc/93/80/90/1434938090.db2.gz WWZPBDASHHZFQZ-CTNGQTDRSA-N 2 1 381.568 3.437 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccsc1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000272889589 1434938821 /nfs/dbraw/zinc/93/88/21/1434938821.db2.gz YZWBOGPJGQKCOS-BXWFABGCSA-N 2 1 378.586 3.303 20 0 GGADMP C[C@H](NC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)C1=CC[NH+](C)CC1 ZINC000272937423 1434942410 /nfs/dbraw/zinc/94/24/10/1434942410.db2.gz LQWGEDDXUNTGON-KRWDZBQOSA-N 2 1 390.959 3.208 20 0 GGADMP C[C@H](NC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)C1=CC[NH+](C)CC1 ZINC000272937423 1434942412 /nfs/dbraw/zinc/94/24/12/1434942412.db2.gz LQWGEDDXUNTGON-KRWDZBQOSA-N 2 1 390.959 3.208 20 0 GGADMP C[C@H](NC(=O)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1)C1=CC[N@H+](C)CC1 ZINC000272937423 1434942414 /nfs/dbraw/zinc/94/24/14/1434942414.db2.gz LQWGEDDXUNTGON-KRWDZBQOSA-N 2 1 390.959 3.208 20 0 GGADMP C[C@H](NC(=O)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1)C1=CC[N@@H+](C)CC1 ZINC000272937423 1434942417 /nfs/dbraw/zinc/94/24/17/1434942417.db2.gz LQWGEDDXUNTGON-KRWDZBQOSA-N 2 1 390.959 3.208 20 0 GGADMP CC[NH+](CC)CCN(Cc1cccs1)C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000272955063 1434943865 /nfs/dbraw/zinc/94/38/65/1434943865.db2.gz NAYNMSLWAPELIG-KRWDZBQOSA-N 2 1 378.586 3.252 20 0 GGADMP C[C@H](NC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1=CC[NH+](C)CC1 ZINC000272986307 1434947000 /nfs/dbraw/zinc/94/70/00/1434947000.db2.gz PONFUFSWKIAYQC-DXIQSLLYSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1)C1=CC[N@H+](C)CC1 ZINC000272986307 1434947001 /nfs/dbraw/zinc/94/70/01/1434947001.db2.gz PONFUFSWKIAYQC-DXIQSLLYSA-N 2 1 384.568 3.331 20 0 GGADMP C[C@H](NC(=O)N(C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1)C1=CC[N@@H+](C)CC1 ZINC000272986307 1434947002 /nfs/dbraw/zinc/94/70/02/1434947002.db2.gz PONFUFSWKIAYQC-DXIQSLLYSA-N 2 1 384.568 3.331 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]C3CCN(Cc4ccncc4)CC3)CC2)cc1 ZINC000272988183 1434947094 /nfs/dbraw/zinc/94/70/94/1434947094.db2.gz WDUVXIPFMHCHMF-UHFFFAOYSA-N 2 1 396.554 3.482 20 0 GGADMP C[C@@H](NC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)C1=CC[NH+](C)CC1 ZINC000273000291 1434948644 /nfs/dbraw/zinc/94/86/44/1434948644.db2.gz RDGMFJMIANUKDP-UZLBHIALSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@@H](NC(=O)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)C1=CC[N@H+](C)CC1 ZINC000273000291 1434948648 /nfs/dbraw/zinc/94/86/48/1434948648.db2.gz RDGMFJMIANUKDP-UZLBHIALSA-N 2 1 395.469 3.208 20 0 GGADMP C[C@@H](NC(=O)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)C1=CC[N@@H+](C)CC1 ZINC000273000291 1434948652 /nfs/dbraw/zinc/94/86/52/1434948652.db2.gz RDGMFJMIANUKDP-UZLBHIALSA-N 2 1 395.469 3.208 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCN(Cc3ccccn3)C2=O)cc1 ZINC000273322979 1434980828 /nfs/dbraw/zinc/98/08/28/1434980828.db2.gz ZPCDAXCAPCYADU-VGOFRKELSA-N 2 1 389.503 3.418 20 0 GGADMP C[C@H](NC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000273407908 1434986900 /nfs/dbraw/zinc/98/69/00/1434986900.db2.gz IDTKAEWLYQCSPD-IPJJNNNSSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000273410909 1434987027 /nfs/dbraw/zinc/98/70/27/1434987027.db2.gz ISRSMJDSHAIJKZ-DXIQSLLYSA-N 2 1 386.584 3.411 20 0 GGADMP CC[NH+](CC)[C@@H](CNC1CC[NH+](CCCC(=O)OC)CC1)c1ccsc1 ZINC000274247769 1435054666 /nfs/dbraw/zinc/05/46/66/1435054666.db2.gz XWIWVNYTQDYFFS-IBGZPJMESA-N 2 1 381.586 3.138 20 0 GGADMP CCn1nc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c2ccccc21 ZINC000274386436 1435067236 /nfs/dbraw/zinc/06/72/36/1435067236.db2.gz BLMKINBHVROUCP-FQEVSTJZSA-N 2 1 378.520 3.303 20 0 GGADMP CCn1nc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)c2ccccc21 ZINC000274386436 1435067238 /nfs/dbraw/zinc/06/72/38/1435067238.db2.gz BLMKINBHVROUCP-FQEVSTJZSA-N 2 1 378.520 3.303 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000274511125 1435075777 /nfs/dbraw/zinc/07/57/77/1435075777.db2.gz VHYNRHPXSURJAX-KRWDZBQOSA-N 2 1 384.524 3.261 20 0 GGADMP CCOC(=O)c1nn(C)cc1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000274511125 1435075781 /nfs/dbraw/zinc/07/57/81/1435075781.db2.gz VHYNRHPXSURJAX-KRWDZBQOSA-N 2 1 384.524 3.261 20 0 GGADMP C[C@H]([NH2+][C@@H]1CCCN(Cc2ccccn2)C1=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274741650 1435088945 /nfs/dbraw/zinc/08/89/45/1435088945.db2.gz FIXLQNALLOWVGG-IEIRFRATSA-N 2 1 392.547 3.073 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749789 1435089691 /nfs/dbraw/zinc/08/96/91/1435089691.db2.gz HFIDUINYCHRGCW-GRYUFTJMSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CC[C@@H](O)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274749789 1435089693 /nfs/dbraw/zinc/08/96/93/1435089693.db2.gz HFIDUINYCHRGCW-GRYUFTJMSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CC[C@@H](O)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274749789 1435089695 /nfs/dbraw/zinc/08/96/95/1435089695.db2.gz HFIDUINYCHRGCW-GRYUFTJMSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749789 1435089696 /nfs/dbraw/zinc/08/96/96/1435089696.db2.gz HFIDUINYCHRGCW-GRYUFTJMSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[N@H+]1CC[C@@H](O)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749789 1435089699 /nfs/dbraw/zinc/08/96/99/1435089699.db2.gz HFIDUINYCHRGCW-GRYUFTJMSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[NH+]1CC[C@@H](O)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274749789 1435089701 /nfs/dbraw/zinc/08/97/01/1435089701.db2.gz HFIDUINYCHRGCW-GRYUFTJMSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[NH+]1CC[C@@H](O)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274749789 1435089703 /nfs/dbraw/zinc/08/97/03/1435089703.db2.gz HFIDUINYCHRGCW-GRYUFTJMSA-N 2 1 393.575 3.253 20 0 GGADMP COc1ccc(-c2ccncc2)cc1C[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1 ZINC000274759521 1435090242 /nfs/dbraw/zinc/09/02/42/1435090242.db2.gz GMGLYLUCORXNLA-YADHBBJMSA-N 2 1 381.520 3.225 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N(C)[C@H](C)c2ccc(F)cc2)[C@@H](C)C1 ZINC000274865930 1435099221 /nfs/dbraw/zinc/09/92/21/1435099221.db2.gz UFWWNZNNOQZOQK-UEXGIBASSA-N 2 1 393.547 3.072 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N(C)[C@H](C)c2ccc(F)cc2)[C@@H](C)C1 ZINC000274865930 1435099223 /nfs/dbraw/zinc/09/92/23/1435099223.db2.gz UFWWNZNNOQZOQK-UEXGIBASSA-N 2 1 393.547 3.072 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(Cl)cn1 ZINC000274877172 1435100195 /nfs/dbraw/zinc/10/01/95/1435100195.db2.gz GXTZNSLYAATXHX-MAUKXSAKSA-N 2 1 386.927 3.283 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(Cl)cn1 ZINC000274877172 1435100197 /nfs/dbraw/zinc/10/01/97/1435100197.db2.gz GXTZNSLYAATXHX-MAUKXSAKSA-N 2 1 386.927 3.283 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(Cl)cn1 ZINC000274878021 1435100521 /nfs/dbraw/zinc/10/05/21/1435100521.db2.gz GXTZNSLYAATXHX-QAPCUYQASA-N 2 1 386.927 3.283 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(Cl)cn1 ZINC000274878021 1435100522 /nfs/dbraw/zinc/10/05/22/1435100522.db2.gz GXTZNSLYAATXHX-QAPCUYQASA-N 2 1 386.927 3.283 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(CS(C)(=O)=O)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274903687 1435102533 /nfs/dbraw/zinc/10/25/33/1435102533.db2.gz LSBYODIMVDCEFO-AVRDEDQJSA-N 2 1 386.561 3.231 20 0 GGADMP Cn1cncc1[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)CCO1 ZINC000275399697 1435136602 /nfs/dbraw/zinc/13/66/02/1435136602.db2.gz CJSMYNBCYKSRNQ-GJTYKATRSA-N 2 1 380.536 3.140 20 0 GGADMP CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000275532386 1435146255 /nfs/dbraw/zinc/14/62/55/1435146255.db2.gz LYUIFJZCXPHMQF-BTPPTMBQSA-N 2 1 394.563 3.481 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C[C@H]1CCc2[nH+]ccn2C1 ZINC000275577312 1435150010 /nfs/dbraw/zinc/15/00/10/1435150010.db2.gz OSZIFJSEAGJHDR-ZIAGYGMSSA-N 2 1 396.413 3.351 20 0 GGADMP C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]C[C@H]1CCc2[nH+]ccn2C1 ZINC000275723318 1435162995 /nfs/dbraw/zinc/16/29/95/1435162995.db2.gz ZEFWVEKHNROJFD-ZIAGYGMSSA-N 2 1 380.414 3.471 20 0 GGADMP C[C@@H](NC(=O)NCc1ccc(CC[NH+](C)C)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000276110618 1435191551 /nfs/dbraw/zinc/19/15/51/1435191551.db2.gz CZGXDEOEVPAUAL-WIYYLYMNSA-N 2 1 386.584 3.243 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N(C)Cc2ccccc2C)[C@H](C)C1 ZINC000276286941 1435202327 /nfs/dbraw/zinc/20/23/27/1435202327.db2.gz VBPUUWHMQBJGQP-SJBKTWHCSA-N 2 1 389.584 3.069 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N(C)Cc2ccccc2C)[C@H](C)C1 ZINC000276286941 1435202331 /nfs/dbraw/zinc/20/23/31/1435202331.db2.gz VBPUUWHMQBJGQP-SJBKTWHCSA-N 2 1 389.584 3.069 20 0 GGADMP CCC[NH+](CCC)CCCNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000276355956 1435206692 /nfs/dbraw/zinc/20/66/92/1435206692.db2.gz IAOYHASGZODKNU-OAQYLSRUSA-N 2 1 389.588 3.057 20 0 GGADMP CCS(=O)(=O)CCCCC[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000276449719 1435212001 /nfs/dbraw/zinc/21/20/01/1435212001.db2.gz KACYRCRXFHZKSC-UHFFFAOYSA-N 2 1 380.598 3.435 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc2c(c1)CC[NH2+]CC2 ZINC000276600606 1435219975 /nfs/dbraw/zinc/21/99/75/1435219975.db2.gz KGFKUVSHBROSQZ-QGZVFWFLSA-N 2 1 383.561 3.078 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000276658641 1435223280 /nfs/dbraw/zinc/22/32/80/1435223280.db2.gz VPQGOWGAYKPNEF-DENIHFKCSA-N 2 1 382.552 3.164 20 0 GGADMP C[C@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)CC[NH2+]CC3)CC[N@H+]1Cc1ccccc1 ZINC000276728382 1435228340 /nfs/dbraw/zinc/22/83/40/1435228340.db2.gz YHQRJLSKILIFED-CYFREDJKSA-N 2 1 391.559 3.500 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[N@@H+]2CCC[C@@H]2C(N)=O)no1)[NH+]1CCCCCC1 ZINC000276917691 1435242815 /nfs/dbraw/zinc/24/28/15/1435242815.db2.gz LWABTHBLUYUGQB-QFBILLFUSA-N 2 1 397.523 3.123 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[N@H+]2CCC[C@@H]2C(N)=O)no1)[NH+]1CCCCCC1 ZINC000276917691 1435242817 /nfs/dbraw/zinc/24/28/17/1435242817.db2.gz LWABTHBLUYUGQB-QFBILLFUSA-N 2 1 397.523 3.123 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[NH+]2CCC[C@H]2C(N)=O)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000276932067 1435244326 /nfs/dbraw/zinc/24/43/26/1435244326.db2.gz OIKMEQCYCREVPC-OLMMMNRUSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[NH+]2CCC[C@H]2C(N)=O)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276932067 1435244328 /nfs/dbraw/zinc/24/43/28/1435244328.db2.gz OIKMEQCYCREVPC-OLMMMNRUSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[N@@H+]2CCC[C@H]2C(N)=O)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276932067 1435244329 /nfs/dbraw/zinc/24/43/29/1435244329.db2.gz OIKMEQCYCREVPC-OLMMMNRUSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@H](c1nc(-c2ccccc2C[N@H+]2CCC[C@H]2C(N)=O)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276932067 1435244331 /nfs/dbraw/zinc/24/43/31/1435244331.db2.gz OIKMEQCYCREVPC-OLMMMNRUSA-N 2 1 397.523 3.120 20 0 GGADMP C[C@H](c1nc(-c2ccc(N3CCC[N@@H+](C)CC3)nc2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000276981626 1435249531 /nfs/dbraw/zinc/24/95/31/1435249531.db2.gz WBQXWBMHBQYGFU-BRWVUGGUSA-N 2 1 384.528 3.207 20 0 GGADMP CCCn1ccnc1CCC[N@@H+](C)CCCS(=O)(=O)c1ccc(C)cc1 ZINC000277042359 1435255575 /nfs/dbraw/zinc/25/55/75/1435255575.db2.gz BXOKHQSOSXAKRV-UHFFFAOYSA-N 2 1 377.554 3.330 20 0 GGADMP CCCn1ccnc1CCCN(C)CCCS(=O)(=O)c1ccc(C)cc1 ZINC000277042359 1435255578 /nfs/dbraw/zinc/25/55/78/1435255578.db2.gz BXOKHQSOSXAKRV-UHFFFAOYSA-N 2 1 377.554 3.330 20 0 GGADMP C[NH+](C)[C@H]1CCCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000277047080 1435256094 /nfs/dbraw/zinc/25/60/94/1435256094.db2.gz GUJIFUNJTHESES-SFHVURJKSA-N 2 1 376.570 3.183 20 0 GGADMP COc1cc2c(cc1OC)C[N@H+](Cc1ccccc1NC(=O)[C@H](C)[C@@H](C)[NH3+])CC2 ZINC000277111756 1435263038 /nfs/dbraw/zinc/26/30/38/1435263038.db2.gz VOEIVRAJZKPRTA-HZPDHXFCSA-N 2 1 397.519 3.184 20 0 GGADMP COc1cc2c(cc1OC)C[N@@H+](Cc1ccccc1NC(=O)[C@H](C)[C@@H](C)[NH3+])CC2 ZINC000277111756 1435263041 /nfs/dbraw/zinc/26/30/41/1435263041.db2.gz VOEIVRAJZKPRTA-HZPDHXFCSA-N 2 1 397.519 3.184 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)N[C@@H](C)c1ccccc1OC ZINC000277223938 1435280777 /nfs/dbraw/zinc/28/07/77/1435280777.db2.gz OFEQOQQVUSWKPR-ZWKOTPCHSA-N 2 1 386.540 3.432 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)N[C@@H](C)c1ccccc1OC ZINC000277223938 1435280780 /nfs/dbraw/zinc/28/07/80/1435280780.db2.gz OFEQOQQVUSWKPR-ZWKOTPCHSA-N 2 1 386.540 3.432 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000277331759 1435294805 /nfs/dbraw/zinc/29/48/05/1435294805.db2.gz VPMIIZYRXUUATJ-IBGZPJMESA-N 2 1 383.540 3.234 20 0 GGADMP C[NH+](C)[C@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000277364733 1435298876 /nfs/dbraw/zinc/29/88/76/1435298876.db2.gz UZOKOXUAUXVUAV-ICSRJNTNSA-N 2 1 397.485 3.384 20 0 GGADMP C[NH+](C)[C@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000277364727 1435298907 /nfs/dbraw/zinc/29/89/07/1435298907.db2.gz UZOKOXUAUXVUAV-AZUAARDMSA-N 2 1 397.485 3.384 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)CC1 ZINC000277995513 1435348649 /nfs/dbraw/zinc/34/86/49/1435348649.db2.gz NQDOAQJLJTWZKE-GOSISDBHSA-N 2 1 388.556 3.455 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000277995513 1435348651 /nfs/dbraw/zinc/34/86/51/1435348651.db2.gz NQDOAQJLJTWZKE-GOSISDBHSA-N 2 1 388.556 3.455 20 0 GGADMP COc1cc(C[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)ccc1OCc1ccncc1 ZINC000278059254 1435355002 /nfs/dbraw/zinc/35/50/02/1435355002.db2.gz YQFAAZHSIKSQOS-IBGZPJMESA-N 2 1 399.535 3.260 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC1CC[NH+](C2CC2)CC1 ZINC000278251444 1435373634 /nfs/dbraw/zinc/37/36/34/1435373634.db2.gz VYXGONCBAHTBFL-OAQYLSRUSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@H]1C[N@H+](CCC[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)CCCO1 ZINC000278371345 1435384732 /nfs/dbraw/zinc/38/47/32/1435384732.db2.gz BXVCYGFZMYFEIZ-KRWDZBQOSA-N 2 1 393.959 3.035 20 0 GGADMP C[C@H]1C[N@@H+](CCC[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)CCCO1 ZINC000278371345 1435384735 /nfs/dbraw/zinc/38/47/35/1435384735.db2.gz BXVCYGFZMYFEIZ-KRWDZBQOSA-N 2 1 393.959 3.035 20 0 GGADMP C[C@@H]1C[N@H+](CCC[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)CCCO1 ZINC000278371351 1435384787 /nfs/dbraw/zinc/38/47/87/1435384787.db2.gz BXVCYGFZMYFEIZ-QGZVFWFLSA-N 2 1 393.959 3.035 20 0 GGADMP C[C@@H]1C[N@@H+](CCC[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)CCCO1 ZINC000278371351 1435384790 /nfs/dbraw/zinc/38/47/90/1435384790.db2.gz BXVCYGFZMYFEIZ-QGZVFWFLSA-N 2 1 393.959 3.035 20 0 GGADMP CCOc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1F ZINC000278488757 1435394669 /nfs/dbraw/zinc/39/46/69/1435394669.db2.gz LUGNQTTZOJDLTG-HXUWFJFHSA-N 2 1 399.510 3.212 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1 ZINC000278516130 1435396394 /nfs/dbraw/zinc/39/63/94/1435396394.db2.gz MLVHANQLINYVCT-ZWKOTPCHSA-N 2 1 376.545 3.368 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1 ZINC000278516130 1435396396 /nfs/dbraw/zinc/39/63/96/1435396396.db2.gz MLVHANQLINYVCT-ZWKOTPCHSA-N 2 1 376.545 3.368 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1 ZINC000278516117 1435396520 /nfs/dbraw/zinc/39/65/20/1435396520.db2.gz MLVHANQLINYVCT-MSOLQXFVSA-N 2 1 376.545 3.368 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1 ZINC000278516117 1435396522 /nfs/dbraw/zinc/39/65/22/1435396522.db2.gz MLVHANQLINYVCT-MSOLQXFVSA-N 2 1 376.545 3.368 20 0 GGADMP COCCSCCC[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000278530241 1435397555 /nfs/dbraw/zinc/39/75/55/1435397555.db2.gz QIGRYGMAQUKUGS-OAQYLSRUSA-N 2 1 380.598 3.134 20 0 GGADMP COCCSCCC[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000278530237 1435397673 /nfs/dbraw/zinc/39/76/73/1435397673.db2.gz QIGRYGMAQUKUGS-NRFANRHFSA-N 2 1 380.598 3.134 20 0 GGADMP Cc1ccc(NC(=O)C[C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)c(Cl)c1 ZINC000278611089 1435405307 /nfs/dbraw/zinc/40/53/07/1435405307.db2.gz RGGBWKAPYOAMCX-DLBZAZTESA-N 2 1 381.948 3.456 20 0 GGADMP Cc1ccc(NC(=O)C[C@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)c(Cl)c1 ZINC000278611089 1435405310 /nfs/dbraw/zinc/40/53/10/1435405310.db2.gz RGGBWKAPYOAMCX-DLBZAZTESA-N 2 1 381.948 3.456 20 0 GGADMP O=C(CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)N1CCc2ccccc2C1 ZINC000278792783 1435424054 /nfs/dbraw/zinc/42/40/54/1435424054.db2.gz FASNXKWERQFVOY-UHFFFAOYSA-N 2 1 392.547 3.374 20 0 GGADMP CCC[NH+](CC)Cc1ccc(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)cc1 ZINC000278909720 1435438616 /nfs/dbraw/zinc/43/86/16/1435438616.db2.gz SRUXBLSLKGRYNK-LJQANCHMSA-N 2 1 387.568 3.244 20 0 GGADMP CCC[NH+](CC)Cc1ccc(C(=O)N2CC[N@H+](C3CCOCC3)C[C@H]2C)cc1 ZINC000278909720 1435438618 /nfs/dbraw/zinc/43/86/18/1435438618.db2.gz SRUXBLSLKGRYNK-LJQANCHMSA-N 2 1 387.568 3.244 20 0 GGADMP CCCN(C(=O)c1cc([C@H]2CC[NH2+]C2)n[nH]1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000279104958 1435460706 /nfs/dbraw/zinc/46/07/06/1435460706.db2.gz XRIXHNPNOULYBH-PMACEKPBSA-N 2 1 395.551 3.003 20 0 GGADMP CCCN(C(=O)c1cc([C@@H]2CC[NH2+]C2)n[nH]1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000279104961 1435460945 /nfs/dbraw/zinc/46/09/45/1435460945.db2.gz XRIXHNPNOULYBH-WOJBJXKFSA-N 2 1 395.551 3.003 20 0 GGADMP Cc1cc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)ccc1-n1cncn1 ZINC000279171447 1435467322 /nfs/dbraw/zinc/46/73/22/1435467322.db2.gz BUFOGKQVMMKDOE-UHFFFAOYSA-N 2 1 376.508 3.488 20 0 GGADMP Cc1nc[nH]c1CC(=O)N1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000279498570 1435506121 /nfs/dbraw/zinc/50/61/21/1435506121.db2.gz SJKIPPOMOFCSDB-UHFFFAOYSA-N 2 1 394.441 3.402 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)[C@@H]2CCC[NH+]2C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000279862186 1435554012 /nfs/dbraw/zinc/55/40/12/1435554012.db2.gz MPNYQNKEGAYMQG-CCKFTAQKSA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)[C@@H]2CCC[N@@H+]2C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000279862186 1435554022 /nfs/dbraw/zinc/55/40/22/1435554022.db2.gz MPNYQNKEGAYMQG-CCKFTAQKSA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)[C@@H]2CCC[N@H+]2C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000279862186 1435554028 /nfs/dbraw/zinc/55/40/28/1435554028.db2.gz MPNYQNKEGAYMQG-CCKFTAQKSA-N 2 1 379.907 3.215 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)[C@H]2CCC[NH+]2C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000279862202 1435554133 /nfs/dbraw/zinc/55/41/33/1435554133.db2.gz MPNYQNKEGAYMQG-ZMYBRWDISA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)[C@H]2CCC[N@@H+]2C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000279862202 1435554141 /nfs/dbraw/zinc/55/41/41/1435554141.db2.gz MPNYQNKEGAYMQG-ZMYBRWDISA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)[C@H]2CCC[N@H+]2C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000279862202 1435554150 /nfs/dbraw/zinc/55/41/50/1435554150.db2.gz MPNYQNKEGAYMQG-ZMYBRWDISA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+](C)Cc1cccc(NC(=O)N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC000279922534 1435563494 /nfs/dbraw/zinc/56/34/94/1435563494.db2.gz FWVBJSAZKVZFJI-OYRHEFFESA-N 2 1 378.520 3.344 20 0 GGADMP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000280157062 1435600910 /nfs/dbraw/zinc/60/09/10/1435600910.db2.gz FMTKPIBLAATXLG-QFIPXVFZSA-N 2 1 376.504 3.037 20 0 GGADMP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000280157059 1435601028 /nfs/dbraw/zinc/60/10/28/1435601028.db2.gz FMTKPIBLAATXLG-JOCHJYFZSA-N 2 1 376.504 3.037 20 0 GGADMP CO[C@]1(C)CCC[N@H+]([C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000280510822 1435671596 /nfs/dbraw/zinc/67/15/96/1435671596.db2.gz NNWGUUQBMZMQCT-AUSIDOKSSA-N 2 1 387.568 3.047 20 0 GGADMP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cn1 ZINC000280542978 1435676826 /nfs/dbraw/zinc/67/68/26/1435676826.db2.gz DBDHXBCVGCWWOV-YADHBBJMSA-N 2 1 380.536 3.317 20 0 GGADMP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC2([NH+]3CCCC3)CCOCC2)cc1OC ZINC000280752076 1435714472 /nfs/dbraw/zinc/71/44/72/1435714472.db2.gz CTFFEBHDGDNAGF-ZWKOTPCHSA-N 2 1 376.541 3.430 20 0 GGADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC2([NH+]3CCCC3)CCOCC2)cc1OC ZINC000280752069 1435714657 /nfs/dbraw/zinc/71/46/57/1435714657.db2.gz CTFFEBHDGDNAGF-QZTJIDSGSA-N 2 1 376.541 3.430 20 0 GGADMP CC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280810908 1435724366 /nfs/dbraw/zinc/72/43/66/1435724366.db2.gz JFAZNHIUNCWOFG-GOSISDBHSA-N 2 1 399.988 3.163 20 0 GGADMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280908485 1435740477 /nfs/dbraw/zinc/74/04/77/1435740477.db2.gz QGEHWCQEBPGVPY-DYVFJYSZSA-N 2 1 398.960 3.130 20 0 GGADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccnc2N2CCOCC2)CC1 ZINC000281127258 1435780886 /nfs/dbraw/zinc/78/08/86/1435780886.db2.gz YASIFWKKWFOEFR-UHFFFAOYSA-N 2 1 394.563 3.451 20 0 GGADMP CN(CCC[NH+]1CCCC1)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000281163604 1435787691 /nfs/dbraw/zinc/78/76/91/1435787691.db2.gz KTKYRDHKBYKRNX-GOSISDBHSA-N 2 1 378.586 3.087 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H](c3cncc(F)c3)C3CC3)c2)C1 ZINC000281172527 1435789301 /nfs/dbraw/zinc/78/93/01/1435789301.db2.gz HYZKTSQETQFGID-DENIHFKCSA-N 2 1 396.510 3.159 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H]2CCC[N@@H+]2C2CCCCC2)cn1 ZINC000281390381 1435806878 /nfs/dbraw/zinc/80/68/78/1435806878.db2.gz GRQWIJORAAHZSQ-FQEVSTJZSA-N 2 1 396.539 3.172 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)cn1 ZINC000281390381 1435806879 /nfs/dbraw/zinc/80/68/79/1435806879.db2.gz GRQWIJORAAHZSQ-FQEVSTJZSA-N 2 1 396.539 3.172 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC000281733263 1435819826 /nfs/dbraw/zinc/81/98/26/1435819826.db2.gz KABCURLNUSRPMA-HXUWFJFHSA-N 2 1 396.539 3.172 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000281733263 1435819827 /nfs/dbraw/zinc/81/98/27/1435819827.db2.gz KABCURLNUSRPMA-HXUWFJFHSA-N 2 1 396.539 3.172 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC000281733240 1435819891 /nfs/dbraw/zinc/81/98/91/1435819891.db2.gz KABCURLNUSRPMA-FQEVSTJZSA-N 2 1 396.539 3.172 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000281733240 1435819892 /nfs/dbraw/zinc/81/98/92/1435819892.db2.gz KABCURLNUSRPMA-FQEVSTJZSA-N 2 1 396.539 3.172 20 0 GGADMP Cc1cc([C@@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)nn1C ZINC000282436996 1435847202 /nfs/dbraw/zinc/84/72/02/1435847202.db2.gz ZFRFUDHAODYHDU-GOSISDBHSA-N 2 1 386.540 3.069 20 0 GGADMP Cc1cc([C@@H](C)[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)nn1C ZINC000282436996 1435847203 /nfs/dbraw/zinc/84/72/03/1435847203.db2.gz ZFRFUDHAODYHDU-GOSISDBHSA-N 2 1 386.540 3.069 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825293 1435861771 /nfs/dbraw/zinc/86/17/71/1435861771.db2.gz JGVMXJCKXNWRSU-RTWAWAEBSA-N 2 1 386.584 3.270 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825293 1435861772 /nfs/dbraw/zinc/86/17/72/1435861772.db2.gz JGVMXJCKXNWRSU-RTWAWAEBSA-N 2 1 386.584 3.270 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825293 1435861773 /nfs/dbraw/zinc/86/17/73/1435861773.db2.gz JGVMXJCKXNWRSU-RTWAWAEBSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 ZINC000283320084 1435884251 /nfs/dbraw/zinc/88/42/51/1435884251.db2.gz OQRBHNNLEYGGCX-YADHBBJMSA-N 2 1 377.548 3.394 20 0 GGADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(N3CCOCC3)nc2)CC1 ZINC000284045020 1435979842 /nfs/dbraw/zinc/97/98/42/1435979842.db2.gz JZPDGKYJNLXTOJ-UHFFFAOYSA-N 2 1 394.563 3.451 20 0 GGADMP c1ccc(C[N@H+]2CCCO[C@H](CN3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)C2)cc1 ZINC000284104647 1435990596 /nfs/dbraw/zinc/99/05/96/1435990596.db2.gz MSIQCXNVTXSKLY-YFNKSVMNSA-N 2 1 383.580 3.226 20 0 GGADMP c1csc(CC[NH+]2CCN(C[C@H]3C[N@@H+](Cc4ccccc4)CCCO3)CC2)c1 ZINC000284139330 1435997374 /nfs/dbraw/zinc/99/73/74/1435997374.db2.gz OSUWOSBBWMRSAG-QFIPXVFZSA-N 2 1 399.604 3.199 20 0 GGADMP CN(C)C(=O)[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000284421071 1436020615 /nfs/dbraw/zinc/02/06/15/1436020615.db2.gz OEXGDCYZVZDTAP-QFIPXVFZSA-N 2 1 381.520 3.079 20 0 GGADMP Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)C1CCOCC1 ZINC000284751944 1436046529 /nfs/dbraw/zinc/04/65/29/1436046529.db2.gz FZKUQKVDMDQSRM-SSGKUCQKSA-N 2 1 394.563 3.388 20 0 GGADMP Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)C1CCOCC1 ZINC000284751944 1436046533 /nfs/dbraw/zinc/04/65/33/1436046533.db2.gz FZKUQKVDMDQSRM-SSGKUCQKSA-N 2 1 394.563 3.388 20 0 GGADMP Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C1CCOCC1 ZINC000284751943 1436046586 /nfs/dbraw/zinc/04/65/86/1436046586.db2.gz FZKUQKVDMDQSRM-MYDTUXCISA-N 2 1 394.563 3.388 20 0 GGADMP Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C1CCOCC1 ZINC000284751943 1436046590 /nfs/dbraw/zinc/04/65/90/1436046590.db2.gz FZKUQKVDMDQSRM-MYDTUXCISA-N 2 1 394.563 3.388 20 0 GGADMP C[NH+]1CCC(Oc2ccnc(N3CCC4(CC[NH2+]CC4)[C@H]3C(F)(F)F)c2)CC1 ZINC001164388265 718815931 /nfs/dbraw/zinc/81/59/31/718815931.db2.gz OCXJZXWXVZLEJA-SFHVURJKSA-N 2 1 398.473 3.065 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@H]4[NH2+]CC[C@@H]42)n1)CCC3)[NH+]1CCCCC1 ZINC001164411095 718875606 /nfs/dbraw/zinc/87/56/06/718875606.db2.gz MKBWJHNODLPHBN-CVEARBPZSA-N 2 1 383.565 3.107 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CC[C@H]5[NH2+]CC[C@H]54)c23)C1 ZINC001164412791 718876044 /nfs/dbraw/zinc/87/60/44/718876044.db2.gz ZFGJHHATWNICON-DJIMGWMZSA-N 2 1 397.592 3.353 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CC[C@H]3[NH2+]CC[C@@H]32)n1 ZINC001164411751 718877000 /nfs/dbraw/zinc/87/70/00/718877000.db2.gz RZISNGYJPGJGDZ-SJORKVTESA-N 2 1 379.533 3.361 20 0 GGADMP c1ccc(C[N@@H+]2CCc3c(ncnc3N3CCCC[C@@H]3C3CC[NH2+]CC3)C2)cc1 ZINC001164418472 718891928 /nfs/dbraw/zinc/89/19/28/718891928.db2.gz OBFKBLLZBBQYQR-HSZRJFAPSA-N 2 1 391.563 3.393 20 0 GGADMP c1ccc(C[N@H+]2CCc3c(ncnc3N3CCCC[C@@H]3C3CC[NH2+]CC3)C2)cc1 ZINC001164418472 718891930 /nfs/dbraw/zinc/89/19/30/718891930.db2.gz OBFKBLLZBBQYQR-HSZRJFAPSA-N 2 1 391.563 3.393 20 0 GGADMP c1ccc(C[N@@H+]2CCc3c(ncnc3N3CCCCC34CC[NH2+]CC4)C2)cc1 ZINC001164419460 718910273 /nfs/dbraw/zinc/91/02/73/718910273.db2.gz AQYXHISDYMGSQN-UHFFFAOYSA-N 2 1 377.536 3.147 20 0 GGADMP c1ccc(C[N@H+]2CCc3c(ncnc3N3CCCCC34CC[NH2+]CC4)C2)cc1 ZINC001164419460 718910279 /nfs/dbraw/zinc/91/02/79/718910279.db2.gz AQYXHISDYMGSQN-UHFFFAOYSA-N 2 1 377.536 3.147 20 0 GGADMP c1ccc(C[N@@H+]2CCc3c(ncnc3N3C[C@H]4c5ccccc5C[NH2+][C@@H]4C3)C2)cc1 ZINC001164425177 718941780 /nfs/dbraw/zinc/94/17/80/718941780.db2.gz SRKLKARVFQRBLE-LADGPHEKSA-N 2 1 397.526 3.111 20 0 GGADMP c1ccc(C[N@H+]2CCc3c(ncnc3N3C[C@H]4c5ccccc5C[NH2+][C@@H]4C3)C2)cc1 ZINC001164425177 718941791 /nfs/dbraw/zinc/94/17/91/718941791.db2.gz SRKLKARVFQRBLE-LADGPHEKSA-N 2 1 397.526 3.111 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@@H]4[NH2+]C[C@H]42)n1)CCCC3)[NH+]1CCCCC1 ZINC001164450313 719000159 /nfs/dbraw/zinc/00/01/59/719000159.db2.gz UPOZJMJHLJBVCK-DLBZAZTESA-N 2 1 397.592 3.497 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@@H]4[NH2+]C[C@@H]42)n1)CCCC3)[NH+]1CCCCC1 ZINC001164450315 719000520 /nfs/dbraw/zinc/00/05/20/719000520.db2.gz UPOZJMJHLJBVCK-IRXDYDNUSA-N 2 1 397.592 3.497 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@H]4[NH2+]C[C@@H]42)n1)CCCC3)[NH+]1CCCC1 ZINC001164447139 719000673 /nfs/dbraw/zinc/00/06/73/719000673.db2.gz AWWIGJJSUCBVLK-CVEARBPZSA-N 2 1 383.565 3.107 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CCC[C@H]5[NH2+]C[C@@H]54)c32)C1 ZINC001164447953 719000688 /nfs/dbraw/zinc/00/06/88/719000688.db2.gz DHTZPADZNORVAE-OIISXLGYSA-N 2 1 397.592 3.353 20 0 GGADMP [NH3+]C1CCN(c2cccc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)n2)CC1 ZINC001164626710 719092063 /nfs/dbraw/zinc/09/20/63/719092063.db2.gz IOKXGACRBQYETL-IFMALSPDSA-N 2 1 391.563 3.110 20 0 GGADMP [NH3+]C1([C@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]2CF)CC1 ZINC001164627448 719117000 /nfs/dbraw/zinc/11/70/00/719117000.db2.gz KMDOKBICULVFII-PMACEKPBSA-N 2 1 380.511 3.153 20 0 GGADMP CSc1nc2sccc2c(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164684091 719608267 /nfs/dbraw/zinc/60/82/67/719608267.db2.gz MDOGRVGRQSLFCU-UHFFFAOYSA-N 2 1 388.566 3.085 20 0 GGADMP CSc1nc2sccc2c(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164684091 719608272 /nfs/dbraw/zinc/60/82/72/719608272.db2.gz MDOGRVGRQSLFCU-UHFFFAOYSA-N 2 1 388.566 3.085 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)Oc2ccc(Cl)nc2)c2c1CC[NH2+]C2 ZINC001164683353 719615365 /nfs/dbraw/zinc/61/53/65/719615365.db2.gz IHAHQSMXPBTQNE-UHFFFAOYSA-N 2 1 385.846 3.003 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)Oc2ccc(Cl)nc2)c2c1CC[NH2+]C2 ZINC001164683353 719615372 /nfs/dbraw/zinc/61/53/72/719615372.db2.gz IHAHQSMXPBTQNE-UHFFFAOYSA-N 2 1 385.846 3.003 20 0 GGADMP CSc1nc2ccsc2c(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164681586 719618371 /nfs/dbraw/zinc/61/83/71/719618371.db2.gz INGSXWVPAQCFEO-UHFFFAOYSA-N 2 1 388.566 3.085 20 0 GGADMP CSc1nc2ccsc2c(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164681586 719618375 /nfs/dbraw/zinc/61/83/75/719618375.db2.gz INGSXWVPAQCFEO-UHFFFAOYSA-N 2 1 388.566 3.085 20 0 GGADMP COc1ccc2nc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)cc(C)c2c1 ZINC001164681301 719622491 /nfs/dbraw/zinc/62/24/91/719622491.db2.gz GKMCQSJYXUBAEI-UHFFFAOYSA-N 2 1 379.508 3.223 20 0 GGADMP COc1ccc2nc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)cc(C)c2c1 ZINC001164681301 719622503 /nfs/dbraw/zinc/62/25/03/719622503.db2.gz GKMCQSJYXUBAEI-UHFFFAOYSA-N 2 1 379.508 3.223 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2cc(F)cc3ncnc(Cl)c32)c2c1CC[NH2+]C2 ZINC001164679519 719634955 /nfs/dbraw/zinc/63/49/55/719634955.db2.gz DZJVKVWOWYCUSS-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2cc(F)cc3ncnc(Cl)c32)c2c1CC[NH2+]C2 ZINC001164679519 719634961 /nfs/dbraw/zinc/63/49/61/719634961.db2.gz DZJVKVWOWYCUSS-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP Cc1cccc(-c2ccc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)nn2)c1 ZINC001164680216 719640457 /nfs/dbraw/zinc/64/04/57/719640457.db2.gz SFHFKJSMNUPQHP-UHFFFAOYSA-N 2 1 376.508 3.124 20 0 GGADMP Cc1cccc(-c2ccc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)nn2)c1 ZINC001164680216 719640463 /nfs/dbraw/zinc/64/04/63/719640463.db2.gz SFHFKJSMNUPQHP-UHFFFAOYSA-N 2 1 376.508 3.124 20 0 GGADMP Cc1cc(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)nc(-c2ccsc2)n1 ZINC001164679646 719643042 /nfs/dbraw/zinc/64/30/42/719643042.db2.gz JYGDCVMJIZEPIX-UHFFFAOYSA-N 2 1 382.537 3.185 20 0 GGADMP Cc1cc(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)nc(-c2ccsc2)n1 ZINC001164679646 719643053 /nfs/dbraw/zinc/64/30/53/719643053.db2.gz JYGDCVMJIZEPIX-UHFFFAOYSA-N 2 1 382.537 3.185 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2cc3nc(Cl)cnc3cc2F)c2c1CC[NH2+]C2 ZINC001164680169 719643949 /nfs/dbraw/zinc/64/39/49/719643949.db2.gz QXSDNSOSBJVTPV-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2cc3nc(Cl)cnc3cc2F)c2c1CC[NH2+]C2 ZINC001164680169 719643958 /nfs/dbraw/zinc/64/39/58/719643958.db2.gz QXSDNSOSBJVTPV-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nnc(Cl)c3ccc(F)cc32)c2c1CC[NH2+]C2 ZINC001164679563 719647362 /nfs/dbraw/zinc/64/73/62/719647362.db2.gz GWTSKANXDYYPQW-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nnc(Cl)c3ccc(F)cc32)c2c1CC[NH2+]C2 ZINC001164679563 719647368 /nfs/dbraw/zinc/64/73/68/719647368.db2.gz GWTSKANXDYYPQW-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-n2nc(CN(C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679763 719648818 /nfs/dbraw/zinc/64/88/18/719648818.db2.gz MKWSAQBVXOIXMO-OAQYLSRUSA-N 2 1 396.583 3.300 20 0 GGADMP CC[N@@H+]1CCCC[C@@H]1c1ccc(-n2nc(C[NH+](C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679763 719648824 /nfs/dbraw/zinc/64/88/24/719648824.db2.gz MKWSAQBVXOIXMO-OAQYLSRUSA-N 3 1 396.583 3.300 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-n2nc(C[NH+](C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679763 719648835 /nfs/dbraw/zinc/64/88/35/719648835.db2.gz MKWSAQBVXOIXMO-OAQYLSRUSA-N 3 1 396.583 3.300 20 0 GGADMP CC[NH+]1CCCC[C@@H]1c1ccc(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679763 719648840 /nfs/dbraw/zinc/64/88/40/719648840.db2.gz MKWSAQBVXOIXMO-OAQYLSRUSA-N 3 1 396.583 3.300 20 0 GGADMP CC[NH+]1CCCC[C@@H]1c1ccc(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1 ZINC001164679763 719648855 /nfs/dbraw/zinc/64/88/55/719648855.db2.gz MKWSAQBVXOIXMO-OAQYLSRUSA-N 3 1 396.583 3.300 20 0 GGADMP COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc3[nH]ccc3c[nH+]1)CC2 ZINC001164710621 720098835 /nfs/dbraw/zinc/09/88/35/720098835.db2.gz KEBJXKBSSDKFBV-HXUWFJFHSA-N 2 1 391.519 3.465 20 0 GGADMP CCOc1cc[nH+]c(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)c1 ZINC001164715567 720116074 /nfs/dbraw/zinc/11/60/74/720116074.db2.gz IAQILOUSFKOKRS-FQEVSTJZSA-N 2 1 396.535 3.383 20 0 GGADMP COC[C@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1cc3cc(OC)ccc3c[nH+]1)C2 ZINC001164810554 720147754 /nfs/dbraw/zinc/14/77/54/720147754.db2.gz KBVRVWAVVKPXCU-OFNKIYASSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc3cc(OC)ccc3c[nH+]1)C2 ZINC001164810554 720147759 /nfs/dbraw/zinc/14/77/59/720147759.db2.gz KBVRVWAVVKPXCU-OFNKIYASSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1cc3cc(OC)ccc3c[nH+]1)C2 ZINC001164810557 720147889 /nfs/dbraw/zinc/14/78/89/720147889.db2.gz KBVRVWAVVKPXCU-REWPJTCUSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc3cc(OC)ccc3c[nH+]1)C2 ZINC001164810557 720147892 /nfs/dbraw/zinc/14/78/92/720147892.db2.gz KBVRVWAVVKPXCU-REWPJTCUSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1[nH+]cnc3c1ccn3C(C)C)C2 ZINC001164816014 720154726 /nfs/dbraw/zinc/15/47/26/720154726.db2.gz JSVHEIALGOWDMY-PGRDOPGGSA-N 2 1 383.540 3.197 20 0 GGADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1[nH+]cnc3c1ccn3C(C)C)C2 ZINC001164816014 720154731 /nfs/dbraw/zinc/15/47/31/720154731.db2.gz JSVHEIALGOWDMY-PGRDOPGGSA-N 2 1 383.540 3.197 20 0 GGADMP CC(C)Oc1cc[nH+]c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164834287 720556351 /nfs/dbraw/zinc/55/63/51/720556351.db2.gz DGZCJYOUKGRDOO-QKNQBKEWSA-N 2 1 383.540 3.443 20 0 GGADMP Cc1[nH+]c(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)cc2[nH]ccc21 ZINC001164841280 720588713 /nfs/dbraw/zinc/58/87/13/720588713.db2.gz RUKQFHGEMVMUAD-DBXWQHBBSA-N 2 1 378.524 3.446 20 0 GGADMP CN(C)c1cccc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)[nH+]1 ZINC001164842761 720665785 /nfs/dbraw/zinc/66/57/85/720665785.db2.gz UBKWJGZKKPTAFG-FQEVSTJZSA-N 2 1 380.536 3.408 20 0 GGADMP C[NH+](C)Cc1ccnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164840954 720720954 /nfs/dbraw/zinc/72/09/54/720720954.db2.gz SXSFIBYPYRJMJY-JOCHJYFZSA-N 2 1 394.563 3.403 20 0 GGADMP CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ccc(C[NH+](C)C3CC3)cn1)[C@H]2C ZINC001164863792 721009026 /nfs/dbraw/zinc/00/90/26/721009026.db2.gz VCROFBVEMDPGHR-KRWDZBQOSA-N 2 1 382.556 3.294 20 0 GGADMP CC(C)[NH+](C)Cc1cnc2n1CCN(c1ccc(C[N@H+](C)C3CC3)cn1)[C@H]2C ZINC001164863792 721009036 /nfs/dbraw/zinc/00/90/36/721009036.db2.gz VCROFBVEMDPGHR-KRWDZBQOSA-N 2 1 382.556 3.294 20 0 GGADMP CC(C)[NH+](C)Cc1cnc2n1CCN(c1ccc(C[N@@H+](C)C3CC3)cn1)[C@H]2C ZINC001164863792 721009046 /nfs/dbraw/zinc/00/90/46/721009046.db2.gz VCROFBVEMDPGHR-KRWDZBQOSA-N 2 1 382.556 3.294 20 0 GGADMP Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(C)c(C)c[nH+]3)C2)C1 ZINC001164783080 721368414 /nfs/dbraw/zinc/36/84/14/721368414.db2.gz PECYRJKEFNAFCO-QFIPXVFZSA-N 2 1 384.524 3.422 20 0 GGADMP COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(C)c(C)[nH+]1)CC2 ZINC001164784172 721457910 /nfs/dbraw/zinc/45/79/10/721457910.db2.gz HBHQVXQKZBFWLH-OAQYLSRUSA-N 2 1 387.568 3.432 20 0 GGADMP CCN(C)c1cc[nH+]c(N2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164792784 721489183 /nfs/dbraw/zinc/48/91/83/721489183.db2.gz LVBRRYWPCFPVDR-UHFFFAOYSA-N 2 1 380.540 3.209 20 0 GGADMP CCN(C)c1cc[nH+]c(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164792784 721489186 /nfs/dbraw/zinc/48/91/86/721489186.db2.gz LVBRRYWPCFPVDR-UHFFFAOYSA-N 2 1 380.540 3.209 20 0 GGADMP Fc1cccc(O[C@H]2C[C@@H]3CN(c4cc(N5CCCC5)cc[nH+]4)CC[N@H+]3C2)c1 ZINC001164906769 721544478 /nfs/dbraw/zinc/54/44/78/721544478.db2.gz LHOVFLXVXYIMRQ-CTNGQTDRSA-N 2 1 382.483 3.163 20 0 GGADMP Fc1cccc(O[C@@H]2C[C@H]3CN(c4ccc(C[NH+]5CCCC5)cn4)CC[N@H+]3C2)c1 ZINC001164904832 721552414 /nfs/dbraw/zinc/55/24/14/721552414.db2.gz FZJKEXCNBJTOMI-RBBKRZOGSA-N 2 1 396.510 3.158 20 0 GGADMP C[N@@H+](Cc1ccc(N2CC[NH+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1)C1CC1 ZINC001164908718 721557873 /nfs/dbraw/zinc/55/78/73/721557873.db2.gz RTIWCLSPQQSVHJ-RBBKRZOGSA-N 2 1 396.510 3.157 20 0 GGADMP C[NH+](Cc1ccc(N2CC[N@@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1)C1CC1 ZINC001164908718 721557875 /nfs/dbraw/zinc/55/78/75/721557875.db2.gz RTIWCLSPQQSVHJ-RBBKRZOGSA-N 2 1 396.510 3.157 20 0 GGADMP C[NH+](Cc1ccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1)C1CC1 ZINC001164908718 721557878 /nfs/dbraw/zinc/55/78/78/721557878.db2.gz RTIWCLSPQQSVHJ-RBBKRZOGSA-N 2 1 396.510 3.157 20 0 GGADMP Fc1cccc(O[C@H]2C[C@H]3CN(c4ncccc4C[NH+]4CCCC4)CC[N@H+]3C2)c1 ZINC001164906427 721565044 /nfs/dbraw/zinc/56/50/44/721565044.db2.gz IZZBNKQOBLGPQE-UNMCSNQZSA-N 2 1 396.510 3.158 20 0 GGADMP C[N@@H+](Cc1ccc(-n2nc(-c3ccc(F)cc3)c3c2CC[NH2+]CC3)nc1)C1CC1 ZINC001164796092 721597319 /nfs/dbraw/zinc/59/73/19/721597319.db2.gz BRACNMDKWVXZSY-UHFFFAOYSA-N 2 1 391.494 3.356 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2CCC(F)(F)[C@@]3(CC[N@H+](Cc4ccccn4)C3)C2)[nH]1 ZINC001164907984 721697066 /nfs/dbraw/zinc/69/70/66/721697066.db2.gz XSIIEHSIMZVHQK-HXUWFJFHSA-N 2 1 398.461 3.399 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)[nH]1 ZINC001164907984 721697071 /nfs/dbraw/zinc/69/70/71/721697071.db2.gz XSIIEHSIMZVHQK-HXUWFJFHSA-N 2 1 398.461 3.399 20 0 GGADMP CCN(C)c1cc[nH+]c(N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165021471 721798113 /nfs/dbraw/zinc/79/81/13/721798113.db2.gz HBXVRBKCYHPHNV-SXLOBPIMSA-N 2 1 380.540 3.065 20 0 GGADMP CCN(C)c1cc[nH+]c(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165021471 721798115 /nfs/dbraw/zinc/79/81/15/721798115.db2.gz HBXVRBKCYHPHNV-SXLOBPIMSA-N 2 1 380.540 3.065 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)[nH]1 ZINC001165027506 721807577 /nfs/dbraw/zinc/80/75/77/721807577.db2.gz VYYYYEUEMWJPSD-PWIZWCRZSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)[nH]1 ZINC001165027506 721807578 /nfs/dbraw/zinc/80/75/78/721807578.db2.gz VYYYYEUEMWJPSD-PWIZWCRZSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)[nH]1 ZINC001165027504 721807826 /nfs/dbraw/zinc/80/78/26/721807826.db2.gz VYYYYEUEMWJPSD-FFZOFVMBSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1cc2c(nc[nH+]c2N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)[nH]1 ZINC001165027504 721807828 /nfs/dbraw/zinc/80/78/28/721807828.db2.gz VYYYYEUEMWJPSD-FFZOFVMBSA-N 2 1 376.508 3.398 20 0 GGADMP CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001164925209 721867643 /nfs/dbraw/zinc/86/76/43/721867643.db2.gz MXGXBVOWZMLJID-XZOQPEGZSA-N 2 1 389.547 3.299 20 0 GGADMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001164925209 721867645 /nfs/dbraw/zinc/86/76/45/721867645.db2.gz MXGXBVOWZMLJID-XZOQPEGZSA-N 2 1 389.547 3.299 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CC[NH+]3CCN(C)C)nc1 ZINC001164930929 721887345 /nfs/dbraw/zinc/88/73/45/721887345.db2.gz DKFFTFBTBAZMQZ-YPAWHYETSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)nc1 ZINC001164930929 721887346 /nfs/dbraw/zinc/88/73/46/721887346.db2.gz DKFFTFBTBAZMQZ-YPAWHYETSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CC[N@H+]3CCN(C)C)nc1 ZINC001164930929 721887348 /nfs/dbraw/zinc/88/73/48/721887348.db2.gz DKFFTFBTBAZMQZ-YPAWHYETSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CCN3CC[NH+](C)C)nc1 ZINC001164930929 721887349 /nfs/dbraw/zinc/88/73/49/721887349.db2.gz DKFFTFBTBAZMQZ-YPAWHYETSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CCN3CC[NH+](C)C)nc1 ZINC001164930929 721887350 /nfs/dbraw/zinc/88/73/50/721887350.db2.gz DKFFTFBTBAZMQZ-YPAWHYETSA-N 2 1 385.600 3.233 20 0 GGADMP Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(C[NH+](C)C)ccn4)CC3)C2)cc1 ZINC001164939674 721932738 /nfs/dbraw/zinc/93/27/38/721932738.db2.gz OAQPIIKJQQEYOC-UHFFFAOYSA-N 2 1 394.563 3.323 20 0 GGADMP Cc1cc(N2CCCC2)nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)[nH+]1 ZINC001164953777 722011997 /nfs/dbraw/zinc/01/19/97/722011997.db2.gz GPTSAKYNJWAGNM-UHFFFAOYSA-N 2 1 392.551 3.273 20 0 GGADMP CC[N@H+]1CCCC[C@H]1c1ccc(N2CC[NH+](CCc3ccccn3)CC2)nc1 ZINC001165054891 722019659 /nfs/dbraw/zinc/01/96/59/722019659.db2.gz IJYYYQDAWSVBSC-QFIPXVFZSA-N 2 1 379.552 3.388 20 0 GGADMP c1ccc2c(c1)cc(N1CCCC1)[nH+]c2N1C[C@@H]2C[N@@H+](CC3CC3)C[C@H](C1)O2 ZINC001164966550 722076068 /nfs/dbraw/zinc/07/60/68/722076068.db2.gz AORZKHDOJPPPOV-BGYRXZFFSA-N 2 1 378.520 3.134 20 0 GGADMP Fc1cccc(C[N@H+]2CC[C@]23CCCN(c2nccc(C4CC[NH2+]CC4)n2)C3)c1 ZINC001164993765 722205232 /nfs/dbraw/zinc/20/52/32/722205232.db2.gz ASQOSEOMFTZEAI-QHCPKHFHSA-N 2 1 395.526 3.328 20 0 GGADMP Fc1cccc(C[N@@H+]2CC[C@@]23CCCN(c2cccc(N4CCOCC4)[nH+]2)C3)c1 ZINC001164995668 722205407 /nfs/dbraw/zinc/20/54/07/722205407.db2.gz PAKNTTFOGXNWFI-HSZRJFAPSA-N 2 1 396.510 3.302 20 0 GGADMP Fc1cccc(C[N@H+]2CC[C@@]23CCCN(c2cccc(N4CCOCC4)[nH+]2)C3)c1 ZINC001164995668 722205410 /nfs/dbraw/zinc/20/54/10/722205410.db2.gz PAKNTTFOGXNWFI-HSZRJFAPSA-N 2 1 396.510 3.302 20 0 GGADMP Cc1cccc2cc[nH+]c(N3CCCn4cnc(COCC[NH+](C)C)c4C3)c12 ZINC001165004038 722257288 /nfs/dbraw/zinc/25/72/88/722257288.db2.gz LXWAEGAWCXCRSK-UHFFFAOYSA-N 2 1 379.508 3.228 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cccc(-c2nn[nH]n2)c1 ZINC000821615666 945745992 /nfs/dbraw/zinc/74/59/92/945745992.db2.gz IFHLVCIUYILUEM-UHFFFAOYSA-N 2 1 388.475 3.382 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(-c2nn[nH]n2)c1 ZINC000824579145 946829583 /nfs/dbraw/zinc/82/95/83/946829583.db2.gz XVRRPMSDPJXORV-IEBWSBKVSA-N 2 1 376.508 3.082 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2)cc1F ZINC000826331002 947961986 /nfs/dbraw/zinc/96/19/86/947961986.db2.gz PHRJPTOHDBIGJI-CYBMUJFWSA-N 2 1 377.427 3.351 20 0 GGADMP c1ccc(C2(C[NH2+]C3CC[NH+](Cc4ccc(-c5nn[nH]n5)cc4)CC3)CC2)cc1 ZINC000826520931 948450964 /nfs/dbraw/zinc/45/09/64/948450964.db2.gz VNLYLIACGKMJCN-UHFFFAOYSA-N 2 1 388.519 3.153 20 0 GGADMP c1ccc(CCCC[NH2+]C2CC[NH+](Cc3ccc(-c4nn[nH]n4)cc3)CC2)cc1 ZINC000826521324 948453052 /nfs/dbraw/zinc/45/30/52/948453052.db2.gz IGUPYGKJYIIBIK-UHFFFAOYSA-N 2 1 390.535 3.444 20 0 GGADMP C[C@H](c1cccc(-c2nn[nH]n2)c1)[N@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001575508989 949106520 /nfs/dbraw/zinc/10/65/20/949106520.db2.gz AVHTWQKXHRVCSD-YHYVQYDKSA-N 2 1 388.519 3.382 20 0 GGADMP C[C@H](c1cccc(-c2nn[nH]n2)c1)[NH+]1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001575508989 949106532 /nfs/dbraw/zinc/10/65/32/949106532.db2.gz AVHTWQKXHRVCSD-YHYVQYDKSA-N 2 1 388.519 3.382 20 0 GGADMP C[C@H](c1cccc(-c2nn[nH]n2)c1)[NH+]1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001575508989 949106542 /nfs/dbraw/zinc/10/65/42/949106542.db2.gz AVHTWQKXHRVCSD-YHYVQYDKSA-N 2 1 388.519 3.382 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCOc2ccccc2-c2nn[nH]n2)CC1 ZINC001576163961 949546124 /nfs/dbraw/zinc/54/61/24/949546124.db2.gz DPBRWZRWQYPMKL-SFHVURJKSA-N 2 1 398.555 3.222 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000118868537 564246995 /nfs/dbraw/zinc/24/69/95/564246995.db2.gz AGBCGVCPGUKFRK-UHFFFAOYSA-N 2 1 382.346 3.360 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000119425944 564270273 /nfs/dbraw/zinc/27/02/73/564270273.db2.gz FVZNLLPLOJHXDD-UONOGXRCSA-N 2 1 380.330 3.240 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2cccc(Br)c2)C2CC2)CC1 ZINC000027230175 564352726 /nfs/dbraw/zinc/35/27/26/564352726.db2.gz VRYSFYRFUWDSKE-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](Cc2cccc(Br)c2)C2CC2)CC1 ZINC000027230175 564352731 /nfs/dbraw/zinc/35/27/31/564352731.db2.gz VRYSFYRFUWDSKE-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP C[C@H](Cn1cc(Br)cn1)[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000122786448 564427696 /nfs/dbraw/zinc/42/76/96/564427696.db2.gz LVLBZDAOBRCHSS-OAHLLOKOSA-N 2 1 377.330 3.072 20 0 GGADMP C[C@H](Cn1cc(Br)cn1)[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000122786448 564427698 /nfs/dbraw/zinc/42/76/98/564427698.db2.gz LVLBZDAOBRCHSS-OAHLLOKOSA-N 2 1 377.330 3.072 20 0 GGADMP CSCC[C@@H](C)[N@@H+](C)CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000126366053 564546403 /nfs/dbraw/zinc/54/64/03/564546403.db2.gz NOYSJPOHWQYOAK-MRXNPFEDSA-N 2 1 381.611 3.247 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](CCC[NH2+][C@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000128122772 564607247 /nfs/dbraw/zinc/60/72/47/564607247.db2.gz KCTLDZCRPYJNPM-YOEHRIQHSA-N 2 1 381.973 3.444 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+][C@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000128122772 564607251 /nfs/dbraw/zinc/60/72/51/564607251.db2.gz KCTLDZCRPYJNPM-YOEHRIQHSA-N 2 1 381.973 3.444 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCCN2CCC[N@@H+](C)CC2)cc1Br ZINC000128236295 564611472 /nfs/dbraw/zinc/61/14/72/564611472.db2.gz GOXNRJVYUVXSAR-OAHLLOKOSA-N 2 1 384.362 3.136 20 0 GGADMP Cc1nccn1CCC[N@H+](C)CC(=O)Nc1ccc(Br)c(C)c1 ZINC000130458294 564682041 /nfs/dbraw/zinc/68/20/41/564682041.db2.gz SPCVPNDDCYGLMY-UHFFFAOYSA-N 2 1 379.302 3.223 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)Nc1ccc(Br)c(C)c1 ZINC000130458294 564682048 /nfs/dbraw/zinc/68/20/48/564682048.db2.gz SPCVPNDDCYGLMY-UHFFFAOYSA-N 2 1 379.302 3.223 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1Br ZINC000130481744 564682991 /nfs/dbraw/zinc/68/29/91/564682991.db2.gz JDADGONXJZWGOG-ZDUSSCGKSA-N 2 1 379.302 3.303 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)C(=O)Nc1ccccc1Br ZINC000130481744 564682993 /nfs/dbraw/zinc/68/29/93/564682993.db2.gz JDADGONXJZWGOG-ZDUSSCGKSA-N 2 1 379.302 3.303 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1Br ZINC000130481985 564683146 /nfs/dbraw/zinc/68/31/46/564683146.db2.gz JDADGONXJZWGOG-CYBMUJFWSA-N 2 1 379.302 3.303 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)C(=O)Nc1ccccc1Br ZINC000130481985 564683148 /nfs/dbraw/zinc/68/31/48/564683148.db2.gz JDADGONXJZWGOG-CYBMUJFWSA-N 2 1 379.302 3.303 20 0 GGADMP C[C@@H](Cn1cc(Br)cn1)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000132338413 564740733 /nfs/dbraw/zinc/74/07/33/564740733.db2.gz NGQQDOGQUHXPBO-HNNXBMFYSA-N 2 1 377.330 3.288 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[NH+](C)C ZINC000133720660 564783159 /nfs/dbraw/zinc/78/31/59/564783159.db2.gz UIXKFQCPKXKXEO-SFHVURJKSA-N 2 1 396.373 3.116 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1c(Br)ccc2F ZINC000134392471 564802308 /nfs/dbraw/zinc/80/23/08/564802308.db2.gz HQGANOXLTQRRKS-CXAGYDPISA-N 2 1 385.321 3.402 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](C[C@@H](C)c3cccc(Br)c3)C2)CC1 ZINC000093133307 564884146 /nfs/dbraw/zinc/88/41/46/564884146.db2.gz RSQYZQCFIDXMBV-APWZRJJASA-N 2 1 380.374 3.264 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCc2nc(C(F)(F)F)cs2)[C@H](C)C1 ZINC000152207219 564951099 /nfs/dbraw/zinc/95/10/99/564951099.db2.gz LOQBXOBMEMJLMA-KGLIPLIRSA-N 2 1 379.492 3.431 20 0 GGADMP CN(CC(=O)Nc1ccc(OC(F)F)c(Cl)c1)C[C@H]1CCC[N@@H+](C)C1 ZINC000152378144 564957089 /nfs/dbraw/zinc/95/70/89/564957089.db2.gz KGUVHXURVHMZTF-LBPRGKRZSA-N 2 1 375.847 3.154 20 0 GGADMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cn3cc(Cl)cc(Cl)c3n2)CC1 ZINC000106124483 564977886 /nfs/dbraw/zinc/97/78/86/564977886.db2.gz USKWCOAYBSQUFN-ZDUSSCGKSA-N 2 1 385.339 3.166 20 0 GGADMP CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)C1CC1 ZINC000153840499 565013453 /nfs/dbraw/zinc/01/34/53/565013453.db2.gz KJMTVMPEXYQVNL-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP CC[N@@H+](CC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)C1CC1 ZINC000153840499 565013454 /nfs/dbraw/zinc/01/34/54/565013454.db2.gz KJMTVMPEXYQVNL-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Br)cc2)CCOCC1 ZINC000155255474 565065138 /nfs/dbraw/zinc/06/51/38/565065138.db2.gz MGOPTMUJPIBWHX-QAPCUYQASA-N 2 1 381.358 3.427 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3cncc(Br)c3)CC2)oc1C ZINC000183707105 565089735 /nfs/dbraw/zinc/08/97/35/565089735.db2.gz NRFNOURWFKDVSU-UHFFFAOYSA-N 2 1 393.329 3.451 20 0 GGADMP Brc1ccc2c(c1)[nH+]ccc2N1CC[NH+](C2CCOCC2)CC1 ZINC000267005730 565101716 /nfs/dbraw/zinc/10/17/16/565101716.db2.gz FEZYFVMJTAUGQF-UHFFFAOYSA-N 2 1 376.298 3.298 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)CC(=O)Nc1cccc(Br)c1 ZINC000268910059 565172160 /nfs/dbraw/zinc/17/21/60/565172160.db2.gz YPGIOCSEZUZXSW-CYBMUJFWSA-N 2 1 379.302 3.351 20 0 GGADMP CC[NH+]1CCC([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC1 ZINC000268997911 565174365 /nfs/dbraw/zinc/17/43/65/565174365.db2.gz IOMPUOBWGOUFIO-UHFFFAOYSA-N 2 1 380.374 3.487 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(Cc3nc(-c4cc(Br)cs4)no3)CC[C@@H]21 ZINC000158909233 565185517 /nfs/dbraw/zinc/18/55/17/565185517.db2.gz HAVXCJFZMZGFCP-AAEUAGOBSA-N 2 1 397.342 3.477 20 0 GGADMP CC[NH+](CCOCC[N@H+](CC)CCc1nccs1)CCc1nccs1 ZINC000269967828 565204738 /nfs/dbraw/zinc/20/47/38/565204738.db2.gz VBVLSIVOOBVXNC-UHFFFAOYSA-N 2 1 382.599 3.045 20 0 GGADMP CN1CC[NH+](CC2CC[NH+](Cc3cccc(F)c3Br)CC2)CC1 ZINC000295597034 565275569 /nfs/dbraw/zinc/27/55/69/565275569.db2.gz CNVUXNRGXHOIRI-UHFFFAOYSA-N 2 1 384.337 3.048 20 0 GGADMP C[NH+]1CCC(O)(C[NH2+][C@H](c2ccco2)c2ccc(Br)cc2)CC1 ZINC000272302577 565283710 /nfs/dbraw/zinc/28/37/10/565283710.db2.gz DMLHJLJQMVEKJS-KRWDZBQOSA-N 2 1 379.298 3.178 20 0 GGADMP OC1CC[NH+](CCC[NH2+][C@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000295999085 565297633 /nfs/dbraw/zinc/29/76/33/565297633.db2.gz ODDCUKJQNHVUKB-LJQANCHMSA-N 2 1 381.358 3.207 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2ncc(Br)cc2F)CC1 ZINC000186999395 565301724 /nfs/dbraw/zinc/30/17/24/565301724.db2.gz POYIXKQYPJLKAY-CQSZACIVSA-N 2 1 387.341 3.052 20 0 GGADMP COc1c(Br)cccc1C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000187168792 565314442 /nfs/dbraw/zinc/31/44/42/565314442.db2.gz ORAFDTXQOHUQLJ-GASCZTMLSA-N 2 1 385.346 3.437 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)nc12 ZINC000273433599 565320355 /nfs/dbraw/zinc/32/03/55/565320355.db2.gz LKTWBOSGRWNOGX-CKEIUWERSA-N 3 1 379.346 3.266 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3C[C@@H](C)N(C)C[C@H]3C)nc12 ZINC000273433599 565320359 /nfs/dbraw/zinc/32/03/59/565320359.db2.gz LKTWBOSGRWNOGX-CKEIUWERSA-N 3 1 379.346 3.266 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)nc12 ZINC000273442467 565321100 /nfs/dbraw/zinc/32/11/00/565321100.db2.gz NAHZSPBROKDHST-RDJZCZTQSA-N 2 1 377.330 3.164 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)nc12 ZINC000273442469 565321353 /nfs/dbraw/zinc/32/13/53/565321353.db2.gz NAHZSPBROKDHST-WBVHZDCISA-N 2 1 377.330 3.164 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3cccc(Br)c3)CC[C@@H]21 ZINC000162800308 565327869 /nfs/dbraw/zinc/32/78/69/565327869.db2.gz MESOBNYSSFOSNI-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CCC(=O)Nc3cccc(Br)c3)CC[C@@H]21 ZINC000162800308 565327872 /nfs/dbraw/zinc/32/78/72/565327872.db2.gz MESOBNYSSFOSNI-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CCC(=O)Nc3cccc(Br)c3)CC[C@@H]21 ZINC000162800308 565327878 /nfs/dbraw/zinc/32/78/78/565327878.db2.gz MESOBNYSSFOSNI-YOEHRIQHSA-N 2 1 380.330 3.194 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2cc(Br)ncc2F)CC1 ZINC000273917354 565346023 /nfs/dbraw/zinc/34/60/23/565346023.db2.gz YXYAJBUZPHUWOI-AWEZNQCLSA-N 2 1 387.341 3.052 20 0 GGADMP C[C@@H](Cn1cc(Br)cn1)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165315230 565369253 /nfs/dbraw/zinc/36/92/53/565369253.db2.gz QKOAQPCUPAATDB-WMZOPIPTSA-N 2 1 391.357 3.188 20 0 GGADMP Brc1ccc(N2CC[C@@H](C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000166333869 565374144 /nfs/dbraw/zinc/37/41/44/565374144.db2.gz NZPTXHHXXSSNBG-KVSKMBFKSA-N 2 1 378.358 3.492 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)Cc2ccc(Br)cc2)CC1 ZINC000188121620 565381634 /nfs/dbraw/zinc/38/16/34/565381634.db2.gz QYTZBCROQTUWNM-QGZVFWFLSA-N 2 1 382.390 3.387 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+]C3CC[NH+](C4CC4)CC3)nc12 ZINC000297716790 565383531 /nfs/dbraw/zinc/38/35/31/565383531.db2.gz RNIOWUGMRQMQSK-UHFFFAOYSA-N 2 1 377.330 3.164 20 0 GGADMP C[C@H](Cc1ccc(Br)cc1)[NH2+]CC1CCN(CC[NH+](C)C)CC1 ZINC000188185447 565386033 /nfs/dbraw/zinc/38/60/33/565386033.db2.gz WSYSMIDUSPVQFF-MRXNPFEDSA-N 2 1 382.390 3.243 20 0 GGADMP C[C@@H](Cc1ccc(Br)cc1)[NH2+]CC1CCN(CC[NH+](C)C)CC1 ZINC000188185422 565386298 /nfs/dbraw/zinc/38/62/98/565386298.db2.gz WSYSMIDUSPVQFF-INIZCTEOSA-N 2 1 382.390 3.243 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+][C@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000297775890 565386555 /nfs/dbraw/zinc/38/65/55/565386555.db2.gz VYUYNUQSGURCEQ-CQSZACIVSA-N 2 1 392.219 3.067 20 0 GGADMP C[C@@H](C[NH2+]Cc1ccc(Br)cc1N1CCOCC1)C[NH+]1CCCC1 ZINC000188700268 565418485 /nfs/dbraw/zinc/41/84/85/565418485.db2.gz RSFLFFXOUHPCAG-INIZCTEOSA-N 2 1 396.373 3.107 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(Br)c2c(c1)OCCO2 ZINC000171764706 565449155 /nfs/dbraw/zinc/44/91/55/565449155.db2.gz JGJWFKRLUZTUPO-GFCCVEGCSA-N 2 1 380.286 3.151 20 0 GGADMP C[N@@H+]1CCC[C@@H](N2CCN(c3cc[nH+]c4ccc(Br)cc43)CC2)C1 ZINC000301245146 565474660 /nfs/dbraw/zinc/47/46/60/565474660.db2.gz ALUUHLNGLNVGFQ-MRXNPFEDSA-N 2 1 389.341 3.214 20 0 GGADMP C[N@H+]1CCC[C@@H](N2CCN(c3cc[nH+]c4ccc(Br)cc43)CC2)C1 ZINC000301245146 565474666 /nfs/dbraw/zinc/47/46/66/565474666.db2.gz ALUUHLNGLNVGFQ-MRXNPFEDSA-N 2 1 389.341 3.214 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3cnc([C@@H](C)O)s3)CC2)cs1 ZINC000377660716 565491343 /nfs/dbraw/zinc/49/13/43/565491343.db2.gz ZEWZLVZIVYETAU-CYBMUJFWSA-N 2 1 380.583 3.217 20 0 GGADMP Brc1ccc([C@H]([NH2+]C[C@H]2CCc3[nH+]ccn3C2)c2cncnc2)cc1 ZINC000278910165 565585586 /nfs/dbraw/zinc/58/55/86/565585586.db2.gz GUDNUJKSSYKIFB-KUHUBIRLSA-N 2 1 398.308 3.377 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000173790745 565586375 /nfs/dbraw/zinc/58/63/75/565586375.db2.gz KROUWKYVUGZSPK-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000173794384 565587176 /nfs/dbraw/zinc/58/71/76/565587176.db2.gz MLNSAMOKWCZNIH-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000174224228 565621260 /nfs/dbraw/zinc/62/12/60/565621260.db2.gz FYRMOFDCULUHCC-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CCN(c2cccc(Br)c2)C1=O ZINC000192075007 565655707 /nfs/dbraw/zinc/65/57/07/565655707.db2.gz RGULONBYPBQXIE-QGZVFWFLSA-N 2 1 391.313 3.081 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CCN(c2cccc(Br)c2)C1=O ZINC000192075007 565655710 /nfs/dbraw/zinc/65/57/10/565655710.db2.gz RGULONBYPBQXIE-QGZVFWFLSA-N 2 1 391.313 3.081 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCC(=O)Nc2ccccc2Br)C1 ZINC000174970946 565669736 /nfs/dbraw/zinc/66/97/36/565669736.db2.gz FWOVEBZNTUDLMN-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000174970946 565669740 /nfs/dbraw/zinc/66/97/40/565669740.db2.gz FWOVEBZNTUDLMN-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000174970946 565669744 /nfs/dbraw/zinc/66/97/44/565669744.db2.gz FWOVEBZNTUDLMN-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP O=C1[C@H](N2CCC(c3ncc[nH]3)CC2)CCN1c1cccc(Br)c1 ZINC000330337922 565701620 /nfs/dbraw/zinc/70/16/20/565701620.db2.gz UQSVLNSBOLBOAV-MRXNPFEDSA-N 2 1 389.297 3.157 20 0 GGADMP C[C@@H](Cn1cc(Br)cn1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192934987 565720118 /nfs/dbraw/zinc/72/01/18/565720118.db2.gz KBJPNXHBDKMMQL-RDJZCZTQSA-N 2 1 377.330 3.146 20 0 GGADMP C[C@@H](Cn1cc(Br)cn1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192935015 565720266 /nfs/dbraw/zinc/72/02/66/565720266.db2.gz KBJPNXHBDKMMQL-DOTOQJQBSA-N 2 1 377.330 3.146 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCC(=O)Nc1cccc(Br)c1 ZINC000411396294 565726984 /nfs/dbraw/zinc/72/69/84/565726984.db2.gz FOVAPEFDDCDKDT-UHFFFAOYSA-N 2 1 379.302 3.305 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CCC(=O)Nc1cccc(Br)c1 ZINC000411396294 565726988 /nfs/dbraw/zinc/72/69/88/565726988.db2.gz FOVAPEFDDCDKDT-UHFFFAOYSA-N 2 1 379.302 3.305 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCC(=O)Nc1ccc(Br)cc1 ZINC000411403808 565728993 /nfs/dbraw/zinc/72/89/93/565728993.db2.gz XILOLFSAQVJPAU-UHFFFAOYSA-N 2 1 379.302 3.305 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CCC(=O)Nc1ccc(Br)cc1 ZINC000411403808 565728998 /nfs/dbraw/zinc/72/89/98/565728998.db2.gz XILOLFSAQVJPAU-UHFFFAOYSA-N 2 1 379.302 3.305 20 0 GGADMP C[N@@H+]1CCCC12CC[NH+](CCC(=O)Nc1ccccc1Br)CC2 ZINC000411438921 565729853 /nfs/dbraw/zinc/72/98/53/565729853.db2.gz CYSAKWXOJIFEAR-UHFFFAOYSA-N 2 1 380.330 3.338 20 0 GGADMP C[N@H+]1CCCC12CC[NH+](CCC(=O)Nc1ccccc1Br)CC2 ZINC000411438921 565729861 /nfs/dbraw/zinc/72/98/61/565729861.db2.gz CYSAKWXOJIFEAR-UHFFFAOYSA-N 2 1 380.330 3.338 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(Cl)cs3)c2)C1 ZINC000193095324 565732566 /nfs/dbraw/zinc/73/25/66/565732566.db2.gz KWBVCUDWWRSPHA-INIZCTEOSA-N 2 1 377.941 3.389 20 0 GGADMP CC[NH+](CC)CCC[N@@H+]1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1 ZINC000193474368 565754446 /nfs/dbraw/zinc/75/44/46/565754446.db2.gz MLYVGNLVCRBXFK-OAHLLOKOSA-N 2 1 397.361 3.227 20 0 GGADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1 ZINC000193474368 565754447 /nfs/dbraw/zinc/75/44/47/565754447.db2.gz MLYVGNLVCRBXFK-OAHLLOKOSA-N 2 1 397.361 3.227 20 0 GGADMP CC[NH+](CC)CCC[N@@H+]1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1 ZINC000193474350 565754454 /nfs/dbraw/zinc/75/44/54/565754454.db2.gz MLYVGNLVCRBXFK-HNNXBMFYSA-N 2 1 397.361 3.227 20 0 GGADMP CC[NH+](CC)CCC[N@H+]1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1 ZINC000193474350 565754457 /nfs/dbraw/zinc/75/44/57/565754457.db2.gz MLYVGNLVCRBXFK-HNNXBMFYSA-N 2 1 397.361 3.227 20 0 GGADMP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cscc2Br)C1 ZINC000286160223 565945212 /nfs/dbraw/zinc/94/52/12/565945212.db2.gz WFOUGICYBYKLTM-MRXNPFEDSA-N 2 1 381.339 3.367 20 0 GGADMP O[C@@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2cscc2Br)C1 ZINC000286160223 565945219 /nfs/dbraw/zinc/94/52/19/565945219.db2.gz WFOUGICYBYKLTM-MRXNPFEDSA-N 2 1 381.339 3.367 20 0 GGADMP Cc1cc([C@@H]2CCC[N@H+]2C[C@H]2CCCN(C(=O)C[NH3+])C2)ccc1Br ZINC000414755710 565958829 /nfs/dbraw/zinc/95/88/29/565958829.db2.gz PLAVOQKAVGSLDK-QAPCUYQASA-N 2 1 394.357 3.092 20 0 GGADMP COC(=O)CC[N@H+](Cc1cccc(Br)c1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414751710 565959217 /nfs/dbraw/zinc/95/92/17/565959217.db2.gz AXSXRKKVXMCGQT-ZBFHGGJFSA-N 2 1 383.330 3.202 20 0 GGADMP CC(C)C[N@H+](Cc1ccccc1Br)C[C@@H]1CCCN(C(=O)C[NH3+])C1 ZINC000414757429 565959242 /nfs/dbraw/zinc/95/92/42/565959242.db2.gz SPKFGEPRXILNOR-INIZCTEOSA-N 2 1 396.373 3.104 20 0 GGADMP Brc1ccc(OCc2ccccn2)c(C[NH2+]C2CC[NH2+]CC2)c1 ZINC000414783070 565959867 /nfs/dbraw/zinc/95/98/67/565959867.db2.gz FWMJXKHAVKYECL-UHFFFAOYSA-N 2 1 376.298 3.265 20 0 GGADMP CCOc1c(Br)cc(C[NH2+]C2CC[NH2+]CC2)cc1Br ZINC000414783676 565959952 /nfs/dbraw/zinc/95/99/52/565959952.db2.gz GLBGYPVFAISEDC-UHFFFAOYSA-N 2 1 392.135 3.452 20 0 GGADMP Cc1cc(Br)ccc1C(=O)N1CCC([NH2+][C@H](C[NH3+])CC(C)C)CC1 ZINC000414831215 565962861 /nfs/dbraw/zinc/96/28/61/565962861.db2.gz CDBBBWVMWZEVSS-KRWDZBQOSA-N 2 1 396.373 3.325 20 0 GGADMP CCOc1c(Br)cc(Br)cc1C[NH2+][C@@H](C)CC[NH3+] ZINC000414891713 565965642 /nfs/dbraw/zinc/96/56/42/565965642.db2.gz WJDPMEOJTPRTFJ-VIFPVBQESA-N 2 1 380.124 3.437 20 0 GGADMP CCOc1c(Br)cc(Br)cc1C[NH2+][C@H](C)CC[NH3+] ZINC000414891712 565965843 /nfs/dbraw/zinc/96/58/43/565965843.db2.gz WJDPMEOJTPRTFJ-SECBINFHSA-N 2 1 380.124 3.437 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000414955446 565967287 /nfs/dbraw/zinc/96/72/87/565967287.db2.gz UHSRUNHMJLAHLC-LRDDRELGSA-N 2 1 377.330 3.482 20 0 GGADMP O=C(CC1CC[NH2+]CC1)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000237669965 565967423 /nfs/dbraw/zinc/96/74/23/565967423.db2.gz MNYMXZOZBFJBAV-UHFFFAOYSA-N 2 1 384.351 3.464 20 0 GGADMP C[C@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000415037498 565970599 /nfs/dbraw/zinc/97/05/99/565970599.db2.gz LHFIOXSYLLKNBB-KUHUBIRLSA-N 2 1 393.325 3.338 20 0 GGADMP COc1sc(C[NH+]2CCC([C@@H]3OCCC[C@H]3[NH3+])CC2)cc1Br ZINC000415111387 565972916 /nfs/dbraw/zinc/97/29/16/565972916.db2.gz QVGFMFMSEVWIGU-CABCVRRESA-N 2 1 389.359 3.238 20 0 GGADMP COc1c(Br)cccc1C[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000415102960 565973046 /nfs/dbraw/zinc/97/30/46/565973046.db2.gz FBQBSHFQSFRHMQ-WMZOPIPTSA-N 2 1 383.330 3.176 20 0 GGADMP COc1c(Br)cccc1C[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000415102958 565973216 /nfs/dbraw/zinc/97/32/16/565973216.db2.gz FBQBSHFQSFRHMQ-SJLPKXTDSA-N 2 1 383.330 3.176 20 0 GGADMP COc1sc(C[NH+]2CCC([C@H]3C[C@@H]([NH3+])CCO3)CC2)cc1Br ZINC000415121258 565974419 /nfs/dbraw/zinc/97/44/19/565974419.db2.gz HWWHOPXSQWCOSA-SWLSCSKDSA-N 2 1 389.359 3.238 20 0 GGADMP COc1ccc(Br)cc1C[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000415119286 565974653 /nfs/dbraw/zinc/97/46/53/565974653.db2.gz FFNRXNCTMWPFNV-FUHWJXTLSA-N 2 1 383.330 3.176 20 0 GGADMP Clc1cc(C[N@@H+]2CC3(CC[NH2+]CC3)[C@@H]3COC[C@@H]32)ccc1Br ZINC000415142333 565975841 /nfs/dbraw/zinc/97/58/41/565975841.db2.gz RCNIEEHRNSNNFJ-CJNGLKHVSA-N 2 1 385.733 3.303 20 0 GGADMP Clc1cc(C[N@H+]2CC3(CC[NH2+]CC3)[C@@H]3COC[C@@H]32)ccc1Br ZINC000415142333 565975846 /nfs/dbraw/zinc/97/58/46/565975846.db2.gz RCNIEEHRNSNNFJ-CJNGLKHVSA-N 2 1 385.733 3.303 20 0 GGADMP [NH3+]CC1(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)CCCC1 ZINC000238048356 565978919 /nfs/dbraw/zinc/97/89/19/565978919.db2.gz FTSXYYIYBHMDKN-UHFFFAOYSA-N 2 1 394.357 3.049 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1c(Br)ccc2F ZINC000245550392 565995710 /nfs/dbraw/zinc/99/57/10/565995710.db2.gz HQGANOXLTQRRKS-SUMWQHHRSA-N 2 1 385.321 3.402 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ncc(Br)s1 ZINC000245672859 566000507 /nfs/dbraw/zinc/00/05/07/566000507.db2.gz PVGKURLTABXYTQ-FRRDWIJNSA-N 2 1 376.364 3.446 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](C[C@H](C)c3cccc(Br)c3)C2)CC1 ZINC000245770643 566005978 /nfs/dbraw/zinc/00/59/78/566005978.db2.gz RSQYZQCFIDXMBV-QFBILLFUSA-N 2 1 380.374 3.264 20 0 GGADMP Cn1ccnc1C[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc(Br)c2)C1 ZINC000245878134 566009407 /nfs/dbraw/zinc/00/94/07/566009407.db2.gz MWVXCNGHKZZYRB-RHSMWYFYSA-N 2 1 378.314 3.171 20 0 GGADMP Brc1ccc(-c2nnc(C[N@@H+]3CCC[C@H](c4ncc[nH]4)C3)o2)o1 ZINC000363566287 566011750 /nfs/dbraw/zinc/01/17/50/566011750.db2.gz PLBLEZJDCMATAX-JTQLQIEISA-N 2 1 378.230 3.195 20 0 GGADMP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](CCCc3ccccc3Br)C2)CC1 ZINC000363670452 566016049 /nfs/dbraw/zinc/01/60/49/566016049.db2.gz JUWZHSZPUTXKEQ-IBGZPJMESA-N 2 1 394.401 3.482 20 0 GGADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)[C@@H](C)C1 ZINC000246439538 566030254 /nfs/dbraw/zinc/03/02/54/566030254.db2.gz OLVWFLDYOPHTNZ-YJBOKZPZSA-N 2 1 396.373 3.106 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)[C@@H](C)C1 ZINC000246439538 566030257 /nfs/dbraw/zinc/03/02/57/566030257.db2.gz OLVWFLDYOPHTNZ-YJBOKZPZSA-N 2 1 396.373 3.106 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3ccccc3Br)CC[C@H]21 ZINC000246724371 566038880 /nfs/dbraw/zinc/03/88/80/566038880.db2.gz FWAZLEPUTIDJEE-WMLDXEAASA-N 2 1 380.330 3.194 20 0 GGADMP O[C@H](COc1ccc(Br)cc1)C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000246873999 566044158 /nfs/dbraw/zinc/04/41/58/566044158.db2.gz APKUENZVYRUKQN-MSOLQXFVSA-N 2 1 397.357 3.139 20 0 GGADMP O[C@H](COc1ccc(Br)cc1)C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000246873999 566044162 /nfs/dbraw/zinc/04/41/62/566044162.db2.gz APKUENZVYRUKQN-MSOLQXFVSA-N 2 1 397.357 3.139 20 0 GGADMP CN(Cc1ccccc1Br)C(=O)CC[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000247205919 566055231 /nfs/dbraw/zinc/05/52/31/566055231.db2.gz YRHWXTBSSPJATF-SJORKVTESA-N 2 1 394.357 3.014 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000247700167 566065571 /nfs/dbraw/zinc/06/55/71/566065571.db2.gz XOTXGOKPWDBYRE-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000247700167 566065575 /nfs/dbraw/zinc/06/55/75/566065575.db2.gz XOTXGOKPWDBYRE-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000247700166 566065666 /nfs/dbraw/zinc/06/56/66/566065666.db2.gz XOTXGOKPWDBYRE-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000247700166 566065671 /nfs/dbraw/zinc/06/56/71/566065671.db2.gz XOTXGOKPWDBYRE-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H]2CO)cc1Br ZINC000247954185 566069709 /nfs/dbraw/zinc/06/97/09/566069709.db2.gz FISUFAUZSIMREI-ZBFHGGJFSA-N 2 1 385.346 3.345 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(Cc3cc4c(cc3Br)OCCO4)CC[C@H]21 ZINC000248165924 566073498 /nfs/dbraw/zinc/07/34/98/566073498.db2.gz SXMLGPCKBIIEJE-CZUORRHYSA-N 2 1 381.314 3.136 20 0 GGADMP Brc1cccc(-c2noc(C[NH+]3CCC([C@@H]4CCC[NH2+]4)CC3)n2)c1 ZINC000261696386 566129340 /nfs/dbraw/zinc/12/93/40/566129340.db2.gz OEBWMHJKCPIMIA-INIZCTEOSA-N 2 1 391.313 3.463 20 0 GGADMP C[C@@]([NH3+])(C(=O)N1CCC[N@H+](C2CCCC2)CC1)c1ccc(Br)cc1 ZINC000261742872 566131908 /nfs/dbraw/zinc/13/19/08/566131908.db2.gz LYDYGDBDTJFNKX-IBGZPJMESA-N 2 1 394.357 3.100 20 0 GGADMP C[C@]([NH3+])(C(=O)N1CCC[N@H+](C2CCCC2)CC1)c1ccc(Br)cc1 ZINC000261742877 566132253 /nfs/dbraw/zinc/13/22/53/566132253.db2.gz LYDYGDBDTJFNKX-LJQANCHMSA-N 2 1 394.357 3.100 20 0 GGADMP C[N@@H+](Cc1cccc(Br)c1OC[C@H]1CCCO1)C[C@H]1CCC[NH2+]C1 ZINC000261944959 566141237 /nfs/dbraw/zinc/14/12/37/566141237.db2.gz NGJONLYVYVFBLD-DOTOQJQBSA-N 2 1 397.357 3.438 20 0 GGADMP C[N@H+](Cc1cccc(Br)c1OC[C@H]1CCCO1)C[C@H]1CCC[NH2+]C1 ZINC000261944959 566141241 /nfs/dbraw/zinc/14/12/41/566141241.db2.gz NGJONLYVYVFBLD-DOTOQJQBSA-N 2 1 397.357 3.438 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000181459439 566142181 /nfs/dbraw/zinc/14/21/81/566142181.db2.gz IPTWOHIVEQJJFV-RKVPGOIHSA-N 2 1 396.373 3.104 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000181459439 566142186 /nfs/dbraw/zinc/14/21/86/566142186.db2.gz IPTWOHIVEQJJFV-RKVPGOIHSA-N 2 1 396.373 3.104 20 0 GGADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)[C@H](C)C1 ZINC000181458017 566142244 /nfs/dbraw/zinc/14/22/44/566142244.db2.gz OLVWFLDYOPHTNZ-QAPCUYQASA-N 2 1 396.373 3.106 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)[C@H](C)C1 ZINC000181458017 566142246 /nfs/dbraw/zinc/14/22/46/566142246.db2.gz OLVWFLDYOPHTNZ-QAPCUYQASA-N 2 1 396.373 3.106 20 0 GGADMP C[N@@H+](Cc1cccc(Br)c1OC[C@@H]1CCCO1)C[C@H]1CCC[NH2+]C1 ZINC000261944961 566142241 /nfs/dbraw/zinc/14/22/41/566142241.db2.gz NGJONLYVYVFBLD-RDJZCZTQSA-N 2 1 397.357 3.438 20 0 GGADMP C[N@H+](Cc1cccc(Br)c1OC[C@@H]1CCCO1)C[C@H]1CCC[NH2+]C1 ZINC000261944961 566142242 /nfs/dbraw/zinc/14/22/42/566142242.db2.gz NGJONLYVYVFBLD-RDJZCZTQSA-N 2 1 397.357 3.438 20 0 GGADMP CCC[C@@](C)([NH3+])C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000262334803 566150907 /nfs/dbraw/zinc/15/09/07/566150907.db2.gz WPDLJIPSRZLPKW-GOSISDBHSA-N 2 1 382.346 3.047 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCCN2CCC[N@@H+](C)CC2)c(Br)c1 ZINC000181704454 566159878 /nfs/dbraw/zinc/15/98/78/566159878.db2.gz LEMXZWGGWPZEBC-HNNXBMFYSA-N 2 1 384.362 3.136 20 0 GGADMP C[C@@H](CCC[NH3+])NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000417988784 566185911 /nfs/dbraw/zinc/18/59/11/566185911.db2.gz ISZUAPKPISAOOR-ZDUSSCGKSA-N 2 1 387.355 3.384 20 0 GGADMP COc1ccc(C[N@@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Br ZINC000367617140 566209135 /nfs/dbraw/zinc/20/91/35/566209135.db2.gz JNXCVDZBONVWBG-QGZVFWFLSA-N 2 1 396.373 3.058 20 0 GGADMP C[N@@H+](Cc1cnc(-c2cccs2)s1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000368050818 566228661 /nfs/dbraw/zinc/22/86/61/566228661.db2.gz IDXUMOOLWGITBK-MRXNPFEDSA-N 2 1 376.595 3.472 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)[C@H]1CCCc2ccc(Br)cc21 ZINC000182963135 566232658 /nfs/dbraw/zinc/23/26/58/566232658.db2.gz ITUCZVZTEJGNFP-IBGZPJMESA-N 2 1 380.374 3.396 20 0 GGADMP CCC[NH+]1CCC([NH2+]Cc2ccc(Br)cc2N2CCOCC2)CC1 ZINC000183355754 566245106 /nfs/dbraw/zinc/24/51/06/566245106.db2.gz WGZJIQBJMIQEAC-UHFFFAOYSA-N 2 1 396.373 3.250 20 0 GGADMP Brc1cc(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc2c1OCCCO2 ZINC000368789430 566245643 /nfs/dbraw/zinc/24/56/43/566245643.db2.gz DABIGJONOQPMRZ-CABCVRRESA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc2c1OCCCO2 ZINC000368789430 566245645 /nfs/dbraw/zinc/24/56/45/566245645.db2.gz DABIGJONOQPMRZ-CABCVRRESA-N 2 1 381.314 3.327 20 0 GGADMP Brc1cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc2c1OCCCO2 ZINC000368789430 566245646 /nfs/dbraw/zinc/24/56/46/566245646.db2.gz DABIGJONOQPMRZ-CABCVRRESA-N 2 1 381.314 3.327 20 0 GGADMP Cc1c(Br)cccc1C[N@@H+]1CC[C@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000534869457 566261729 /nfs/dbraw/zinc/26/17/29/566261729.db2.gz ZWIVYFNVWBQAAH-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP CC[C@@H]([NH2+]C[C@@H](C)C[NH+]1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481914939 566262580 /nfs/dbraw/zinc/26/25/80/566262580.db2.gz CAIIGUVZBZNFOO-RHSMWYFYSA-N 2 1 387.977 3.021 20 0 GGADMP CC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481916843 566263233 /nfs/dbraw/zinc/26/32/33/566263233.db2.gz XWOMGQPABHGLAY-MRXNPFEDSA-N 2 1 375.966 3.019 20 0 GGADMP CC[C@@H]([NH2+]CCC[N@@H+](C)C(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481916843 566263238 /nfs/dbraw/zinc/26/32/38/566263238.db2.gz XWOMGQPABHGLAY-MRXNPFEDSA-N 2 1 375.966 3.019 20 0 GGADMP C[C@@H]1CC[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H]1C[NH3+] ZINC000420410161 566278013 /nfs/dbraw/zinc/27/80/13/566278013.db2.gz RDFCDMHTNSBEJW-HIFRSBDPSA-N 2 1 375.314 3.323 20 0 GGADMP C[C@@H]1CC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H]1C[NH3+] ZINC000420410161 566278022 /nfs/dbraw/zinc/27/80/22/566278022.db2.gz RDFCDMHTNSBEJW-HIFRSBDPSA-N 2 1 375.314 3.323 20 0 GGADMP C[C@H]1CC[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H]1C[NH3+] ZINC000420410163 566278839 /nfs/dbraw/zinc/27/88/39/566278839.db2.gz RDFCDMHTNSBEJW-ZFWWWQNUSA-N 2 1 375.314 3.323 20 0 GGADMP C[C@H]1CC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H]1C[NH3+] ZINC000420410163 566278843 /nfs/dbraw/zinc/27/88/43/566278843.db2.gz RDFCDMHTNSBEJW-ZFWWWQNUSA-N 2 1 375.314 3.323 20 0 GGADMP O=C1Nc2ccc(Br)cc2CC[C@H]1[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000625216576 566290624 /nfs/dbraw/zinc/29/06/24/566290624.db2.gz QWNFITCKFJLJAX-MRXNPFEDSA-N 2 1 389.297 3.305 20 0 GGADMP C[C@H](C(=O)Nc1cccc(Br)c1)[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000575869362 566293669 /nfs/dbraw/zinc/29/36/69/566293669.db2.gz SQKNBEIWMMFNNN-RBSFLKMASA-N 2 1 380.330 3.098 20 0 GGADMP C[C@H](C(=O)Nc1cccc(Br)c1)[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000575869361 566293763 /nfs/dbraw/zinc/29/37/63/566293763.db2.gz SQKNBEIWMMFNNN-QLFBSQMISA-N 2 1 380.330 3.098 20 0 GGADMP C[C@H](C(=O)Nc1cccc(Br)c1)[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000575869359 566294701 /nfs/dbraw/zinc/29/47/01/566294701.db2.gz SQKNBEIWMMFNNN-ILXRZTDVSA-N 2 1 380.330 3.098 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CCc2cc(Br)ccc2NC1=O ZINC000625262773 566300391 /nfs/dbraw/zinc/30/03/91/566300391.db2.gz GNPLOLDKNAVVJC-KRWDZBQOSA-N 2 1 391.313 3.229 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CCc2cc(Br)ccc2NC1=O ZINC000625262773 566300395 /nfs/dbraw/zinc/30/03/95/566300395.db2.gz GNPLOLDKNAVVJC-KRWDZBQOSA-N 2 1 391.313 3.229 20 0 GGADMP C[N@H+]1CC[C@](O)(CNCc2ccc(-c3ccccc3Br)cc2)C1 ZINC000509472398 566308875 /nfs/dbraw/zinc/30/88/75/566308875.db2.gz RLOOKAPCHTVZMI-IBGZPJMESA-N 2 1 375.310 3.272 20 0 GGADMP CN1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000509472398 566308879 /nfs/dbraw/zinc/30/88/79/566308879.db2.gz RLOOKAPCHTVZMI-IBGZPJMESA-N 2 1 375.310 3.272 20 0 GGADMP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000509472398 566308889 /nfs/dbraw/zinc/30/88/89/566308889.db2.gz RLOOKAPCHTVZMI-IBGZPJMESA-N 2 1 375.310 3.272 20 0 GGADMP C[N@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000509472398 566308894 /nfs/dbraw/zinc/30/88/94/566308894.db2.gz RLOOKAPCHTVZMI-IBGZPJMESA-N 2 1 375.310 3.272 20 0 GGADMP C[NH+]1CCN(C(=O)CC[NH2+][C@@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000482462170 566309399 /nfs/dbraw/zinc/30/93/99/566309399.db2.gz VBXHWNIOWUELLS-GFCCVEGCSA-N 2 1 376.353 3.186 20 0 GGADMP C[C@@H]1[C@H](C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC[N@@H+]1C ZINC000648776994 566313876 /nfs/dbraw/zinc/31/38/76/566313876.db2.gz BLXIAUBETHWVDX-CZUORRHYSA-N 2 1 384.351 3.414 20 0 GGADMP C[C@@H]1[C@H](C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC[N@H+]1C ZINC000648776994 566313884 /nfs/dbraw/zinc/31/38/84/566313884.db2.gz BLXIAUBETHWVDX-CZUORRHYSA-N 2 1 384.351 3.414 20 0 GGADMP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cccc(Br)c1 ZINC000482561769 566318139 /nfs/dbraw/zinc/31/81/39/566318139.db2.gz DORSDYZETQQNBX-WBVHZDCISA-N 2 1 382.346 3.077 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]CCC[N@H+]2CCC[C@@H](C(N)=O)C2)c2cccc(Br)c21 ZINC000482568306 566318369 /nfs/dbraw/zinc/31/83/69/566318369.db2.gz XKMJGUANRHPDIV-CPUCHLNUSA-N 2 1 394.357 3.174 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]Cc2cc(Br)cc3c2OCC3)C[C@H](C)O1 ZINC000462537360 566319371 /nfs/dbraw/zinc/31/93/71/566319371.db2.gz VEPLRNVYYPYIBB-GASCZTMLSA-N 2 1 397.357 3.363 20 0 GGADMP CC[N@@H+]1CCC[C@@H](CN(C)c2cc[nH+]cc2Br)[C@@H]1c1cnn(C)c1 ZINC000509623588 566321395 /nfs/dbraw/zinc/32/13/95/566321395.db2.gz YRXWIGLLAWKDCT-KBXCAEBGSA-N 2 1 392.345 3.487 20 0 GGADMP CC[N@H+]1CCC[C@@H](CN(C)c2cc[nH+]cc2Br)[C@@H]1c1cnn(C)c1 ZINC000509623588 566321403 /nfs/dbraw/zinc/32/14/03/566321403.db2.gz YRXWIGLLAWKDCT-KBXCAEBGSA-N 2 1 392.345 3.487 20 0 GGADMP Cc1cc(C[N@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)ccc1Br ZINC000669691622 566322216 /nfs/dbraw/zinc/32/22/16/566322216.db2.gz FZJKLXWYDOHFJB-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP C[N@H+]1CCC[C@]2(CCN([C@H]3CCc4cc(Br)ccc4NC3=O)C2)C1 ZINC000625448440 566323586 /nfs/dbraw/zinc/32/35/86/566323586.db2.gz LHUCRPCERZIIKQ-HKUYNNGSSA-N 2 1 392.341 3.120 20 0 GGADMP C[N@H+]1CCC[C@@]2(CCN([C@H]3CCc4cc(Br)ccc4NC3=O)C2)C1 ZINC000625448445 566323718 /nfs/dbraw/zinc/32/37/18/566323718.db2.gz LHUCRPCERZIIKQ-PKOBYXMFSA-N 2 1 392.341 3.120 20 0 GGADMP C[N@H+]1CC[C@]2(C1)CCCN([C@H]1CCc3cc(Br)ccc3NC1=O)C2 ZINC000625452062 566326012 /nfs/dbraw/zinc/32/60/12/566326012.db2.gz OOWUTYMTCGMRRU-HKUYNNGSSA-N 2 1 392.341 3.120 20 0 GGADMP C[N@H+]1CC[C@@]2(C1)CCCN([C@H]1CCc3cc(Br)ccc3NC1=O)C2 ZINC000625452075 566326217 /nfs/dbraw/zinc/32/62/17/566326217.db2.gz OOWUTYMTCGMRRU-PKOBYXMFSA-N 2 1 392.341 3.120 20 0 GGADMP CC[C@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc(Br)c1 ZINC000482874692 566339438 /nfs/dbraw/zinc/33/94/38/566339438.db2.gz JKJDYVBZWNFVPQ-SFHVURJKSA-N 2 1 396.373 3.433 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)C[N@@H+](C)[C@H]1CCSC1)c1ccccc1Cl ZINC000536072071 566350209 /nfs/dbraw/zinc/35/02/09/566350209.db2.gz HDKKPLZHZFVTBW-YJBOKZPZSA-N 2 1 383.989 3.276 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000576498978 566351396 /nfs/dbraw/zinc/35/13/96/566351396.db2.gz VBBHLYSVYKPBKU-XYPHTWIQSA-N 2 1 380.330 3.383 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000576498975 566352223 /nfs/dbraw/zinc/35/22/23/566352223.db2.gz VBBHLYSVYKPBKU-XOKHGSTOSA-N 2 1 380.330 3.383 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@H]2CCCc3ccc(Br)cc32)CC1 ZINC000536157083 566354692 /nfs/dbraw/zinc/35/46/92/566354692.db2.gz CODTVCSRUREDRY-IBGZPJMESA-N 2 1 380.374 3.444 20 0 GGADMP CC(C)([NH3+])CCC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000649346782 566361499 /nfs/dbraw/zinc/36/14/99/566361499.db2.gz JZNROIGPCUYHDJ-UHFFFAOYSA-N 2 1 382.346 3.047 20 0 GGADMP C[C@H]1CC[NH2+][C@@H](C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000649330289 566361648 /nfs/dbraw/zinc/36/16/48/566361648.db2.gz NLZXPYHHZVXVGG-SCLBCKFNSA-N 2 1 384.351 3.462 20 0 GGADMP C[C@H]1C[N@H+](Cc2cnc(-c3ccsc3)s2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000536664625 566392809 /nfs/dbraw/zinc/39/28/09/566392809.db2.gz RKQOYOUCQJFIKK-YJBOKZPZSA-N 2 1 376.595 3.329 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cnc(-c3ccsc3)s2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000536664625 566392816 /nfs/dbraw/zinc/39/28/16/566392816.db2.gz RKQOYOUCQJFIKK-YJBOKZPZSA-N 2 1 376.595 3.329 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(Br)cc1OCCCO ZINC000463375312 566405402 /nfs/dbraw/zinc/40/54/02/566405402.db2.gz LCQMNWKXSOKRHT-ZDUSSCGKSA-N 2 1 382.302 3.066 20 0 GGADMP CN(C(=O)CSc1ccccc1Cl)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000601477939 566408395 /nfs/dbraw/zinc/40/83/95/566408395.db2.gz NEERAQKKIKKYQX-INIZCTEOSA-N 2 1 381.973 3.059 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1NCc1ccc(Cl)cc1I ZINC000447566701 566416503 /nfs/dbraw/zinc/41/65/03/566416503.db2.gz VTQIEHZMPYPOLR-HZMBPMFUSA-N 2 1 378.685 3.374 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000447571057 566417055 /nfs/dbraw/zinc/41/70/55/566417055.db2.gz WWBKRSSQDAUZNW-GLJUWKHASA-N 2 1 377.330 3.453 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000447571057 566417062 /nfs/dbraw/zinc/41/70/62/566417062.db2.gz WWBKRSSQDAUZNW-GLJUWKHASA-N 2 1 377.330 3.453 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000447571058 566417199 /nfs/dbraw/zinc/41/71/99/566417199.db2.gz WWBKRSSQDAUZNW-HBUWYVDXSA-N 2 1 377.330 3.453 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000447571058 566417208 /nfs/dbraw/zinc/41/72/08/566417208.db2.gz WWBKRSSQDAUZNW-HBUWYVDXSA-N 2 1 377.330 3.453 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCCCN2CC[NH+](C)CC2)c(Br)c1 ZINC000537295765 566437158 /nfs/dbraw/zinc/43/71/58/566437158.db2.gz NHAIHGUDJWPIJY-OAHLLOKOSA-N 2 1 384.362 3.136 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCCCN2CC[NH+](C)CC2)c(Br)c1 ZINC000537295759 566437386 /nfs/dbraw/zinc/43/73/86/566437386.db2.gz NHAIHGUDJWPIJY-HNNXBMFYSA-N 2 1 384.362 3.136 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000537344803 566439531 /nfs/dbraw/zinc/43/95/31/566439531.db2.gz SMOISXSRBSIJRR-UHFFFAOYSA-N 2 1 375.314 3.295 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]CCn2cc(Br)cn2)CC[N@@H+]1Cc1ccccc1 ZINC000671769589 566449162 /nfs/dbraw/zinc/44/91/62/566449162.db2.gz JRIVIIWNRTVOJB-QAPCUYQASA-N 2 1 377.330 3.288 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]CCn2cc(Br)cn2)CC[N@H+]1Cc1ccccc1 ZINC000671769589 566449166 /nfs/dbraw/zinc/44/91/66/566449166.db2.gz JRIVIIWNRTVOJB-QAPCUYQASA-N 2 1 377.330 3.288 20 0 GGADMP Fc1cc(Br)ccc1CCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1 ZINC000484778320 566453179 /nfs/dbraw/zinc/45/31/79/566453179.db2.gz SPEPBORSYFPBGH-JQHSSLGASA-N 2 1 385.321 3.268 20 0 GGADMP C[C@@H]1C[C@@H](C)[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)C[C@H]1C[NH3+] ZINC000422637624 566460699 /nfs/dbraw/zinc/46/06/99/566460699.db2.gz PCNQSYUNNQDVLS-JHJVBQTASA-N 2 1 386.309 3.222 20 0 GGADMP C[C@H]([NH3+])C[C@H](C)NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000577749118 566461321 /nfs/dbraw/zinc/46/13/21/566461321.db2.gz MIGCLODPDQEVPV-STQMWFEESA-N 2 1 387.355 3.383 20 0 GGADMP Brc1ccc2nc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)cn2c1 ZINC000422732566 566462439 /nfs/dbraw/zinc/46/24/39/566462439.db2.gz PBYOVHZFRRXVEY-IXDOHACOSA-N 2 1 377.330 3.497 20 0 GGADMP Brc1ccc2nc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)cn2c1 ZINC000422732567 566462884 /nfs/dbraw/zinc/46/28/84/566462884.db2.gz PBYOVHZFRRXVEY-YESZJQIVSA-N 2 1 377.330 3.497 20 0 GGADMP COc1cc(Br)c(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422945133 566467351 /nfs/dbraw/zinc/46/73/51/566467351.db2.gz MOXHQBUPNJOXNY-NSHDSACASA-N 2 1 394.313 3.479 20 0 GGADMP Cc1cc(Br)cn2cc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)nc12 ZINC000423042261 566470708 /nfs/dbraw/zinc/47/07/08/566470708.db2.gz YVVGXTSDHPUZST-IXDOHACOSA-N 2 1 377.330 3.416 20 0 GGADMP C[C@H]([NH3+])[C@H]1COCC[C@H]1[NH2+]Cc1cc(Br)ccc1Br ZINC000423051248 566471212 /nfs/dbraw/zinc/47/12/12/566471212.db2.gz MTNRRCLSDPGNOC-MRCXROJRSA-N 2 1 392.135 3.054 20 0 GGADMP Cc1cc(Br)cn2cc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)nc12 ZINC000423042260 566471698 /nfs/dbraw/zinc/47/16/98/566471698.db2.gz YVVGXTSDHPUZST-GVDBMIGSSA-N 2 1 377.330 3.416 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000650707710 566471875 /nfs/dbraw/zinc/47/18/75/566471875.db2.gz LOIRTVFTZRODRC-HWWQOWPSSA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000650707710 566471882 /nfs/dbraw/zinc/47/18/82/566471882.db2.gz LOIRTVFTZRODRC-HWWQOWPSSA-N 2 1 389.284 3.446 20 0 GGADMP COc1ccc(Br)cc1C[N@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000650705340 566471975 /nfs/dbraw/zinc/47/19/75/566471975.db2.gz DZLGBKFEJXRSDD-QANKJYHBSA-N 2 1 383.330 3.176 20 0 GGADMP COc1ccc(Br)c(C[N@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c1 ZINC000650707416 566471989 /nfs/dbraw/zinc/47/19/89/566471989.db2.gz FJRAPMKSKWXUNO-JOQOYGCGSA-N 2 1 383.330 3.176 20 0 GGADMP COc1sc(C[N@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)cc1Br ZINC000650708055 566472112 /nfs/dbraw/zinc/47/21/12/566472112.db2.gz SQIKEQYGMKDVHV-ZOWXZIJZSA-N 2 1 389.359 3.238 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000650707711 566472447 /nfs/dbraw/zinc/47/24/47/566472447.db2.gz LOIRTVFTZRODRC-OZVIIMIRSA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000650707711 566472453 /nfs/dbraw/zinc/47/24/53/566472453.db2.gz LOIRTVFTZRODRC-OZVIIMIRSA-N 2 1 389.284 3.446 20 0 GGADMP C[N@H+](C[C@@H](O)C[NH+]1CCC(C)(c2ccc(Br)cc2)CC1)C1CC1 ZINC000558467180 566476549 /nfs/dbraw/zinc/47/65/49/566476549.db2.gz UUJZOVKMHSHENF-GOSISDBHSA-N 2 1 381.358 3.258 20 0 GGADMP C[N@@H+](C[C@@H](O)C[NH+]1CCC(C)(c2ccc(Br)cc2)CC1)C1CC1 ZINC000558467180 566476556 /nfs/dbraw/zinc/47/65/56/566476556.db2.gz UUJZOVKMHSHENF-GOSISDBHSA-N 2 1 381.358 3.258 20 0 GGADMP CC[N@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)Cc1cccc(Br)c1 ZINC000511644085 566478990 /nfs/dbraw/zinc/47/89/90/566478990.db2.gz ZULUEULSKNMSFX-UHFFFAOYSA-N 2 1 396.373 3.260 20 0 GGADMP CC[N@@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)Cc1cccc(Br)c1 ZINC000511644085 566478991 /nfs/dbraw/zinc/47/89/91/566478991.db2.gz ZULUEULSKNMSFX-UHFFFAOYSA-N 2 1 396.373 3.260 20 0 GGADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H](CO)Cc2cc(F)cc(Br)c2)c2ccccc21 ZINC000423173732 566480410 /nfs/dbraw/zinc/48/04/10/566480410.db2.gz ZVITZDPRAXYEEU-MJXNMMHHSA-N 2 1 393.300 3.474 20 0 GGADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H](CO)Cc2cc(Br)ccc2F)c2ccccc21 ZINC000423161433 566481135 /nfs/dbraw/zinc/48/11/35/566481135.db2.gz NVGMPOPIYLOZMF-DPMMWBKBSA-N 2 1 393.300 3.474 20 0 GGADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCOc3ccc(I)cc32)CC[NH2+]1 ZINC000423381313 566485843 /nfs/dbraw/zinc/48/58/43/566485843.db2.gz OJJRERSDHBPVST-UXIGCNINSA-N 2 1 386.277 3.235 20 0 GGADMP COC[C@]1(C[NH2+][C@H](c2cccc(Br)c2)C2CCOCC2)CCC[NH2+]1 ZINC000423413375 566487728 /nfs/dbraw/zinc/48/77/28/566487728.db2.gz KBHJJFMPAAWFMS-RBUKOAKNSA-N 2 1 397.357 3.275 20 0 GGADMP Ic1ccc2c(c1)[C@@H]([NH2+]CCC[NH2+]C1CC1)CCCO2 ZINC000423528025 566492003 /nfs/dbraw/zinc/49/20/03/566492003.db2.gz NISSUBCRHUUXNA-HNNXBMFYSA-N 2 1 386.277 3.237 20 0 GGADMP COc1ccc(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(Br)c1 ZINC000512041140 566508836 /nfs/dbraw/zinc/50/88/36/566508836.db2.gz SKGMJUXYPCEKCF-GASCZTMLSA-N 2 1 385.346 3.437 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1)Nc1cccc(Br)c1 ZINC000578324110 566512422 /nfs/dbraw/zinc/51/24/22/566512422.db2.gz RKZJRYXCHUKPAR-HUUCEWRRSA-N 2 1 380.330 3.099 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1)Nc1cccc(Br)c1 ZINC000578324111 566513059 /nfs/dbraw/zinc/51/30/59/566513059.db2.gz RKZJRYXCHUKPAR-LSDHHAIUSA-N 2 1 380.330 3.099 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ncc(I)s1 ZINC000512144340 566516644 /nfs/dbraw/zinc/51/66/44/566516644.db2.gz JVLBUADYOQZFKL-GFCCVEGCSA-N 2 1 393.338 3.492 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cc(O)ccc3Br)CC2)C[C@@H](C)O1 ZINC000512177881 566519159 /nfs/dbraw/zinc/51/91/59/566519159.db2.gz GUCYTSHFQCBGKM-HUUCEWRRSA-N 2 1 397.357 3.476 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1CCC(=O)Nc1cccc(Br)c1)CC[NH2+]CC2 ZINC000424288669 566525555 /nfs/dbraw/zinc/52/55/55/566525555.db2.gz KXHKWWXWZMWTTH-CQSZACIVSA-N 2 1 380.330 3.242 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424297535 566527228 /nfs/dbraw/zinc/52/72/28/566527228.db2.gz SVZCBQOOXMZIOG-AWEZNQCLSA-N 2 1 380.330 3.160 20 0 GGADMP Cc1cc(Br)cn2c(C[N@@H+]3CC4(C[C@H]3C)CC[NH2+]CC4)cnc12 ZINC000424380552 566530931 /nfs/dbraw/zinc/53/09/31/566530931.db2.gz PXTWRJOZLIMIFN-CQSZACIVSA-N 2 1 377.330 3.369 20 0 GGADMP Cc1cc(C[N@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)ccc1Br ZINC000538762628 566533210 /nfs/dbraw/zinc/53/32/10/566533210.db2.gz ZVSSHJNHTFPJSZ-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP Cc1cc(C[N@@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)ccc1Br ZINC000538762628 566533214 /nfs/dbraw/zinc/53/32/14/566533214.db2.gz ZVSSHJNHTFPJSZ-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2ccc(OC)c(Br)c2)C1 ZINC000538751388 566533867 /nfs/dbraw/zinc/53/38/67/566533867.db2.gz JKWDQIQKBMECPP-INIZCTEOSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2ccc(OC)c(Br)c2)C1 ZINC000538751388 566533872 /nfs/dbraw/zinc/53/38/72/566533872.db2.gz JKWDQIQKBMECPP-INIZCTEOSA-N 2 1 385.346 3.390 20 0 GGADMP COc1ccc(Br)c(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c1 ZINC000512457577 566536687 /nfs/dbraw/zinc/53/66/87/566536687.db2.gz USXUOIYKWDNBEO-UHFFFAOYSA-N 2 1 397.357 3.392 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]C2CC(c3ccc(Br)cc3F)C2)CC1(C)C ZINC000449305176 566546469 /nfs/dbraw/zinc/54/64/69/566546469.db2.gz RISVQAWJKYDQRI-UHFFFAOYSA-N 2 1 398.364 3.450 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1ccnc2c(Br)cccc12 ZINC000449324490 566547854 /nfs/dbraw/zinc/54/78/54/566547854.db2.gz FYWMVHMVQSFSIE-UHFFFAOYSA-N 2 1 391.357 3.067 20 0 GGADMP Brc1cc2c(cc1CN1CCC[C@H](c3ncc[nH]3)C1)OCCO2 ZINC000673712070 566552709 /nfs/dbraw/zinc/55/27/09/566552709.db2.gz NLVQIXUCWDSHPH-LBPRGKRZSA-N 2 1 378.270 3.323 20 0 GGADMP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCn3cc(Br)ccc3=O)CC2)C1 ZINC000449380547 566555683 /nfs/dbraw/zinc/55/56/83/566555683.db2.gz WILPNFWJFIDXTA-MAUKXSAKSA-N 2 1 396.373 3.244 20 0 GGADMP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCn2cc(Br)ccc2=O)CC1 ZINC000449379566 566555990 /nfs/dbraw/zinc/55/59/90/566555990.db2.gz TXFZBKHECUQYQW-YJBOKZPZSA-N 2 1 396.373 3.244 20 0 GGADMP CC(C)[N@@H+]1CCc2nc(C[NH2+]C3CCN(c4nccs4)CC3)sc2C1 ZINC000466421236 566574815 /nfs/dbraw/zinc/57/48/15/566574815.db2.gz KCKAUMURYBAYKE-UHFFFAOYSA-N 2 1 377.583 3.125 20 0 GGADMP CC(C)[N@H+]1CCc2nc(C[NH2+]C3CCN(c4nccs4)CC3)sc2C1 ZINC000466421236 566574822 /nfs/dbraw/zinc/57/48/22/566574822.db2.gz KCKAUMURYBAYKE-UHFFFAOYSA-N 2 1 377.583 3.125 20 0 GGADMP COCC[NH+]1CCC([NH2+]CCc2ccc(Br)cc2Cl)CC1 ZINC000559918311 566576706 /nfs/dbraw/zinc/57/67/06/566576706.db2.gz UMWCRRUMSZVBQP-UHFFFAOYSA-N 2 1 375.738 3.345 20 0 GGADMP Cc1c(Br)cccc1C[C@@H](CO)C[NH2+]Cc1c[nH+]ccc1N(C)C ZINC000449681520 566590658 /nfs/dbraw/zinc/59/06/58/566590658.db2.gz JJWYGSCOJHDDER-OAHLLOKOSA-N 2 1 392.341 3.159 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2ccc(F)c(Br)c2)[C@H](C)C1 ZINC000449680470 566591147 /nfs/dbraw/zinc/59/11/47/566591147.db2.gz HAYUSDKBWWSBRS-XUWXXGDYSA-N 2 1 387.337 3.059 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2ccc(F)c(Br)c2)[C@H](C)C1 ZINC000449680468 566591228 /nfs/dbraw/zinc/59/12/28/566591228.db2.gz HAYUSDKBWWSBRS-SIIHOXLZSA-N 2 1 387.337 3.059 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000449684991 566592740 /nfs/dbraw/zinc/59/27/40/566592740.db2.gz QSAIBONAXIDRFN-SZMVWBNQSA-N 2 1 381.358 3.125 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](CC(=O)Nc3cccc(Cl)c3Cl)C2)C1 ZINC000652345757 566603066 /nfs/dbraw/zinc/60/30/66/566603066.db2.gz LCURQVWBZDVJMU-ZENOOKHLSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](CC(=O)Nc3cccc(Cl)c3Cl)C2)C1 ZINC000652345757 566603070 /nfs/dbraw/zinc/60/30/70/566603070.db2.gz LCURQVWBZDVJMU-ZENOOKHLSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](CCOc3cccc(Br)c3)C2)C1 ZINC000652349414 566603725 /nfs/dbraw/zinc/60/37/25/566603725.db2.gz OJUHWLASINSCRC-KYJSFNMBSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](CCOc3ccccc3Br)C2)C1 ZINC000652349174 566603750 /nfs/dbraw/zinc/60/37/50/566603750.db2.gz DUILNJOYBQQDST-HDMKZQKVSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](CC(=O)Nc3cccc(Cl)c3Cl)C2)C1 ZINC000652345756 566603865 /nfs/dbraw/zinc/60/38/65/566603865.db2.gz LCURQVWBZDVJMU-XJKCOSOUSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](CC(=O)Nc3cccc(Cl)c3Cl)C2)C1 ZINC000652345756 566603868 /nfs/dbraw/zinc/60/38/68/566603868.db2.gz LCURQVWBZDVJMU-XJKCOSOUSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](CCOc3ccc(Br)cc3)C2)C1 ZINC000652345983 566603932 /nfs/dbraw/zinc/60/39/32/566603932.db2.gz QKMNAKALSVENQR-YXJHDRRASA-N 2 1 383.330 3.046 20 0 GGADMP C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)[C@H]1CC[NH3+] ZINC000652353993 566605644 /nfs/dbraw/zinc/60/56/44/566605644.db2.gz KARKIISMXPDGRG-LRDDRELGSA-N 2 1 386.309 3.366 20 0 GGADMP C[NH+]1CCN(CCCC[NH2+]Cc2cc3cc(Br)ccc3o2)CC1 ZINC000579495902 566614254 /nfs/dbraw/zinc/61/42/54/566614254.db2.gz QIZNSNFYQNSSNI-UHFFFAOYSA-N 2 1 380.330 3.313 20 0 GGADMP COc1cc2[nH+]ccc(N[C@@H]3CC[N@H+]4CCC[C@@H]4C3)c2cc1Br ZINC000425209606 566617560 /nfs/dbraw/zinc/61/75/60/566617560.db2.gz SDDIRRBVDHSJMC-CHWSQXEVSA-N 2 1 376.298 3.467 20 0 GGADMP COc1cc2[nH+]ccc(NCCCn3cc[nH+]c3C)c2cc1Br ZINC000425238700 566621702 /nfs/dbraw/zinc/62/17/02/566621702.db2.gz VGYVNUCWRJKADU-UHFFFAOYSA-N 2 1 375.270 3.435 20 0 GGADMP CN(C)c1ncc(C[N@H+]2CCC[C@@H](Nc3cccc(Br)c3)C2)n1C ZINC000425333682 566631620 /nfs/dbraw/zinc/63/16/20/566631620.db2.gz FJEBDPJRRHIVSU-MRXNPFEDSA-N 2 1 392.345 3.325 20 0 GGADMP CN(C)c1ncc(CN2CCC[C@@H](Nc3cccc(Br)c3)C2)n1C ZINC000425333682 566631623 /nfs/dbraw/zinc/63/16/23/566631623.db2.gz FJEBDPJRRHIVSU-MRXNPFEDSA-N 2 1 392.345 3.325 20 0 GGADMP C[NH+]1CCN(C(=O)CC[NH2+][C@@H](c2ccc(Br)cc2)C2CCC2)CC1 ZINC000514127613 566645272 /nfs/dbraw/zinc/64/52/72/566645272.db2.gz XDHMDWQNCJIGRI-LJQANCHMSA-N 2 1 394.357 3.044 20 0 GGADMP C[NH+]1CCN(C(=O)CC[NH2+][C@H](c2ccc(Br)cc2)C2CCC2)CC1 ZINC000514127612 566645636 /nfs/dbraw/zinc/64/56/36/566645636.db2.gz XDHMDWQNCJIGRI-IBGZPJMESA-N 2 1 394.357 3.044 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc2c(cc1Br)OCCO2 ZINC000540373967 566648648 /nfs/dbraw/zinc/64/86/48/566648648.db2.gz BNODHGUOFCGKDU-GFCCVEGCSA-N 2 1 380.286 3.466 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000580040287 566660035 /nfs/dbraw/zinc/66/00/35/566660035.db2.gz RBCLPDBYMHODOV-MRXNPFEDSA-N 2 1 390.380 3.154 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000580040286 566660294 /nfs/dbraw/zinc/66/02/94/566660294.db2.gz RBCLPDBYMHODOV-INIZCTEOSA-N 2 1 390.380 3.154 20 0 GGADMP C[NH+]1CCN([C@@H](C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c2cccs2)CC1 ZINC000675723831 566661366 /nfs/dbraw/zinc/66/13/66/566661366.db2.gz BFZTUTCFECWWCP-MOPGFXCFSA-N 2 1 375.969 3.447 20 0 GGADMP C[NH+]1CCN([C@H](C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c2cccs2)CC1 ZINC000675723841 566661417 /nfs/dbraw/zinc/66/14/17/566661417.db2.gz BFZTUTCFECWWCP-RTBURBONSA-N 2 1 375.969 3.447 20 0 GGADMP Clc1cc(Cl)cc(-c2nc(C[N@@H+]3CC[C@@H](N4CC[NH2+]CC4)C3)co2)c1 ZINC000629539453 566664104 /nfs/dbraw/zinc/66/41/04/566664104.db2.gz XXFBGQKRNOTWQV-QGZVFWFLSA-N 2 1 381.307 3.128 20 0 GGADMP Clc1cc(Cl)cc(-c2nc(C[N@H+]3CC[C@@H](N4CC[NH2+]CC4)C3)co2)c1 ZINC000629539453 566664113 /nfs/dbraw/zinc/66/41/13/566664113.db2.gz XXFBGQKRNOTWQV-QGZVFWFLSA-N 2 1 381.307 3.128 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCc2cccc(Br)c2C1 ZINC000580087761 566664722 /nfs/dbraw/zinc/66/47/22/566664722.db2.gz ABOUXRJYOMVQSP-SJORKVTESA-N 2 1 381.358 3.133 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](CCOc2cccc(Br)c2)CC[C@H]1C(F)(F)F ZINC000629562510 566666012 /nfs/dbraw/zinc/66/60/12/566666012.db2.gz NQTJZHQHEJFOKC-SMDDNHRTSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCOc2cccc(Br)c2)CC[C@H]1C(F)(F)F ZINC000629562510 566666016 /nfs/dbraw/zinc/66/60/16/566666016.db2.gz NQTJZHQHEJFOKC-SMDDNHRTSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+](CCOc2ccc(Br)cc2)CC[C@H]1C(F)(F)F ZINC000629568156 566666382 /nfs/dbraw/zinc/66/63/82/566666382.db2.gz RUEBHZDREAMORG-BXUZGUMPSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCOc2ccc(Br)cc2)CC[C@H]1C(F)(F)F ZINC000629568156 566666384 /nfs/dbraw/zinc/66/63/84/566666384.db2.gz RUEBHZDREAMORG-BXUZGUMPSA-N 2 1 381.236 3.287 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc(Br)c1 ZINC000467865019 566671948 /nfs/dbraw/zinc/67/19/48/566671948.db2.gz PTXUGIFWPRVNFL-AWEZNQCLSA-N 2 1 382.346 3.042 20 0 GGADMP O[C@@H]1CCCC[C@@H]1C[N@@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000580198018 566673057 /nfs/dbraw/zinc/67/30/57/566673057.db2.gz OBMMKGMXPJOJHH-GDBMZVCRSA-N 2 1 382.302 3.292 20 0 GGADMP C[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(Br)cn1 ZINC000676064161 566674110 /nfs/dbraw/zinc/67/41/10/566674110.db2.gz FKUUMGCBJYUWOV-AWEZNQCLSA-N 2 1 393.329 3.420 20 0 GGADMP C[C@@H](C[NH2+][C@@H]1CCCOc2ccc(I)cc21)C[NH+](C)C ZINC000425927762 566682798 /nfs/dbraw/zinc/68/27/98/566682798.db2.gz UMDQULXWYITMFQ-SWLSCSKDSA-N 2 1 388.293 3.292 20 0 GGADMP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](CC(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000561283680 566690354 /nfs/dbraw/zinc/69/03/54/566690354.db2.gz VKXYGGLNZSXKBZ-SUMWQHHRSA-N 2 1 386.323 3.150 20 0 GGADMP O[C@H]1CCC[C@H]1[NH+]1CCN(c2cc[nH+]c3cc(Br)ccc32)CC1 ZINC000608014028 566690585 /nfs/dbraw/zinc/69/05/85/566690585.db2.gz BSBNKMHFHWJPRR-MSOLQXFVSA-N 2 1 376.298 3.033 20 0 GGADMP C[NH+](C)CCC1CC[NH+](Cc2cn(-c3ccccc3Br)nn2)CC1 ZINC000580504220 566697896 /nfs/dbraw/zinc/69/78/96/566697896.db2.gz MTXJEFVTXUQOJM-UHFFFAOYSA-N 2 1 392.345 3.194 20 0 GGADMP C[NH+]1CCC(Oc2ccc(CNc3cc[nH+]cc3Br)cc2)CC1 ZINC000561351351 566698629 /nfs/dbraw/zinc/69/86/29/566698629.db2.gz KFVMZYFKKCFDJJ-UHFFFAOYSA-N 2 1 376.298 3.351 20 0 GGADMP Cc1c(Br)cccc1C(=O)Nc1c[nH+]ccc1N1CC[NH+](C)CC1 ZINC000608117189 566703985 /nfs/dbraw/zinc/70/39/85/566703985.db2.gz NOEDWOFCRFMBDD-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000580646596 566712591 /nfs/dbraw/zinc/71/25/91/566712591.db2.gz OBAMGVWUEGNACY-ARFHVFGLSA-N 2 1 394.357 3.406 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000580646596 566712596 /nfs/dbraw/zinc/71/25/96/566712596.db2.gz OBAMGVWUEGNACY-ARFHVFGLSA-N 2 1 394.357 3.406 20 0 GGADMP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000468619216 566716149 /nfs/dbraw/zinc/71/61/49/566716149.db2.gz LNTVZLOIMFTCKC-LJQANCHMSA-N 2 1 391.309 3.398 20 0 GGADMP C[N@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000468619216 566716151 /nfs/dbraw/zinc/71/61/51/566716151.db2.gz LNTVZLOIMFTCKC-LJQANCHMSA-N 2 1 391.309 3.398 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@@H](C[NH3+])C2(C1)CCOCC2 ZINC000580774761 566721453 /nfs/dbraw/zinc/72/14/53/566721453.db2.gz MALUBYVFERJFKS-QWHCGFSZSA-N 2 1 386.323 3.008 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@@H](C[NH3+])C2(C1)CCOCC2 ZINC000580774761 566721458 /nfs/dbraw/zinc/72/14/58/566721458.db2.gz MALUBYVFERJFKS-QWHCGFSZSA-N 2 1 386.323 3.008 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000608507944 566722084 /nfs/dbraw/zinc/72/20/84/566722084.db2.gz HDXFSWZQYLDZAQ-CABCVRRESA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000608507944 566722088 /nfs/dbraw/zinc/72/20/88/566722088.db2.gz HDXFSWZQYLDZAQ-CABCVRRESA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000608507946 566722357 /nfs/dbraw/zinc/72/23/57/566722357.db2.gz HDXFSWZQYLDZAQ-HUUCEWRRSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000608507946 566722359 /nfs/dbraw/zinc/72/23/59/566722359.db2.gz HDXFSWZQYLDZAQ-HUUCEWRRSA-N 2 1 375.340 3.397 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000468864021 566739041 /nfs/dbraw/zinc/73/90/41/566739041.db2.gz GMFJXONPECZMQM-ARFHVFGLSA-N 2 1 383.989 3.380 20 0 GGADMP CC[C@H]1[NH2+]CC[C@@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000581130574 566752183 /nfs/dbraw/zinc/75/21/83/566752183.db2.gz RHNWQEVPQBBXRX-ZWKOTPCHSA-N 2 1 384.351 3.462 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccnc(-c4ccc(Br)cc4)n3)C[C@@H]21 ZINC000581251703 566761864 /nfs/dbraw/zinc/76/18/64/566761864.db2.gz GEADLVIKOWKJMT-JCGIZDLHSA-N 2 1 387.325 3.465 20 0 GGADMP C[N@@H+](Cc1cc(F)cc(Br)c1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000677801617 566763389 /nfs/dbraw/zinc/76/33/89/566763389.db2.gz XOWAZFMFCSJKIY-SFHVURJKSA-N 2 1 384.337 3.189 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C[C@H](O)COc2ccc(Br)cc2)C1 ZINC000581364941 566771735 /nfs/dbraw/zinc/77/17/35/566771735.db2.gz URZJNJLFKXJIGU-AEFFLSMTSA-N 2 1 399.373 3.291 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](CCC[NH2+][C@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000581523639 566784794 /nfs/dbraw/zinc/78/47/94/566784794.db2.gz KCTLDZCRPYJNPM-PBHICJAKSA-N 2 1 381.973 3.444 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+][C@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000581523639 566784797 /nfs/dbraw/zinc/78/47/97/566784797.db2.gz KCTLDZCRPYJNPM-PBHICJAKSA-N 2 1 381.973 3.444 20 0 GGADMP COc1cc(C[NH+]2CCC(C[NH3+])CC2)cc(Br)c1OC(F)F ZINC000469837285 566818314 /nfs/dbraw/zinc/81/83/14/566818314.db2.gz YIASSLRBIOCTMY-UHFFFAOYSA-N 2 1 379.245 3.230 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cc(Br)c4c(c3)OCCCO4)C[C@@H]21 ZINC000469873613 566823175 /nfs/dbraw/zinc/82/31/75/566823175.db2.gz NLCKGEKNPLLELR-IJEWVQPXSA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3cc(Br)c4c(c3)OCCCO4)C[C@@H]21 ZINC000469873613 566823181 /nfs/dbraw/zinc/82/31/81/566823181.db2.gz NLCKGEKNPLLELR-IJEWVQPXSA-N 2 1 381.314 3.170 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000469874315 566823577 /nfs/dbraw/zinc/82/35/77/566823577.db2.gz QCCLHHDHXVJHSC-DOPJRALCSA-N 2 1 375.314 3.112 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cc(Br)c4c(c3)OCCCO4)C[C@H]21 ZINC000469873618 566823604 /nfs/dbraw/zinc/82/36/04/566823604.db2.gz NLCKGEKNPLLELR-SQWLQELKSA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3cc(Br)c4c(c3)OCCCO4)C[C@H]21 ZINC000469873618 566823611 /nfs/dbraw/zinc/82/36/11/566823611.db2.gz NLCKGEKNPLLELR-SQWLQELKSA-N 2 1 381.314 3.170 20 0 GGADMP CCOc1c(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)cc1OC ZINC000469888309 566824958 /nfs/dbraw/zinc/82/49/58/566824958.db2.gz KIAIRVPZRPAADW-OFQRWUPVSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1c(Br)cc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)cc1OC ZINC000469888309 566824963 /nfs/dbraw/zinc/82/49/63/566824963.db2.gz KIAIRVPZRPAADW-OFQRWUPVSA-N 2 1 383.330 3.416 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3cnn(-c4ccc(Br)cc4)c3)C[C@H]21 ZINC000469891051 566825407 /nfs/dbraw/zinc/82/54/07/566825407.db2.gz VAMTURZWSWCTEX-BMGDILEWSA-N 2 1 375.314 3.194 20 0 GGADMP [NH3+]CCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000469995333 566835417 /nfs/dbraw/zinc/83/54/17/566835417.db2.gz YYSPVVKBMXHLTB-AWEZNQCLSA-N 2 1 377.941 3.355 20 0 GGADMP Fc1ccc(CC[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1Br ZINC000655702511 566837075 /nfs/dbraw/zinc/83/70/75/566837075.db2.gz ZOBJESURMCCTRJ-MRXNPFEDSA-N 2 1 385.321 3.364 20 0 GGADMP CC[NH2+]CC1CC[NH+](Cc2cc(Br)c3c(c2)OCCCO3)CC1 ZINC000470001862 566837266 /nfs/dbraw/zinc/83/72/66/566837266.db2.gz DWJRNRNSAWVVIP-UHFFFAOYSA-N 2 1 383.330 3.432 20 0 GGADMP Fc1cc(Br)ccc1CCC[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655716658 566837715 /nfs/dbraw/zinc/83/77/15/566837715.db2.gz WPUFUBZHERONMN-QGZVFWFLSA-N 2 1 385.321 3.364 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)Oc1cccc(Br)c1 ZINC000655719846 566838047 /nfs/dbraw/zinc/83/80/47/566838047.db2.gz YTIWKQUSYBITFB-KXBFYZLASA-N 2 1 397.357 3.449 20 0 GGADMP Cc1cc(Br)cn2c(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)cnc12 ZINC000470014092 566838742 /nfs/dbraw/zinc/83/87/42/566838742.db2.gz UVVIKRZKZWWJJV-QGZVFWFLSA-N 2 1 377.330 3.369 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)Oc1ccccc1Br ZINC000655719345 566838767 /nfs/dbraw/zinc/83/87/67/566838767.db2.gz RPYJEGGCRWHYNW-WBVHZDCISA-N 2 1 397.357 3.449 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)Oc1ccc(Br)cc1 ZINC000655719531 566838972 /nfs/dbraw/zinc/83/89/72/566838972.db2.gz VDABOICLEJXXQI-WMLDXEAASA-N 2 1 383.330 3.059 20 0 GGADMP Brc1ccc(OCC[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000655725430 566840763 /nfs/dbraw/zinc/84/07/63/566840763.db2.gz TWIUQINKIQIDKU-GOSISDBHSA-N 2 1 383.330 3.061 20 0 GGADMP Brc1cccc(NCC[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)c1 ZINC000655750468 566843748 /nfs/dbraw/zinc/84/37/48/566843748.db2.gz BEPIZQBMASURNQ-GOSISDBHSA-N 2 1 382.346 3.094 20 0 GGADMP Brc1cc(C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc2c1OCCO2 ZINC000563135791 566858527 /nfs/dbraw/zinc/85/85/27/566858527.db2.gz UJZQXEQESCFHSS-CABCVRRESA-N 2 1 381.314 3.042 20 0 GGADMP O=C1[C@H]([N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)CCN1c1ccc(Cl)cc1Cl ZINC000563155023 566860107 /nfs/dbraw/zinc/86/01/07/566860107.db2.gz XYCKYNRIRKXCLJ-SUNYJGFJSA-N 2 1 382.335 3.420 20 0 GGADMP CC(C)[C@@](C)([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000563464165 566885876 /nfs/dbraw/zinc/88/58/76/566885876.db2.gz NWRNHPNYOFHWDZ-LJQANCHMSA-N 2 1 396.373 3.074 20 0 GGADMP CC[C@H]1[NH2+]CC[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000518528219 566889379 /nfs/dbraw/zinc/88/93/79/566889379.db2.gz SEPKPBRKJUOILC-CRAIPNDOSA-N 2 1 384.351 3.462 20 0 GGADMP CC[C@@H]1[NH2+]CC[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000518528221 566890336 /nfs/dbraw/zinc/89/03/36/566890336.db2.gz SEPKPBRKJUOILC-QAPCUYQASA-N 2 1 384.351 3.462 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cncc(Br)c1 ZINC000518566015 566891998 /nfs/dbraw/zinc/89/19/98/566891998.db2.gz WLHJOUAYGYVIDD-AUUYWEPGSA-N 2 1 390.325 3.262 20 0 GGADMP C[NH+](C)CCCNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000680260932 566900910 /nfs/dbraw/zinc/90/09/10/566900910.db2.gz DVAHTGJQKAFTPB-UHFFFAOYSA-N 2 1 387.355 3.209 20 0 GGADMP O=C(NC[C@@H]1CCC[NH2+]1)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000518940459 566911429 /nfs/dbraw/zinc/91/14/29/566911429.db2.gz OMZPWIGPPAQPDQ-KRWDZBQOSA-N 2 1 385.339 3.009 20 0 GGADMP COc1cc(C[NH2+]C[C@H](C)C[NH+](C)C)cc(Br)c1OC(F)F ZINC000491589117 566911461 /nfs/dbraw/zinc/91/14/61/566911461.db2.gz OARGEXHCMOCRGT-JTQLQIEISA-N 2 1 381.261 3.346 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+]2CC[C@H](Sc3cccc(Cl)c3)C2)CC1 ZINC000429164134 566912483 /nfs/dbraw/zinc/91/24/83/566912483.db2.gz PSHPBIYXJIPSCQ-SFHVURJKSA-N 2 1 381.973 3.107 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+]2CC[C@H](Sc3cccc(Cl)c3)C2)CC1 ZINC000429164134 566912486 /nfs/dbraw/zinc/91/24/86/566912486.db2.gz PSHPBIYXJIPSCQ-SFHVURJKSA-N 2 1 381.973 3.107 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000470958585 566918684 /nfs/dbraw/zinc/91/86/84/566918684.db2.gz LAQCUGHINVUINY-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000470958585 566918690 /nfs/dbraw/zinc/91/86/90/566918690.db2.gz LAQCUGHINVUINY-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C(C[NH+]1CCC[C@@]2(CCSC2)C1)OCC[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451986416 566918750 /nfs/dbraw/zinc/91/87/50/566918750.db2.gz XNUHOLVPIDHEHG-WOJBJXKFSA-N 2 1 384.655 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000470958585 566918699 /nfs/dbraw/zinc/91/86/99/566918699.db2.gz LAQCUGHINVUINY-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C[C@@H](NCc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(Br)cn1 ZINC000583178965 566926604 /nfs/dbraw/zinc/92/66/04/566926604.db2.gz WHGCUJCJQRBJAS-RDTXWAMCSA-N 2 1 390.325 3.262 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(Br)cn1 ZINC000583178965 566926614 /nfs/dbraw/zinc/92/66/14/566926614.db2.gz WHGCUJCJQRBJAS-RDTXWAMCSA-N 2 1 390.325 3.262 20 0 GGADMP C[C@H](NCc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(Br)cn1 ZINC000583178962 566927038 /nfs/dbraw/zinc/92/70/38/566927038.db2.gz WHGCUJCJQRBJAS-KBXCAEBGSA-N 2 1 390.325 3.262 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(Br)cn1 ZINC000583178962 566927049 /nfs/dbraw/zinc/92/70/49/566927049.db2.gz WHGCUJCJQRBJAS-KBXCAEBGSA-N 2 1 390.325 3.262 20 0 GGADMP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCc3sc(Br)cc32)CC1 ZINC000583217369 566929745 /nfs/dbraw/zinc/92/97/45/566929745.db2.gz XWJZJHLHEUDLFK-RRFJBIMHSA-N 2 1 385.371 3.465 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](C[NH2+]C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000564078547 566943815 /nfs/dbraw/zinc/94/38/15/566943815.db2.gz SSKXILIFPSBFAQ-GDBMZVCRSA-N 2 1 375.340 3.301 20 0 GGADMP C[N@H+](C[C@@H](O)C[NH2+][C@H](Cc1cccc(Br)c1)CC1CC1)C1CC1 ZINC000583436702 566951121 /nfs/dbraw/zinc/95/11/21/566951121.db2.gz XIGZRBLBEWTQSU-HKUYNNGSSA-N 2 1 381.358 3.205 20 0 GGADMP C[N@@H+](C[C@@H](O)C[NH2+][C@H](Cc1cccc(Br)c1)CC1CC1)C1CC1 ZINC000583436702 566951123 /nfs/dbraw/zinc/95/11/23/566951123.db2.gz XIGZRBLBEWTQSU-HKUYNNGSSA-N 2 1 381.358 3.205 20 0 GGADMP C[N@H+](C[C@H](O)C[NH2+][C@H](Cc1cccc(Br)c1)CC1CC1)C1CC1 ZINC000583436705 566952044 /nfs/dbraw/zinc/95/20/44/566952044.db2.gz XIGZRBLBEWTQSU-PKOBYXMFSA-N 2 1 381.358 3.205 20 0 GGADMP C[N@@H+](C[C@H](O)C[NH2+][C@H](Cc1cccc(Br)c1)CC1CC1)C1CC1 ZINC000583436705 566952049 /nfs/dbraw/zinc/95/20/49/566952049.db2.gz XIGZRBLBEWTQSU-PKOBYXMFSA-N 2 1 381.358 3.205 20 0 GGADMP C[N@H+](C[C@@H](O)C[NH2+][C@@H](Cc1cccc(Br)c1)CC1CC1)C1CC1 ZINC000583436704 566952325 /nfs/dbraw/zinc/95/23/25/566952325.db2.gz XIGZRBLBEWTQSU-MJGOQNOKSA-N 2 1 381.358 3.205 20 0 GGADMP C[N@@H+](C[C@@H](O)C[NH2+][C@@H](Cc1cccc(Br)c1)CC1CC1)C1CC1 ZINC000583436704 566952328 /nfs/dbraw/zinc/95/23/28/566952328.db2.gz XIGZRBLBEWTQSU-MJGOQNOKSA-N 2 1 381.358 3.205 20 0 GGADMP Cc1cc(Br)cc2c1[C@@H]([NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1)CC2 ZINC000493892330 566958860 /nfs/dbraw/zinc/95/88/60/566958860.db2.gz VBNAFYDGFCDHIG-MSOLQXFVSA-N 2 1 381.358 3.427 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000564329425 566965629 /nfs/dbraw/zinc/96/56/29/566965629.db2.gz GRAKBFILXRZJNI-KGLIPLIRSA-N 2 1 398.320 3.238 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3c(F)cccc3Br)CC2)CC1 ZINC000544492528 566967175 /nfs/dbraw/zinc/96/71/75/566967175.db2.gz PSCVAUNXVLBNRO-UHFFFAOYSA-N 2 1 398.364 3.438 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)[C@](C)([NH3+])c1ccc(Br)cc1 ZINC000564892492 567018064 /nfs/dbraw/zinc/01/80/64/567018064.db2.gz YZTSKKVWVJCHLL-KBXCAEBGSA-N 2 1 382.346 3.004 20 0 GGADMP O=C(CC[NH+]1CCC([NH2+]CC2CC2)CC1)Nc1ccc(Br)cc1 ZINC000430548428 567021320 /nfs/dbraw/zinc/02/13/20/567021320.db2.gz WNQYMRDMYPXIFS-UHFFFAOYSA-N 2 1 380.330 3.242 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(OCCC[NH3+])CC1)c1ccc(Cl)c(Cl)c1 ZINC000430560998 567021561 /nfs/dbraw/zinc/02/15/61/567021561.db2.gz JJXYVCSGEAWGST-ZDUSSCGKSA-N 2 1 388.339 3.000 20 0 GGADMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000430579268 567022871 /nfs/dbraw/zinc/02/28/71/567022871.db2.gz CAQGUHRVEMSCEF-KBPBESRZSA-N 2 1 388.293 3.119 20 0 GGADMP [NH3+]CCCOC1CC[NH+](Cc2ncc(-c3ccc(Br)cc3)o2)CC1 ZINC000430588894 567023130 /nfs/dbraw/zinc/02/31/30/567023130.db2.gz AYINFZBNZZVLKH-UHFFFAOYSA-N 2 1 394.313 3.434 20 0 GGADMP CC[NH2+]CC1CC[NH+](Cc2nc(-c3ccc(Br)s3)no2)CC1 ZINC000430592252 567023634 /nfs/dbraw/zinc/02/36/34/567023634.db2.gz PWFTWRMGAFNKLI-UHFFFAOYSA-N 2 1 385.331 3.382 20 0 GGADMP [NH3+]CC1CC[NH+](CC(=O)Nc2ccc(Br)c(C(F)(F)F)c2)CC1 ZINC000430614625 567025688 /nfs/dbraw/zinc/02/56/88/567025688.db2.gz ZQLCQYWLRSASCS-UHFFFAOYSA-N 2 1 394.235 3.077 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Br)cc1)[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000564988731 567027258 /nfs/dbraw/zinc/02/72/58/567027258.db2.gz OSFCSYXZFCNQJL-RBSFLKMASA-N 2 1 380.330 3.098 20 0 GGADMP Cc1cc(NC(=O)C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)ccc1Br ZINC000564989599 567027911 /nfs/dbraw/zinc/02/79/11/567027911.db2.gz TXSUNQSHROUQDY-CABCVRRESA-N 2 1 380.330 3.018 20 0 GGADMP Cc1cc(NC(=O)C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)ccc1Br ZINC000564989601 567028372 /nfs/dbraw/zinc/02/83/72/567028372.db2.gz TXSUNQSHROUQDY-HUUCEWRRSA-N 2 1 380.330 3.018 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000472483214 567028575 /nfs/dbraw/zinc/02/85/75/567028575.db2.gz HKIHGFLEUDCCDG-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000472483214 567028577 /nfs/dbraw/zinc/02/85/77/567028577.db2.gz HKIHGFLEUDCCDG-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000472483214 567028579 /nfs/dbraw/zinc/02/85/79/567028579.db2.gz HKIHGFLEUDCCDG-INIZCTEOSA-N 2 1 394.357 3.441 20 0 GGADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492701 567029683 /nfs/dbraw/zinc/02/96/83/567029683.db2.gz CHZHYIDAMIRZGC-DOTOQJQBSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492701 567029692 /nfs/dbraw/zinc/02/96/92/567029692.db2.gz CHZHYIDAMIRZGC-DOTOQJQBSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492701 567029697 /nfs/dbraw/zinc/02/96/97/567029697.db2.gz CHZHYIDAMIRZGC-DOTOQJQBSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492701 567029706 /nfs/dbraw/zinc/02/97/06/567029706.db2.gz CHZHYIDAMIRZGC-DOTOQJQBSA-N 2 1 387.351 3.397 20 0 GGADMP C[C@H]([NH3+])CC(=O)N1CC[NH+](Cc2ccc(-c3ccccc3Cl)s2)CC1 ZINC000430701070 567030471 /nfs/dbraw/zinc/03/04/71/567030471.db2.gz CTCJTKSJTKLZIO-AWEZNQCLSA-N 2 1 377.941 3.450 20 0 GGADMP Cc1ccc(C[N@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Br ZINC000682085668 567030840 /nfs/dbraw/zinc/03/08/40/567030840.db2.gz KOCMEWWAGNGYSW-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cncc(Br)c2C)[C@H](C)C1 ZINC000657362343 567051336 /nfs/dbraw/zinc/05/13/36/567051336.db2.gz AJGGCYZRYGGOEO-KDOFPFPSSA-N 2 1 384.362 3.379 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cncc(Br)c2C)[C@H](C)C1 ZINC000657362343 567051344 /nfs/dbraw/zinc/05/13/44/567051344.db2.gz AJGGCYZRYGGOEO-KDOFPFPSSA-N 2 1 384.362 3.379 20 0 GGADMP Cc1c(Br)cncc1C[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1 ZINC000657398529 567054847 /nfs/dbraw/zinc/05/48/47/567054847.db2.gz CQGJOMRAJUQMCC-ROUUACIJSA-N 2 1 382.346 3.010 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000453106251 567054918 /nfs/dbraw/zinc/05/49/18/567054918.db2.gz YKIIIFQMEGEDGL-HXUWFJFHSA-N 2 1 394.401 3.387 20 0 GGADMP Cc1ncc(CN[C@H](C)c2ccc(Br)cc2OCCCO)n1C ZINC000657472273 567060285 /nfs/dbraw/zinc/06/02/85/567060285.db2.gz LGNTYUPRTHGSCE-GFCCVEGCSA-N 2 1 382.302 3.103 20 0 GGADMP C[C@@H](NCc1cnc2n1CCC2)c1ccc(Br)cc1OCCCO ZINC000657472261 567060515 /nfs/dbraw/zinc/06/05/15/567060515.db2.gz KZQGOHKANFNTBP-CYBMUJFWSA-N 2 1 394.313 3.204 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2ccc(OC)cc2Br)C1 ZINC000584687141 567061344 /nfs/dbraw/zinc/06/13/44/567061344.db2.gz JYSNXPOJIXGZBO-QGZVFWFLSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2ccc(OC)cc2Br)C1 ZINC000584687141 567061348 /nfs/dbraw/zinc/06/13/48/567061348.db2.gz JYSNXPOJIXGZBO-QGZVFWFLSA-N 2 1 385.346 3.390 20 0 GGADMP C[N@@H+]1CC[C@H]([NH2+]CCn2cc(Br)ccc2=O)C[C@H]1c1ccccc1 ZINC000453261729 567069597 /nfs/dbraw/zinc/06/95/97/567069597.db2.gz YWVCATBTASIRJC-ROUUACIJSA-N 2 1 390.325 3.036 20 0 GGADMP C[N@H+]1CC[C@H]([NH2+]CCn2cc(Br)ccc2=O)C[C@H]1c1ccccc1 ZINC000453261729 567069602 /nfs/dbraw/zinc/06/96/02/567069602.db2.gz YWVCATBTASIRJC-ROUUACIJSA-N 2 1 390.325 3.036 20 0 GGADMP C[N@@H+]1CC[C@H]([NH2+]CCn2cc(Br)ccc2=O)C[C@@H]1c1ccccc1 ZINC000453261732 567069867 /nfs/dbraw/zinc/06/98/67/567069867.db2.gz YWVCATBTASIRJC-ZWKOTPCHSA-N 2 1 390.325 3.036 20 0 GGADMP C[N@H+]1CC[C@H]([NH2+]CCn2cc(Br)ccc2=O)C[C@@H]1c1ccccc1 ZINC000453261732 567069869 /nfs/dbraw/zinc/06/98/69/567069869.db2.gz YWVCATBTASIRJC-ZWKOTPCHSA-N 2 1 390.325 3.036 20 0 GGADMP C[N@@H+]1CC[C@@H]([NH2+]CCn2cc(Br)ccc2=O)C[C@@H]1c1ccccc1 ZINC000453261727 567069892 /nfs/dbraw/zinc/06/98/92/567069892.db2.gz YWVCATBTASIRJC-QZTJIDSGSA-N 2 1 390.325 3.036 20 0 GGADMP C[N@H+]1CC[C@@H]([NH2+]CCn2cc(Br)ccc2=O)C[C@@H]1c1ccccc1 ZINC000453261727 567069895 /nfs/dbraw/zinc/06/98/95/567069895.db2.gz YWVCATBTASIRJC-QZTJIDSGSA-N 2 1 390.325 3.036 20 0 GGADMP C[C@@H](Cc1ccc(F)cc1Br)[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000584861406 567075639 /nfs/dbraw/zinc/07/56/39/567075639.db2.gz DYYTUQGRGVVMRA-HNNXBMFYSA-N 2 1 386.353 3.136 20 0 GGADMP Brc1ccc2[nH]cc(CC[NH2+][C@@H]3CCC[C@@H]3[C@H]3COCC[NH2+]3)c2c1 ZINC000584840295 567075865 /nfs/dbraw/zinc/07/58/65/567075865.db2.gz VGBCLPOTGNQFCU-KVSKMBFKSA-N 2 1 392.341 3.220 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000453345329 567077654 /nfs/dbraw/zinc/07/76/54/567077654.db2.gz FFJWOQRCWBNISJ-PGSNGQOISA-N 2 1 383.374 3.227 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000453345333 567078061 /nfs/dbraw/zinc/07/80/61/567078061.db2.gz FFJWOQRCWBNISJ-QMYADUOMSA-N 2 1 383.374 3.227 20 0 GGADMP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000545859431 567080863 /nfs/dbraw/zinc/08/08/63/567080863.db2.gz CQLRRBAWBLWTDA-KRWDZBQOSA-N 2 1 381.339 3.334 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)cc1Br ZINC000453380885 567083824 /nfs/dbraw/zinc/08/38/24/567083824.db2.gz RMYBQBLCJIBDSJ-RIVXBTQJSA-N 2 1 383.374 3.227 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000565627033 567084441 /nfs/dbraw/zinc/08/44/41/567084441.db2.gz SRAYMQVXAPRMEV-GJZGRUSLSA-N 2 1 382.346 3.486 20 0 GGADMP Brc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)c2ncccc12 ZINC000657752844 567093294 /nfs/dbraw/zinc/09/32/94/567093294.db2.gz SMWDZFQLVQIHSY-INIZCTEOSA-N 2 1 390.325 3.340 20 0 GGADMP Brc1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)c2ncccc12 ZINC000657752845 567093562 /nfs/dbraw/zinc/09/35/62/567093562.db2.gz SMWDZFQLVQIHSY-MRXNPFEDSA-N 2 1 390.325 3.340 20 0 GGADMP CC(C)[C@@H]([NH3+])CC[N@@H+](C)Cc1ccc(Br)cc1N1CCOCC1 ZINC000566230625 567140305 /nfs/dbraw/zinc/14/03/05/567140305.db2.gz SVPTUPZEBBKDMF-KRWDZBQOSA-N 2 1 384.362 3.091 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000566245159 567142793 /nfs/dbraw/zinc/14/27/93/567142793.db2.gz JIKUAIOQOUZOME-LSDHHAIUSA-N 2 1 380.330 3.099 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]CCc2cn3cc(Br)cc(C)c3n2)[C@@H](C)C1 ZINC000546932655 567172265 /nfs/dbraw/zinc/17/22/65/567172265.db2.gz XMPGCCCAXSSLQE-WMLDXEAASA-N 2 1 379.346 3.268 20 0 GGADMP C[C@@H]1C[N@H+](CCCNc2cc[nH+]c3ccc(Br)cc23)CCCO1 ZINC000432874782 567199931 /nfs/dbraw/zinc/19/99/31/567199931.db2.gz CCSWUTDDLBOVNH-CQSZACIVSA-N 2 1 378.314 3.332 20 0 GGADMP C[C@@H]1C[N@@H+](CCCNc2cc[nH+]c3ccc(Br)cc23)CCCO1 ZINC000432874782 567199937 /nfs/dbraw/zinc/19/99/37/567199937.db2.gz CCSWUTDDLBOVNH-CQSZACIVSA-N 2 1 378.314 3.332 20 0 GGADMP C[NH2+][C@H](C(=O)Nc1ccc2c(c1)C[NH2+]CCO2)c1cccc(Cl)c1Cl ZINC000659312330 567204320 /nfs/dbraw/zinc/20/43/20/567204320.db2.gz DHLULZNKURXGAT-KRWDZBQOSA-N 2 1 380.275 3.375 20 0 GGADMP C[N@H+](CCN1CCN(c2cc[nH+]cc2Br)CC1)Cc1ccccc1 ZINC000547501833 567215043 /nfs/dbraw/zinc/21/50/43/567215043.db2.gz MNTUFZBUNOAKFY-UHFFFAOYSA-N 2 1 389.341 3.098 20 0 GGADMP C[N@@H+](CCN1CCN(c2cc[nH+]cc2Br)CC1)Cc1ccccc1 ZINC000547501833 567215049 /nfs/dbraw/zinc/21/50/49/567215049.db2.gz MNTUFZBUNOAKFY-UHFFFAOYSA-N 2 1 389.341 3.098 20 0 GGADMP Brc1c[nH+]ccc1NCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000547826513 567250948 /nfs/dbraw/zinc/25/09/48/567250948.db2.gz QIGOTLAJSXHPRB-UHFFFAOYSA-N 2 1 376.298 3.353 20 0 GGADMP Brc1cc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)cc2c1OCO2 ZINC000567499650 567251767 /nfs/dbraw/zinc/25/17/67/567251767.db2.gz JZMBCVQLJQTWHD-CQSZACIVSA-N 2 1 377.238 3.226 20 0 GGADMP Brc1cc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)cc2c1OCO2 ZINC000567499650 567251773 /nfs/dbraw/zinc/25/17/73/567251773.db2.gz JZMBCVQLJQTWHD-CQSZACIVSA-N 2 1 377.238 3.226 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Cc1c(Cl)cccc1Cl ZINC000499518503 567254751 /nfs/dbraw/zinc/25/47/51/567254751.db2.gz HMXCFHZCAQZUDQ-HNNXBMFYSA-N 2 1 386.367 3.410 20 0 GGADMP CC[N@H+]1CC[C@H](N(C)CC(=O)c2c[nH]c3ncc(Br)cc23)[C@@H](C)C1 ZINC000660081103 567258526 /nfs/dbraw/zinc/25/85/26/567258526.db2.gz CVRQZSIMDACJLG-LRDDRELGSA-N 2 1 393.329 3.170 20 0 GGADMP C[NH2+][C@H](C(=O)N1CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C1)c1cccc(Cl)c1Cl ZINC000638564729 567259056 /nfs/dbraw/zinc/25/90/56/567259056.db2.gz WBHPMOVUKVYCEV-CHIMOYNISA-N 2 1 398.256 3.240 20 0 GGADMP C[NH2+][C@H](C(=O)Nc1ccc2c(c1)OCC[NH2+]C2)c1cccc(Cl)c1Cl ZINC000638670123 567264142 /nfs/dbraw/zinc/26/41/42/567264142.db2.gz DHFNHLXVVXDELP-KRWDZBQOSA-N 2 1 380.275 3.375 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000567681646 567267248 /nfs/dbraw/zinc/26/72/48/567267248.db2.gz XWIXNWSGYYWQSJ-GDBMZVCRSA-N 2 1 375.340 3.443 20 0 GGADMP C[C@@H]1C[C@@H]1C[N@@H+](CCN1CC[NH+](C)CC1)Cc1ccc(Br)cc1F ZINC000685469245 567277609 /nfs/dbraw/zinc/27/76/09/567277609.db2.gz UBQVVNFLLKIONF-NVXWUHKLSA-N 2 1 398.364 3.294 20 0 GGADMP Brc1ccc2[nH+]ccc(NCC3([NH+]4CCCC4)CCOCC3)c2c1 ZINC000591371303 567278036 /nfs/dbraw/zinc/27/80/36/567278036.db2.gz ARQLYZQVKZKNIF-UHFFFAOYSA-N 2 1 390.325 3.476 20 0 GGADMP C[C@H]([NH2+]Cc1cnn2cc(Br)cnc12)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000638970750 567279465 /nfs/dbraw/zinc/27/94/65/567279465.db2.gz OUKSUNCJENLAGE-KBPBESRZSA-N 2 1 392.345 3.234 20 0 GGADMP C[C@H]([NH2+]Cc1cnn2cc(Br)cnc12)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000638970750 567279473 /nfs/dbraw/zinc/27/94/73/567279473.db2.gz OUKSUNCJENLAGE-KBPBESRZSA-N 2 1 392.345 3.234 20 0 GGADMP C[C@@H]([NH2+]Cc1cnn2cc(Br)cnc12)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000638970751 567279743 /nfs/dbraw/zinc/27/97/43/567279743.db2.gz OUKSUNCJENLAGE-KGLIPLIRSA-N 2 1 392.345 3.234 20 0 GGADMP C[C@@H]([NH2+]Cc1cnn2cc(Br)cnc12)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000638970751 567279757 /nfs/dbraw/zinc/27/97/57/567279757.db2.gz OUKSUNCJENLAGE-KGLIPLIRSA-N 2 1 392.345 3.234 20 0 GGADMP Nc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000638971822 567280985 /nfs/dbraw/zinc/28/09/85/567280985.db2.gz BDDQKXGYBOUAEB-KRWDZBQOSA-N 2 1 380.319 3.432 20 0 GGADMP Cc1cc(Br)cn2c(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)cnc12 ZINC000567871113 567285905 /nfs/dbraw/zinc/28/59/05/567285905.db2.gz QMICBCRHGZXERJ-OAHLLOKOSA-N 2 1 377.330 3.227 20 0 GGADMP Brc1cc2c(cc1C[N@H+]1CCC[C@@H]([C@H]3CC[NH2+]C3)C1)OCCCO2 ZINC000567895559 567287857 /nfs/dbraw/zinc/28/78/57/567287857.db2.gz NUTLUCOOZKPXOL-LSDHHAIUSA-N 2 1 395.341 3.432 20 0 GGADMP Brc1cc2c(cc1C[N@H+]1CCC[C@H]([C@H]3CC[NH2+]C3)C1)OCCCO2 ZINC000567895557 567287926 /nfs/dbraw/zinc/28/79/26/567287926.db2.gz NUTLUCOOZKPXOL-GJZGRUSLSA-N 2 1 395.341 3.432 20 0 GGADMP Brc1cc2c(cc1C[N@H+]1CCC[C@@H]([C@@H]3CC[NH2+]C3)C1)OCCCO2 ZINC000567895558 567288881 /nfs/dbraw/zinc/28/88/81/567288881.db2.gz NUTLUCOOZKPXOL-HUUCEWRRSA-N 2 1 395.341 3.432 20 0 GGADMP C[C@@]1(C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CCC[NH2+]C1 ZINC000567911544 567289877 /nfs/dbraw/zinc/28/98/77/567289877.db2.gz ZBAXJYXLNQBSDP-LJQANCHMSA-N 2 1 384.351 3.464 20 0 GGADMP COCC[NH+]1CCC([NH2+]CCc2c[nH]c3cccc(Br)c23)CC1 ZINC000685658822 567290744 /nfs/dbraw/zinc/29/07/44/567290744.db2.gz RIVZYEKYMQYBLK-UHFFFAOYSA-N 2 1 380.330 3.173 20 0 GGADMP C[N@H+]1CC[C@@H](C(=O)N(CC[NH+]2CCCC2)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000591865696 567302045 /nfs/dbraw/zinc/30/20/45/567302045.db2.gz LYXHBVMUVWAHST-MRXNPFEDSA-N 2 1 384.351 3.370 20 0 GGADMP C[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1cc2c(cc1Br)OCCO2 ZINC000568166388 567309120 /nfs/dbraw/zinc/30/91/20/567309120.db2.gz JXTYNIDRFXDDIT-GFCCVEGCSA-N 2 1 380.286 3.237 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCC(=O)Nc2cc(Cl)ccc2Cl)CC12CCOCC2 ZINC000568513196 567334652 /nfs/dbraw/zinc/33/46/52/567334652.db2.gz KHHIILHWDAJEEX-CYBMUJFWSA-N 2 1 386.323 3.009 20 0 GGADMP C[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1ccc(Br)cn1 ZINC000568690120 567349867 /nfs/dbraw/zinc/34/98/67/567349867.db2.gz FMVIAWHNZPVJEA-ZDUSSCGKSA-N 2 1 379.302 3.030 20 0 GGADMP C[NH+](C)CCOc1cccc(C[NH2+]Cc2ncc(Br)cc2F)c1 ZINC000527640380 567355205 /nfs/dbraw/zinc/35/52/05/567355205.db2.gz JXGWGKCQWRFKSQ-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C[C@H]21 ZINC000435377389 567357671 /nfs/dbraw/zinc/35/76/71/567357671.db2.gz BAKQFSDJHVFRSQ-NUEKZKHPSA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C[C@H]21 ZINC000435377389 567357676 /nfs/dbraw/zinc/35/76/76/567357676.db2.gz BAKQFSDJHVFRSQ-NUEKZKHPSA-N 2 1 375.314 3.398 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000435374825 567358098 /nfs/dbraw/zinc/35/80/98/567358098.db2.gz YSRLWOJOXMPIHP-XIKOKIGWSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000435374825 567358106 /nfs/dbraw/zinc/35/81/06/567358106.db2.gz YSRLWOJOXMPIHP-XIKOKIGWSA-N 2 1 377.330 3.421 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000435377936 567358217 /nfs/dbraw/zinc/35/82/17/567358217.db2.gz BHZDBUYBKXHPEO-IUODEOHRSA-N 2 1 377.330 3.421 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3nc(-c4ccc(Br)cc4)c[nH]3)C[C@H]21 ZINC000435381097 567359380 /nfs/dbraw/zinc/35/93/80/567359380.db2.gz VHRRMQJPKKULEB-NUEKZKHPSA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3nc(-c4ccc(Br)cc4)c[nH]3)C[C@H]21 ZINC000435381097 567359384 /nfs/dbraw/zinc/35/93/84/567359384.db2.gz VHRRMQJPKKULEB-NUEKZKHPSA-N 2 1 375.314 3.398 20 0 GGADMP C[C@@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1cc(F)c(Br)cc1F ZINC000527859573 567380443 /nfs/dbraw/zinc/38/04/43/567380443.db2.gz QBJKGXSOWRDGRY-CYBMUJFWSA-N 2 1 390.316 3.406 20 0 GGADMP CC[N@H+](CC(=O)N[C@@H](C)c1ccc(Br)cc1)[C@H]1CCC[NH2+]CC1 ZINC000435628963 567381906 /nfs/dbraw/zinc/38/19/06/567381906.db2.gz RZRFREVFCVYDSY-YOEHRIQHSA-N 2 1 382.346 3.090 20 0 GGADMP CC[N@@H+](CC(=O)N[C@@H](C)c1ccc(Br)cc1)[C@H]1CCC[NH2+]CC1 ZINC000435628963 567381913 /nfs/dbraw/zinc/38/19/13/567381913.db2.gz RZRFREVFCVYDSY-YOEHRIQHSA-N 2 1 382.346 3.090 20 0 GGADMP CC[N@H+](CC(=O)N[C@H](C)c1ccc(Br)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000435628961 567381945 /nfs/dbraw/zinc/38/19/45/567381945.db2.gz RZRFREVFCVYDSY-RHSMWYFYSA-N 2 1 382.346 3.090 20 0 GGADMP CC[N@@H+](CC(=O)N[C@H](C)c1ccc(Br)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000435628961 567381951 /nfs/dbraw/zinc/38/19/51/567381951.db2.gz RZRFREVFCVYDSY-RHSMWYFYSA-N 2 1 382.346 3.090 20 0 GGADMP O=C(C[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2)NCc1cccs1 ZINC000435691740 567384466 /nfs/dbraw/zinc/38/44/66/567384466.db2.gz HTBKTXLXGFBXBU-QGZVFWFLSA-N 2 1 375.563 3.070 20 0 GGADMP O=C(C[N@@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2)NCc1cccs1 ZINC000435691740 567384473 /nfs/dbraw/zinc/38/44/73/567384473.db2.gz HTBKTXLXGFBXBU-QGZVFWFLSA-N 2 1 375.563 3.070 20 0 GGADMP CC(C)c1[nH+]ccn1CCC(=O)Nc1cc(N(C)C)c(Br)cn1 ZINC000456661777 567399303 /nfs/dbraw/zinc/39/93/03/567399303.db2.gz JZRSGTYQHBBDQF-UHFFFAOYSA-N 2 1 380.290 3.259 20 0 GGADMP C[C@@H](C[NH+](C)C)NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000501850932 567409538 /nfs/dbraw/zinc/40/95/38/567409538.db2.gz BDCXEFBOWGVHSH-ZDUSSCGKSA-N 2 1 387.355 3.207 20 0 GGADMP COc1ccc(Br)c(C[N@H+](C)CCCN2CC[NH+](C(C)C)CC2)c1 ZINC000501898400 567411883 /nfs/dbraw/zinc/41/18/83/567411883.db2.gz GRVIRPSKACYMIV-UHFFFAOYSA-N 2 1 398.389 3.306 20 0 GGADMP COc1ccc(Br)c(C[N@@H+](C)CCCN2CC[NH+](C(C)C)CC2)c1 ZINC000501898400 567411888 /nfs/dbraw/zinc/41/18/88/567411888.db2.gz GRVIRPSKACYMIV-UHFFFAOYSA-N 2 1 398.389 3.306 20 0 GGADMP C[C@H]1C[N@H+](CCC[NH2+][C@H]2CCc3cccc(Br)c3C2)CCCO1 ZINC000549816780 567412552 /nfs/dbraw/zinc/41/25/52/567412552.db2.gz ZMMKMHDJGDRQKU-RDJZCZTQSA-N 2 1 381.358 3.397 20 0 GGADMP C[C@H]1C[N@@H+](CCC[NH2+][C@H]2CCc3cccc(Br)c3C2)CCCO1 ZINC000549816780 567412559 /nfs/dbraw/zinc/41/25/59/567412559.db2.gz ZMMKMHDJGDRQKU-RDJZCZTQSA-N 2 1 381.358 3.397 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+](CCSc2cccc(Cl)c2)C1)[C@H]1CCC[NH2+]1 ZINC000662263748 567422304 /nfs/dbraw/zinc/42/23/04/567422304.db2.gz DSNZEOXRMNVBMH-CRAIPNDOSA-N 2 1 381.973 3.012 20 0 GGADMP [NH3+]Cc1cn([C@H]2CCC[N@H+](Cc3oc4ccccc4c3Br)C2)nn1 ZINC000662281020 567424129 /nfs/dbraw/zinc/42/41/29/567424129.db2.gz HPSLCENYRJRDRM-ZDUSSCGKSA-N 2 1 390.285 3.083 20 0 GGADMP [NH3+]Cc1cn([C@H]2CCC[N@@H+](Cc3oc4ccccc4c3Br)C2)nn1 ZINC000662281020 567424135 /nfs/dbraw/zinc/42/41/35/567424135.db2.gz HPSLCENYRJRDRM-ZDUSSCGKSA-N 2 1 390.285 3.083 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)[C@@H]([NH3+])c2ccccc2Br)CC1 ZINC000662388969 567433289 /nfs/dbraw/zinc/43/32/89/567433289.db2.gz REHAPMVJONBUEA-KRWDZBQOSA-N 2 1 382.346 3.077 20 0 GGADMP C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662402371 567433374 /nfs/dbraw/zinc/43/33/74/567433374.db2.gz IJNGUJHZJKWBHC-XJKSGUPXSA-N 2 1 382.346 3.076 20 0 GGADMP C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662402371 567433379 /nfs/dbraw/zinc/43/33/79/567433379.db2.gz IJNGUJHZJKWBHC-XJKSGUPXSA-N 2 1 382.346 3.076 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)[C@H]([NH3+])c2ccccc2Br)c1 ZINC000662404910 567433628 /nfs/dbraw/zinc/43/36/28/567433628.db2.gz KCWPNVZBPXYLLC-GOSISDBHSA-N 2 1 390.325 3.217 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)[C@H]([NH3+])c2ccccc2Br)c1 ZINC000662404910 567433635 /nfs/dbraw/zinc/43/36/35/567433635.db2.gz KCWPNVZBPXYLLC-GOSISDBHSA-N 2 1 390.325 3.217 20 0 GGADMP C[C@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)[N@H+](C)Cc1ccccc1 ZINC000662454473 567438410 /nfs/dbraw/zinc/43/84/10/567438410.db2.gz NZHVZBINUITWRH-KDOFPFPSSA-N 2 1 390.325 3.086 20 0 GGADMP C[C@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)[N@@H+](C)Cc1ccccc1 ZINC000662454473 567438418 /nfs/dbraw/zinc/43/84/18/567438418.db2.gz NZHVZBINUITWRH-KDOFPFPSSA-N 2 1 390.325 3.086 20 0 GGADMP CC[NH+](CC)CC1CCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)CC1 ZINC000662473940 567439923 /nfs/dbraw/zinc/43/99/23/567439923.db2.gz QYYIRDJLCSWFMI-KRWDZBQOSA-N 2 1 382.346 3.029 20 0 GGADMP [NH3+][C@@H](C(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccccc1Br ZINC000662487933 567441351 /nfs/dbraw/zinc/44/13/51/567441351.db2.gz OHEZMQYDEZYQEC-GOSISDBHSA-N 2 1 394.357 3.362 20 0 GGADMP C[NH2+][C@H](C(=O)N1CC[C@H](C[N@H+](C)CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000662486159 567441476 /nfs/dbraw/zinc/44/14/76/567441476.db2.gz LZHHNGFWKXXHSZ-KDOFPFPSSA-N 2 1 384.351 3.444 20 0 GGADMP C[NH2+][C@H](C(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000662486159 567441477 /nfs/dbraw/zinc/44/14/77/567441477.db2.gz LZHHNGFWKXXHSZ-KDOFPFPSSA-N 2 1 384.351 3.444 20 0 GGADMP CCS(=O)(=O)c1c(Cl)cccc1C[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000569892697 567442547 /nfs/dbraw/zinc/44/25/47/567442547.db2.gz UEPFXQLRNCVEFO-UHFFFAOYSA-N 2 1 391.002 3.051 20 0 GGADMP Cc1cc(C[NH+](C)C)cc(NC(=O)[C@@H]([NH3+])c2ccccc2Br)c1 ZINC000662508457 567443129 /nfs/dbraw/zinc/44/31/29/567443129.db2.gz BCKTUWKROGAJKO-KRWDZBQOSA-N 2 1 376.298 3.458 20 0 GGADMP C[NH2+][C@H](C(=O)N1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)c1cccc(Cl)c1Cl ZINC000662522279 567444468 /nfs/dbraw/zinc/44/44/68/567444468.db2.gz KKOWIXMCJPXTTA-LBTNJELSSA-N 2 1 384.351 3.492 20 0 GGADMP [NH3+][C@@H](C(=O)Nc1nc(C2CC[NH2+]CC2)cs1)c1ccccc1Br ZINC000662571652 567449121 /nfs/dbraw/zinc/44/91/21/567449121.db2.gz QLGGGECSJKMLIE-CQSZACIVSA-N 2 1 395.326 3.011 20 0 GGADMP C[NH2+][C@H](C(=O)N1CCC([C@H]2[NH2+]CC2(C)C)CC1)c1cccc(Cl)c1Cl ZINC000662578005 567451345 /nfs/dbraw/zinc/45/13/45/567451345.db2.gz OMZKNIUHGAMYKB-DLBZAZTESA-N 2 1 384.351 3.491 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C[C@@H](O)COc1ccc(Br)cc1 ZINC000570037147 567454146 /nfs/dbraw/zinc/45/41/46/567454146.db2.gz OPRACTDWSJYHTB-FUHWJXTLSA-N 2 1 399.373 3.433 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)C1CCCCC1 ZINC000662679953 567455904 /nfs/dbraw/zinc/45/59/04/567455904.db2.gz QISSOMAEMDUHOQ-DLBZAZTESA-N 2 1 382.346 3.076 20 0 GGADMP C[C@@]([NH3+])(C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccc(Br)cc1 ZINC000662667676 567456358 /nfs/dbraw/zinc/45/63/58/567456358.db2.gz CIVLOFKBFMQORY-APWZRJJASA-N 2 1 394.357 3.146 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@@H]([NH3+])c1ccccc1Br ZINC000662747329 567460752 /nfs/dbraw/zinc/46/07/52/567460752.db2.gz SNTPGERXAXXATN-KRWDZBQOSA-N 2 1 376.298 3.458 20 0 GGADMP C[N@@H+]1CC[C@@H]([NH2+]CCCn2cc(Br)cn2)C[C@H]1c1ccccc1 ZINC000550818270 567463571 /nfs/dbraw/zinc/46/35/71/567463571.db2.gz JLZVBSGLULJBIF-MSOLQXFVSA-N 2 1 377.330 3.461 20 0 GGADMP C[N@H+]1CC[C@@H]([NH2+]CCCn2cc(Br)cn2)C[C@H]1c1ccccc1 ZINC000550818270 567463578 /nfs/dbraw/zinc/46/35/78/567463578.db2.gz JLZVBSGLULJBIF-MSOLQXFVSA-N 2 1 377.330 3.461 20 0 GGADMP C[N@H+]1CCC[C@@H]1CCN1CCN(Cc2ccc(Br)c(F)c2)CC1 ZINC000503055851 567466569 /nfs/dbraw/zinc/46/65/69/567466569.db2.gz YHVPMRXVKYHACI-MRXNPFEDSA-N 2 1 384.337 3.190 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@H]2CCc3sc(Br)cc32)CC1 ZINC000551029790 567474482 /nfs/dbraw/zinc/47/44/82/567474482.db2.gz RYPCZQNFZSDNCB-HNNXBMFYSA-N 2 1 386.403 3.361 20 0 GGADMP C[N@H+](C[C@H](O)C[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1)C1CC1 ZINC000570325537 567476418 /nfs/dbraw/zinc/47/64/18/567476418.db2.gz YMQKKVFYHTYRGB-CQSZACIVSA-N 2 1 376.850 3.435 20 0 GGADMP C[N@@H+](C[C@H](O)C[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1)C1CC1 ZINC000570325537 567476421 /nfs/dbraw/zinc/47/64/21/567476421.db2.gz YMQKKVFYHTYRGB-CQSZACIVSA-N 2 1 376.850 3.435 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)Nc1cccc(Br)c1 ZINC000643061757 567491528 /nfs/dbraw/zinc/49/15/28/567491528.db2.gz SPWAFXQMVGIWRR-IAGOWNOFSA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)Nc1cccc(Br)c1 ZINC000643061757 567491534 /nfs/dbraw/zinc/49/15/34/567491534.db2.gz SPWAFXQMVGIWRR-IAGOWNOFSA-N 2 1 380.330 3.384 20 0 GGADMP CC(C)C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000479061408 567499296 /nfs/dbraw/zinc/49/92/96/567499296.db2.gz MVULRTCGYVBICR-GOSISDBHSA-N 2 1 396.373 3.290 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+][C@H]2CCCc3cc(Br)ccc32)C1 ZINC000479061472 567499851 /nfs/dbraw/zinc/49/98/51/567499851.db2.gz NTLUCUHDBMJBTB-QAPCUYQASA-N 2 1 394.357 3.004 20 0 GGADMP O[C@@H](C[NH2+][C@@H]1CCCSc2ccc(Br)cc21)C[NH+]1CCCC1 ZINC000663438444 567509314 /nfs/dbraw/zinc/50/93/14/567509314.db2.gz ICIOPFNVQMKRIF-GOEBONIOSA-N 2 1 385.371 3.422 20 0 GGADMP Cc1cc([C@H]([NH2+]CC(=O)N2CC[NH2+]CC2)c2cccc(Cl)c2)c(C)s1 ZINC000570792623 567513063 /nfs/dbraw/zinc/51/30/63/567513063.db2.gz UTJMLBJNLNAWNI-LJQANCHMSA-N 2 1 377.941 3.129 20 0 GGADMP COC(=O)c1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)c(Br)c1 ZINC000551529972 567514638 /nfs/dbraw/zinc/51/46/38/567514638.db2.gz MJELYENZDHNLGC-GFCCVEGCSA-N 2 1 380.286 3.167 20 0 GGADMP C[NH+](C)CCCCC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000571192308 567545201 /nfs/dbraw/zinc/54/52/01/567545201.db2.gz ZKVSYVLWNRZWIO-UHFFFAOYSA-N 2 1 396.373 3.262 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000644532071 567556763 /nfs/dbraw/zinc/55/67/63/567556763.db2.gz YTJVTNUMHHBKMZ-LSDHHAIUSA-N 2 1 375.340 3.443 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Cc1ccc(Cl)c(Cl)c1 ZINC000505724417 567594399 /nfs/dbraw/zinc/59/43/99/567594399.db2.gz CCMJTZDSLPGCDK-MRXNPFEDSA-N 2 1 386.367 3.410 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Cc1ccc(Cl)c(Cl)c1 ZINC000505724416 567594460 /nfs/dbraw/zinc/59/44/60/567594460.db2.gz CCMJTZDSLPGCDK-INIZCTEOSA-N 2 1 386.367 3.410 20 0 GGADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc4c(cc3Br)OCO4)C2)CC1 ZINC000571960659 567601966 /nfs/dbraw/zinc/60/19/66/567601966.db2.gz PXOALVGAABHWNC-CQSZACIVSA-N 2 1 381.314 3.342 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@@H]2OCC[C@H]2[NH3+])CC1 ZINC000572037760 567609045 /nfs/dbraw/zinc/60/90/45/567609045.db2.gz HBIPHBPETZPRQT-JECHBYEQSA-N 2 1 386.323 3.149 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cccc(O)c3Br)CC2)C[C@H](C)O1 ZINC000459307886 567612501 /nfs/dbraw/zinc/61/25/01/567612501.db2.gz ABHHXHVQXKNCTO-GASCZTMLSA-N 2 1 397.357 3.476 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cccc(O)c3Br)CC2)C[C@H](C)O1 ZINC000459307886 567612504 /nfs/dbraw/zinc/61/25/04/567612504.db2.gz ABHHXHVQXKNCTO-GASCZTMLSA-N 2 1 397.357 3.476 20 0 GGADMP CCN1CC[NH+]([C@H]2CCN(Cc3cc(Cl)cc(Br)c3)C2)CC1 ZINC000459346976 567616388 /nfs/dbraw/zinc/61/63/88/567616388.db2.gz LBHJHUHRKNLPMW-KRWDZBQOSA-N 2 1 386.765 3.314 20 0 GGADMP C[C@@H]1CCc2ccc(Br)cc2[C@H]([NH2+]Cc2nc(C[NH3+])cc(=O)[nH]2)C1 ZINC000665292480 567616937 /nfs/dbraw/zinc/61/69/37/567616937.db2.gz AVFGBXMSQWRGHD-BDJLRTHQSA-N 2 1 391.313 3.207 20 0 GGADMP C[NH+](C)CCOc1cccc(C[NH2+]Cc2cccc(O)c2Br)c1 ZINC000459388421 567620427 /nfs/dbraw/zinc/62/04/27/567620427.db2.gz KVKWBBIGGNTVDR-UHFFFAOYSA-N 2 1 379.298 3.385 20 0 GGADMP CC[N@H+](CCC[NH+](C)C)Cc1ccc(Br)cc1N1CCOCC1 ZINC000572206098 567621564 /nfs/dbraw/zinc/62/15/64/567621564.db2.gz FPYHKVJACQEZKT-UHFFFAOYSA-N 2 1 384.362 3.059 20 0 GGADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(Br)cc1N1CCOCC1 ZINC000572206098 567621570 /nfs/dbraw/zinc/62/15/70/567621570.db2.gz FPYHKVJACQEZKT-UHFFFAOYSA-N 2 1 384.362 3.059 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc3c(c(Br)c2)OCO3)C1 ZINC000530866455 567628236 /nfs/dbraw/zinc/62/82/36/567628236.db2.gz DLLQFMAFEODHGS-OAHLLOKOSA-N 2 1 399.329 3.111 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cc3c(c(Br)c2)OCO3)C1 ZINC000530866455 567628239 /nfs/dbraw/zinc/62/82/39/567628239.db2.gz DLLQFMAFEODHGS-OAHLLOKOSA-N 2 1 399.329 3.111 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc3c(c(Br)c2)OCO3)C1 ZINC000530866454 567628856 /nfs/dbraw/zinc/62/88/56/567628856.db2.gz DLLQFMAFEODHGS-HNNXBMFYSA-N 2 1 399.329 3.111 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cc3c(c(Br)c2)OCO3)C1 ZINC000530866454 567628858 /nfs/dbraw/zinc/62/88/58/567628858.db2.gz DLLQFMAFEODHGS-HNNXBMFYSA-N 2 1 399.329 3.111 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(F)cc(Br)c2)[C@H](C)C1 ZINC000459693287 567652192 /nfs/dbraw/zinc/65/21/92/567652192.db2.gz HVASUNKVDTVEFP-SIIHOXLZSA-N 2 1 387.337 3.059 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2CCOc1cccc(Br)c1 ZINC000441181880 567656542 /nfs/dbraw/zinc/65/65/42/567656542.db2.gz SURKODREDBXMGP-NJAFHUGGSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2CCOc1cccc(Br)c1 ZINC000441181880 567656547 /nfs/dbraw/zinc/65/65/47/567656547.db2.gz SURKODREDBXMGP-NJAFHUGGSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2CCOc1ccc(Br)cc1 ZINC000441250273 567657295 /nfs/dbraw/zinc/65/72/95/567657295.db2.gz YQLDKVPWUUFGMY-NXHRZFHOSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2CCOc1ccc(Br)cc1 ZINC000441250273 567657301 /nfs/dbraw/zinc/65/73/01/567657301.db2.gz YQLDKVPWUUFGMY-NXHRZFHOSA-N 2 1 383.330 3.011 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459777237 567657898 /nfs/dbraw/zinc/65/78/98/567657898.db2.gz KIVPULNNHNFDLD-HUUCEWRRSA-N 2 1 382.346 3.488 20 0 GGADMP CSc1cc(Br)ccc1C[NH2+]CCN1CC[N@@H+](C)C(C)(C)C1 ZINC000441343733 567662953 /nfs/dbraw/zinc/66/29/53/567662953.db2.gz GWMOFNFTTOBLPV-UHFFFAOYSA-N 2 1 386.403 3.287 20 0 GGADMP Cc1ccc(Br)cc1C[N@@H+]1CC[C@@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000573317946 567705033 /nfs/dbraw/zinc/70/50/33/567705033.db2.gz LXRLFACNBOMASK-LJQANCHMSA-N 2 1 380.374 3.358 20 0 GGADMP Cc1cc(C[NH2+]Cc2ccccc2OCC[NH+](C)C)ncc1Br ZINC000623385411 567706199 /nfs/dbraw/zinc/70/61/99/567706199.db2.gz JNIZKZCIDWFZKM-UHFFFAOYSA-N 2 1 378.314 3.383 20 0 GGADMP [NH3+][C@H](CC(F)F)C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000573367386 567708166 /nfs/dbraw/zinc/70/81/66/567708166.db2.gz WCLHEOHSLPZFDW-CQSZACIVSA-N 2 1 380.266 3.057 20 0 GGADMP Cc1cc(Br)ccc1C[NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000532346397 567709840 /nfs/dbraw/zinc/70/98/40/567709840.db2.gz FXURNXDDDITWMJ-HXUWFJFHSA-N 2 1 389.337 3.484 20 0 GGADMP Cc1cc(Br)ccc1C[NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000532346397 567709852 /nfs/dbraw/zinc/70/98/52/567709852.db2.gz FXURNXDDDITWMJ-HXUWFJFHSA-N 2 1 389.337 3.484 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3cc(C)c(Br)cn3)CC2)nc(C)[nH+]1 ZINC000623440968 567710506 /nfs/dbraw/zinc/71/05/06/567710506.db2.gz VKSPRYINGJMGHV-UHFFFAOYSA-N 2 1 390.329 3.318 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@H]2CCCc3c(Br)cccc32)CC1(C)C ZINC000442872542 567713562 /nfs/dbraw/zinc/71/35/62/567713562.db2.gz JRZNMYMEUDFZFG-SFHVURJKSA-N 2 1 380.374 3.442 20 0 GGADMP Cc1cc(Br)cc2c1[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)CC2 ZINC000442878635 567713917 /nfs/dbraw/zinc/71/39/17/567713917.db2.gz UEWUTVGAOOAYMZ-QGZVFWFLSA-N 2 1 380.374 3.360 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@H+]1CCC[C@H](CC[NH3+])C1 ZINC000442919013 567716807 /nfs/dbraw/zinc/71/68/07/567716807.db2.gz DNLXHQVYZQZPBG-OAHLLOKOSA-N 2 1 385.346 3.425 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)cn2)cc1 ZINC000666998488 567717492 /nfs/dbraw/zinc/71/74/92/567717492.db2.gz WOWADKCKUFVWNK-INIZCTEOSA-N 2 1 375.314 3.399 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000573906595 567743665 /nfs/dbraw/zinc/74/36/65/567743665.db2.gz FUYZYNRZULFGTC-IRXDYDNUSA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000573906595 567743672 /nfs/dbraw/zinc/74/36/72/567743672.db2.gz FUYZYNRZULFGTC-IRXDYDNUSA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000573906594 567743805 /nfs/dbraw/zinc/74/38/05/567743805.db2.gz FUYZYNRZULFGTC-IAGOWNOFSA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)Nc1ccc(Br)cc1 ZINC000573906594 567743814 /nfs/dbraw/zinc/74/38/14/567743814.db2.gz FUYZYNRZULFGTC-IAGOWNOFSA-N 2 1 380.330 3.384 20 0 GGADMP C[N@@H+](Cc1cc(Br)c2c(c1)OCCCO2)C[C@@H]1CCC[NH+](C)C1 ZINC000508554351 567753251 /nfs/dbraw/zinc/75/32/51/567753251.db2.gz ULUKFDGHBVNVBI-CQSZACIVSA-N 2 1 383.330 3.384 20 0 GGADMP C[N@H+](Cc1cc(Br)c2c(c1)OCCCO2)C[C@@H]1CCC[NH+](C)C1 ZINC000508554351 567753257 /nfs/dbraw/zinc/75/32/57/567753257.db2.gz ULUKFDGHBVNVBI-CQSZACIVSA-N 2 1 383.330 3.384 20 0 GGADMP C[NH+](Cc1cc(Br)c2c(c1)OCCCO2)C[C@@H]1CCC[N@H+](C)C1 ZINC000508554351 567753261 /nfs/dbraw/zinc/75/32/61/567753261.db2.gz ULUKFDGHBVNVBI-CQSZACIVSA-N 2 1 383.330 3.384 20 0 GGADMP C[NH+](Cc1cc(Br)c2c(c1)OCCCO2)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508554351 567753267 /nfs/dbraw/zinc/75/32/67/567753267.db2.gz ULUKFDGHBVNVBI-CQSZACIVSA-N 2 1 383.330 3.384 20 0 GGADMP COc1c(Br)cc(C[NH2+]CC[C@H]2CCC[NH2+]2)cc1Br ZINC000574422088 567777514 /nfs/dbraw/zinc/77/75/14/567777514.db2.gz JXIKVEPTTTVWGT-LLVKDONJSA-N 2 1 392.135 3.452 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cncc(Br)c1C ZINC000668159867 567798990 /nfs/dbraw/zinc/79/89/90/567798990.db2.gz JJAUCDJIBIGHCB-KRWDZBQOSA-N 2 1 383.378 3.000 20 0 GGADMP O=C(C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000647975224 567808870 /nfs/dbraw/zinc/80/88/70/567808870.db2.gz RFHBYCGQIMLKBX-GJZGRUSLSA-N 2 1 380.330 3.099 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccccc1Br ZINC000647976956 567809086 /nfs/dbraw/zinc/80/90/86/567809086.db2.gz WHJXSZFLNQTCSF-HZPDHXFCSA-N 2 1 394.357 3.489 20 0 GGADMP Cc1cccc(-c2noc(C[NH+]3CCC(C[NH+]4C[C@H](C)O[C@@H](C)C4)CC3)n2)c1 ZINC000058268657 570724204 /nfs/dbraw/zinc/72/42/04/570724204.db2.gz WCNFVGAPYHJWSC-ROUUACIJSA-N 2 1 384.524 3.366 20 0 GGADMP COc1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cc1-c1nn[nH]n1 ZINC000821818211 599404550 /nfs/dbraw/zinc/40/45/50/599404550.db2.gz LEBNZUAGBPFAFP-UHFFFAOYSA-N 2 1 380.496 3.005 20 0 GGADMP Cc1cccc2c(NCCCC[N@H+]3CCCC[C@H]3C)c(-c3nn[nH]n3)c[nH+]c12 ZINC000822335296 599479235 /nfs/dbraw/zinc/47/92/35/599479235.db2.gz JQSIYIIEHAFAKS-MRXNPFEDSA-N 2 1 379.512 3.212 20 0 GGADMP Cc1cccc2c(NCCCC[N@@H+]3CCCC[C@H]3C)c(-c3nn[nH]n3)c[nH+]c12 ZINC000822335296 599479236 /nfs/dbraw/zinc/47/92/36/599479236.db2.gz JQSIYIIEHAFAKS-MRXNPFEDSA-N 2 1 379.512 3.212 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C3CC[NH+](CCCC(=O)[O-])CC3)cc2)C1 ZINC000833612635 605218918 /nfs/dbraw/zinc/21/89/18/605218918.db2.gz AXKUEXHCWBAVGI-LJQANCHMSA-N 2 1 387.568 3.337 20 0 GGADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOc2cccc(-c3nn[nH]n3)c2)C1 ZINC000820705935 606899192 /nfs/dbraw/zinc/89/91/92/606899192.db2.gz WZIYJZGAUPRHFK-RBUKOAKNSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCOc2cccc(-c3nn[nH]n3)c2)C1 ZINC000820705935 606899193 /nfs/dbraw/zinc/89/91/93/606899193.db2.gz WZIYJZGAUPRHFK-RBUKOAKNSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCOc2cccc(-c3nn[nH]n3)c2)C1 ZINC000820705935 606899194 /nfs/dbraw/zinc/89/91/94/606899194.db2.gz WZIYJZGAUPRHFK-RBUKOAKNSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCOc2cccc(-c3nn[nH]n3)c2)C1 ZINC000820705935 606899195 /nfs/dbraw/zinc/89/91/95/606899195.db2.gz WZIYJZGAUPRHFK-RBUKOAKNSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(-c3nn[nH]n3)cc2F)CC1 ZINC000820704319 606914863 /nfs/dbraw/zinc/91/48/63/606914863.db2.gz NNVCTDBYKJKSTB-INIZCTEOSA-N 2 1 386.519 3.482 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cc(-c3nn[nH]n3)ccc2F)CC1 ZINC000820703743 606914878 /nfs/dbraw/zinc/91/48/78/606914878.db2.gz JYFOSKWZCQGEHG-MRXNPFEDSA-N 2 1 386.519 3.482 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(-c3nn[nH]n3)cc2F)CC1 ZINC000820704321 606915180 /nfs/dbraw/zinc/91/51/80/606915180.db2.gz NNVCTDBYKJKSTB-MRXNPFEDSA-N 2 1 386.519 3.482 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(-c2nn[nH]n2)cc1 ZINC000820411633 607012158 /nfs/dbraw/zinc/01/21/58/607012158.db2.gz IVPSFTDTEXABOJ-XGHQBKJUSA-N 2 1 376.508 3.428 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(-c2nn[nH]n2)cc1 ZINC000820411633 607012159 /nfs/dbraw/zinc/01/21/59/607012159.db2.gz IVPSFTDTEXABOJ-XGHQBKJUSA-N 2 1 376.508 3.428 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc(F)ccc2-c2nn[nH]n2)CC1 ZINC000821614427 607062800 /nfs/dbraw/zinc/06/28/00/607062800.db2.gz FRKFBBLNQWFOIO-UHFFFAOYSA-N 2 1 394.498 3.350 20 0 GGADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(F)cc2-c2nn[nH]n2)CC1)CC1CC1 ZINC000825419658 608211831 /nfs/dbraw/zinc/21/18/31/608211831.db2.gz QLRWTSSPUUJZFF-UHFFFAOYSA-N 2 1 386.519 3.340 20 0 GGADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(F)c(-c3nn[nH]n3)c2)CC1)CC1CC1 ZINC000825419002 608212015 /nfs/dbraw/zinc/21/20/15/608212015.db2.gz CPZFDWVEPWLRHX-UHFFFAOYSA-N 2 1 386.519 3.340 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(-c2nn[nH]n2)cc1F ZINC000824577666 609332945 /nfs/dbraw/zinc/33/29/45/609332945.db2.gz MMNBBHIEJNAPKS-SJLPKXTDSA-N 2 1 394.498 3.221 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(-c2nn[nH]n2)cc1F ZINC000824577666 609332947 /nfs/dbraw/zinc/33/29/47/609332947.db2.gz MMNBBHIEJNAPKS-SJLPKXTDSA-N 2 1 394.498 3.221 20 0 GGADMP C[N@H+](CC(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cc1)CC1CC1 ZINC000053184396 1406318729 /nfs/dbraw/zinc/31/87/29/1406318729.db2.gz JPGPISOXKUQNPK-UHFFFAOYSA-N 2 1 392.547 3.289 20 0 GGADMP CC(C)[NH+](CCNC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)C(C)C ZINC000053958436 1406569699 /nfs/dbraw/zinc/56/96/99/1406569699.db2.gz TWZVCCQLBHKQIW-UHFFFAOYSA-N 2 1 378.536 3.162 20 0 GGADMP CC(C)[NH+](CCNC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)C(C)C ZINC000053958436 1406569706 /nfs/dbraw/zinc/56/97/06/1406569706.db2.gz TWZVCCQLBHKQIW-UHFFFAOYSA-N 2 1 378.536 3.162 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000054044787 1406602988 /nfs/dbraw/zinc/60/29/88/1406602988.db2.gz CFJVKDXVPHAQGO-QHCPKHFHSA-N 2 1 392.547 3.225 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCC[N@H+](C)Cc3ccccc3)cc2)C[C@@H](C)O1 ZINC000054265492 1406672341 /nfs/dbraw/zinc/67/23/41/1406672341.db2.gz AMTKGDGQEZOUIL-WOJBJXKFSA-N 2 1 395.547 3.158 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCC[N@@H+](C)Cc3ccccc3)cc2)C[C@@H](C)O1 ZINC000054265492 1406672351 /nfs/dbraw/zinc/67/23/51/1406672351.db2.gz AMTKGDGQEZOUIL-WOJBJXKFSA-N 2 1 395.547 3.158 20 0 GGADMP O=[N+]([O-])c1cccc(-c2ncn(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)n2)c1 ZINC000054488062 1406751148 /nfs/dbraw/zinc/75/11/48/1406751148.db2.gz IHNWCBVPJHDJKR-UHFFFAOYSA-N 2 1 398.511 3.399 20 0 GGADMP CCC[N@@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509663 1406755975 /nfs/dbraw/zinc/75/59/75/1406755975.db2.gz NPTMLFNBHFVHOQ-IBGZPJMESA-N 2 1 392.975 3.289 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509663 1406755983 /nfs/dbraw/zinc/75/59/83/1406755983.db2.gz NPTMLFNBHFVHOQ-IBGZPJMESA-N 2 1 392.975 3.289 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509663 1406755993 /nfs/dbraw/zinc/75/59/93/1406755993.db2.gz NPTMLFNBHFVHOQ-IBGZPJMESA-N 2 1 392.975 3.289 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000054509663 1406755999 /nfs/dbraw/zinc/75/59/99/1406755999.db2.gz NPTMLFNBHFVHOQ-IBGZPJMESA-N 2 1 392.975 3.289 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000054511628 1406757308 /nfs/dbraw/zinc/75/73/08/1406757308.db2.gz FDVKPBHNBSJPIA-FQEVSTJZSA-N 2 1 386.584 3.450 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCC[N@H+]1CCCC[C@H]1C ZINC000054609168 1406782593 /nfs/dbraw/zinc/78/25/93/1406782593.db2.gz DFTJCABGUVHRBH-QGZVFWFLSA-N 2 1 384.528 3.030 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000054609168 1406782601 /nfs/dbraw/zinc/78/26/01/1406782601.db2.gz DFTJCABGUVHRBH-QGZVFWFLSA-N 2 1 384.528 3.030 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)Cc1ccccc1 ZINC000054762628 1406820845 /nfs/dbraw/zinc/82/08/45/1406820845.db2.gz IUBSOAMQGXWZPI-LJQANCHMSA-N 2 1 386.565 3.316 20 0 GGADMP C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)C[C@H](C)O1 ZINC000021061484 1399362960 /nfs/dbraw/zinc/36/29/60/1399362960.db2.gz QYHKCNPYFALTDC-KDURUIRLSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)C[C@H](C)O1 ZINC000021061484 1399362963 /nfs/dbraw/zinc/36/29/63/1399362963.db2.gz QYHKCNPYFALTDC-KDURUIRLSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)C[C@@H](C)O1 ZINC000021061481 1399363126 /nfs/dbraw/zinc/36/31/26/1399363126.db2.gz QYHKCNPYFALTDC-RTBURBONSA-N 2 1 387.568 3.290 20 0 GGADMP C[NH+](C)CCCNC(=S)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000023102375 1399531934 /nfs/dbraw/zinc/53/19/34/1399531934.db2.gz XQSHTLOHVMOXEN-UHFFFAOYSA-N 2 1 396.604 3.220 20 0 GGADMP C[NH+]1CCN([C@H](C[NH2+]Cc2cnn(-c3ccccc3)c2)c2cccs2)CC1 ZINC000024082330 1399600621 /nfs/dbraw/zinc/60/06/21/1399600621.db2.gz QKLVPBKCJMINDH-HXUWFJFHSA-N 2 1 381.549 3.012 20 0 GGADMP C[NH+]1CCN([C@H](C[NH2+]Cc2cnn(Cc3ccccc3)c2)c2cccs2)CC1 ZINC000024082342 1399601000 /nfs/dbraw/zinc/60/10/00/1399601000.db2.gz QAXBJOJOKSOSEG-OAQYLSRUSA-N 2 1 395.576 3.071 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCc3cccc(C[NH+](C)C)c3)cc2)C[C@@H](C)O1 ZINC000025127626 1399751488 /nfs/dbraw/zinc/75/14/88/1399751488.db2.gz FYFIEZIZWQCRGE-RTBURBONSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCc3cccc(C[NH+](C)C)c3)cc2)C[C@H](C)O1 ZINC000025127632 1399751782 /nfs/dbraw/zinc/75/17/82/1399751782.db2.gz FYFIEZIZWQCRGE-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCc3cccc(C[NH+](C)C)c3)cc2)C[C@H](C)O1 ZINC000025127632 1399751798 /nfs/dbraw/zinc/75/17/98/1399751798.db2.gz FYFIEZIZWQCRGE-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+](C)CCOc1ccccc1 ZINC000026184249 1399868113 /nfs/dbraw/zinc/86/81/13/1399868113.db2.gz LMGSXIGUBQDGRT-HXUWFJFHSA-N 2 1 395.547 3.167 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)CCOc1ccccc1 ZINC000026184249 1399868116 /nfs/dbraw/zinc/86/81/16/1399868116.db2.gz LMGSXIGUBQDGRT-HXUWFJFHSA-N 2 1 395.547 3.167 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)C(=O)NC(=O)NC(C)(C)C ZINC000056156197 1407232632 /nfs/dbraw/zinc/23/26/32/1407232632.db2.gz POZDMRIDZPBEAF-IRXDYDNUSA-N 2 1 388.556 3.163 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC2([NH+](C)C)CCCCCC2)cn1 ZINC000056383690 1407316313 /nfs/dbraw/zinc/31/63/13/1407316313.db2.gz TVBCVXWGFXKXJW-UHFFFAOYSA-N 2 1 384.528 3.030 20 0 GGADMP C[NH+](C)CCCNC(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000042924002 1403673755 /nfs/dbraw/zinc/67/37/55/1403673755.db2.gz YLLCLTOPQUCIGX-UHFFFAOYSA-N 2 1 380.536 3.055 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000042929607 1403675009 /nfs/dbraw/zinc/67/50/09/1403675009.db2.gz OYABFHVKNCKBPI-BGYRXZFFSA-N 2 1 386.584 3.318 20 0 GGADMP Cc1ccc(C[N@H+]2CCCN(C(=O)NC[C@@H](c3ccco3)[NH+](C)C)CC2)cc1 ZINC000043138244 1403715002 /nfs/dbraw/zinc/71/50/02/1403715002.db2.gz HBYUCCRNPCZZBV-FQEVSTJZSA-N 2 1 384.524 3.108 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)NC[C@@H](c3ccco3)[NH+](C)C)CC2)cc1 ZINC000043138244 1403715010 /nfs/dbraw/zinc/71/50/10/1403715010.db2.gz HBYUCCRNPCZZBV-FQEVSTJZSA-N 2 1 384.524 3.108 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000043167315 1403723361 /nfs/dbraw/zinc/72/33/61/1403723361.db2.gz VLEGFMJZVHTVAN-OALUTQOASA-N 2 1 376.545 3.228 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000043167322 1403723993 /nfs/dbraw/zinc/72/39/93/1403723993.db2.gz FAEOBWNZRWUXKB-ZCNNSNEGSA-N 2 1 390.572 3.474 20 0 GGADMP C[NH+]1CCC(NC(=O)N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)CC1 ZINC000043180641 1403726466 /nfs/dbraw/zinc/72/64/66/1403726466.db2.gz YMPQPZJGZDQJBY-UHFFFAOYSA-N 2 1 392.547 3.197 20 0 GGADMP O=C(NCCC[NH+]1CCCC1)C1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000044913448 1404019859 /nfs/dbraw/zinc/01/98/59/1404019859.db2.gz RXDLCZKOIRTAEY-UHFFFAOYSA-N 2 1 381.923 3.293 20 0 GGADMP O=C(NCCC[NH+]1CCCC1)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000045121095 1404056614 /nfs/dbraw/zinc/05/66/14/1404056614.db2.gz MEFGKLMJHUSGRR-UHFFFAOYSA-N 2 1 378.948 3.043 20 0 GGADMP O=C(NCCC[NH+]1CCCC1)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000045121095 1404056621 /nfs/dbraw/zinc/05/66/21/1404056621.db2.gz MEFGKLMJHUSGRR-UHFFFAOYSA-N 2 1 378.948 3.043 20 0 GGADMP O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000045182396 1404069332 /nfs/dbraw/zinc/06/93/32/1404069332.db2.gz SHZDYXAEONPEFO-VQTJNVASSA-N 2 1 390.959 3.230 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)NC2CC[NH+](CC(C)C)CC2)CC1 ZINC000045462417 1404126951 /nfs/dbraw/zinc/12/69/51/1404126951.db2.gz VSMHAEUWCFUNTG-UHFFFAOYSA-N 2 1 386.584 3.333 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H](c1cccs1)[NH+](C)C)[N@H+]1CCc2ccccc2C1 ZINC000045543527 1404143889 /nfs/dbraw/zinc/14/38/89/1404143889.db2.gz JCRAURDAVWSHRN-QFBILLFUSA-N 2 1 386.565 3.097 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)CC1 ZINC000045757663 1404196818 /nfs/dbraw/zinc/19/68/18/1404196818.db2.gz SMWGDBVWFWXIII-AZUAARDMSA-N 2 1 386.584 3.379 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)Nc2ccccc2N2CC[NH+](C)CC2)C1 ZINC000045983939 1404261990 /nfs/dbraw/zinc/26/19/90/1404261990.db2.gz MEIBZUZGELIXOL-LJQANCHMSA-N 2 1 387.572 3.072 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCC3([NH+](C)C)CCCCC3)cc2)C[C@H](C)O1 ZINC000046430470 1404410658 /nfs/dbraw/zinc/41/06/58/1404410658.db2.gz QZGZOKKYMFEPGT-KDURUIRLSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCC3([NH+](C)C)CCCCC3)cc2)C[C@H](C)O1 ZINC000046430470 1404410662 /nfs/dbraw/zinc/41/06/62/1404410662.db2.gz QZGZOKKYMFEPGT-KDURUIRLSA-N 2 1 387.568 3.290 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)NCc3cccc(C[NH+](C)C)c3)CC2)cc1 ZINC000046926777 1404637381 /nfs/dbraw/zinc/63/73/81/1404637381.db2.gz PGEJDSUGUFGWIK-UHFFFAOYSA-N 2 1 394.563 3.474 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000047777638 1404938468 /nfs/dbraw/zinc/93/84/68/1404938468.db2.gz QBFZHYMCCXKKNO-OAQYLSRUSA-N 2 1 396.535 3.164 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2sccc2C1 ZINC000047966036 1405012428 /nfs/dbraw/zinc/01/24/28/1405012428.db2.gz UGAQUEDZBZJSMO-XLIONFOSSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2sccc2C1 ZINC000047966036 1405012440 /nfs/dbraw/zinc/01/24/40/1405012440.db2.gz UGAQUEDZBZJSMO-XLIONFOSSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2sccc2C1 ZINC000047966036 1405012450 /nfs/dbraw/zinc/01/24/50/1405012450.db2.gz UGAQUEDZBZJSMO-XLIONFOSSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2sccc2C1 ZINC000047966036 1405012459 /nfs/dbraw/zinc/01/24/59/1405012459.db2.gz UGAQUEDZBZJSMO-XLIONFOSSA-N 2 1 398.576 3.068 20 0 GGADMP CC[NH+]1CCC(NC(=O)NCc2ccc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cc2)CC1 ZINC000047978914 1405014771 /nfs/dbraw/zinc/01/47/71/1405014771.db2.gz FYJPCUMSCNKKAL-KDURUIRLSA-N 2 1 386.584 3.448 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCC(C)(C)[NH+]3CCCCC3)cc2)C[C@H](C)O1 ZINC000048178239 1405087475 /nfs/dbraw/zinc/08/74/75/1405087475.db2.gz LDYLTLMDNYGTEV-KDURUIRLSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCC(C)(C)[NH+]3CCCCC3)cc2)C[C@H](C)O1 ZINC000048178239 1405087483 /nfs/dbraw/zinc/08/74/83/1405087483.db2.gz LDYLTLMDNYGTEV-KDURUIRLSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)NC2CC[NH+](C3CC3)CC2)C1 ZINC000048394819 1405177605 /nfs/dbraw/zinc/17/76/05/1405177605.db2.gz RZQFSDUAGYSFJA-GOSISDBHSA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C[NH+]1CCCCC1 ZINC000050136848 1405496825 /nfs/dbraw/zinc/49/68/25/1405496825.db2.gz HJELRMOUXDIUEF-OALUTQOASA-N 2 1 392.613 3.381 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)C[NH+]1CCCCC1 ZINC000050136851 1405496883 /nfs/dbraw/zinc/49/68/83/1405496883.db2.gz HJELRMOUXDIUEF-RTBURBONSA-N 2 1 392.613 3.381 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)C[NH+]1CCCCC1 ZINC000050136850 1405497404 /nfs/dbraw/zinc/49/74/04/1405497404.db2.gz HJELRMOUXDIUEF-RBUKOAKNSA-N 2 1 392.613 3.381 20 0 GGADMP CCc1cccc(CC)c1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959244 1405889644 /nfs/dbraw/zinc/88/96/44/1405889644.db2.gz KCNZTONEKJSUPL-SFHVURJKSA-N 2 1 387.568 3.183 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959106 1405889860 /nfs/dbraw/zinc/88/98/60/1405889860.db2.gz AOZLNHMRUMVYEO-SFHVURJKSA-N 2 1 387.568 3.355 20 0 GGADMP C[C@H](NC(=O)C[NH+]1CCC(C[NH+]2CCOCC2)CC1)c1cccc2ccccc21 ZINC000051957944 1405889872 /nfs/dbraw/zinc/88/98/72/1405889872.db2.gz KYIRWBYXKHDNCJ-IBGZPJMESA-N 2 1 395.547 3.061 20 0 GGADMP Fc1ccc(-c2nc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)cs2)cc1 ZINC000051958236 1405890034 /nfs/dbraw/zinc/89/00/34/1405890034.db2.gz KLMMLFWIDOLFKM-UHFFFAOYSA-N 2 1 375.513 3.493 20 0 GGADMP C[C@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959113 1405890046 /nfs/dbraw/zinc/89/00/46/1405890046.db2.gz AOZLNHMRUMVYEO-GOSISDBHSA-N 2 1 387.568 3.355 20 0 GGADMP Cc1ccc(-c2noc([C@H](C)[NH+]3CCC(C[NH+]4CCOCC4)CC3)n2)cc1F ZINC000051959868 1405890617 /nfs/dbraw/zinc/89/06/17/1405890617.db2.gz CXFLILFUGZFEHY-INIZCTEOSA-N 2 1 388.487 3.289 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2ccc3c(c2)OCCCO3)CC1 ZINC000052208315 1405982672 /nfs/dbraw/zinc/98/26/72/1405982672.db2.gz ZTFPLRIQKDBKNC-UHFFFAOYSA-N 2 1 389.540 3.230 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2ccc3c(c2)OCCCO3)CC1 ZINC000052208315 1405982689 /nfs/dbraw/zinc/98/26/89/1405982689.db2.gz ZTFPLRIQKDBKNC-UHFFFAOYSA-N 2 1 389.540 3.230 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(S(=O)(=O)N3CCCC3)o2)CC1 ZINC000052210071 1405984766 /nfs/dbraw/zinc/98/47/66/1405984766.db2.gz MDDXUFYQNVZXBI-UHFFFAOYSA-N 2 1 397.585 3.008 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(S(=O)(=O)N3CCCC3)o2)CC1 ZINC000052210071 1405984784 /nfs/dbraw/zinc/98/47/84/1405984784.db2.gz MDDXUFYQNVZXBI-UHFFFAOYSA-N 2 1 397.585 3.008 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N(C)Cc2ccccc2OC)CC1 ZINC000052209365 1405985168 /nfs/dbraw/zinc/98/51/68/1405985168.db2.gz RKWPLAYPBLPJHY-UHFFFAOYSA-N 2 1 375.557 3.098 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H](O)Cn2cnc3cc(C)c(C)cc32)CC1 ZINC000052210269 1405985330 /nfs/dbraw/zinc/98/53/30/1405985330.db2.gz HZHJWBZJAHBLPT-OAQYLSRUSA-N 2 1 386.584 3.458 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[NH+]1CCCCC1 ZINC000052554791 1406082303 /nfs/dbraw/zinc/08/23/03/1406082303.db2.gz IHACDHUUXURJOT-INIZCTEOSA-N 2 1 394.510 3.103 20 0 GGADMP COCc1cccc(CNC(=O)C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000052713956 1406134419 /nfs/dbraw/zinc/13/44/19/1406134419.db2.gz UGPWLVHBWFFDOX-UHFFFAOYSA-N 2 1 387.568 3.037 20 0 GGADMP COCc1ccc(CNC(=O)C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000052713868 1406134626 /nfs/dbraw/zinc/13/46/26/1406134626.db2.gz SKZZPFJPVIHXDZ-UHFFFAOYSA-N 2 1 387.568 3.037 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000056950317 1407482420 /nfs/dbraw/zinc/48/24/20/1407482420.db2.gz PLYMIBBMECSCOU-LEWJYISDSA-N 2 1 384.499 3.002 20 0 GGADMP CC[NH+](CC)CCN(CC(C)C)C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000057126760 1407530077 /nfs/dbraw/zinc/53/00/77/1407530077.db2.gz IHYLUDYLYWELRJ-UHFFFAOYSA-N 2 1 386.544 3.085 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NCc1ccc(-n2cc[nH+]c2C)nc1)CC(C)C ZINC000057127982 1407531171 /nfs/dbraw/zinc/53/11/71/1407531171.db2.gz HXDNQPLNWNYEDE-LJQANCHMSA-N 2 1 386.544 3.131 20 0 GGADMP C#CC[NH+]1CCC(C(=O)NCc2ccccc2C[N@@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000057173083 1407544242 /nfs/dbraw/zinc/54/42/42/1407544242.db2.gz FZDAHISMLKGFGB-BGYRXZFFSA-N 2 1 381.564 3.126 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000057552306 1407647736 /nfs/dbraw/zinc/64/77/36/1407647736.db2.gz AUSJEKVKDBVTBL-WOIUINJBSA-N 2 1 387.568 3.242 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CCC[N@H+](C(C)(C)C)CC2)CC1 ZINC000057611605 1407665037 /nfs/dbraw/zinc/66/50/37/1407665037.db2.gz DLPIJYAGEWKNEZ-UHFFFAOYSA-N 2 1 386.584 3.475 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)CC1 ZINC000057615866 1407668239 /nfs/dbraw/zinc/66/82/39/1407668239.db2.gz YKKJTMIDAYZFBY-UHFFFAOYSA-N 2 1 390.547 3.306 20 0 GGADMP C[C@H](CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)[NH+](C)C1CC1 ZINC000057705819 1407694663 /nfs/dbraw/zinc/69/46/63/1407694663.db2.gz BYLCPESWLKLWGG-BEFAXECRSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@H](CNC(=O)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)[N@H+](C)C1CC1 ZINC000057705819 1407694676 /nfs/dbraw/zinc/69/46/76/1407694676.db2.gz BYLCPESWLKLWGG-BEFAXECRSA-N 2 1 383.458 3.040 20 0 GGADMP C[C@H](CNC(=O)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1)[N@@H+](C)C1CC1 ZINC000057705819 1407694683 /nfs/dbraw/zinc/69/46/83/1407694683.db2.gz BYLCPESWLKLWGG-BEFAXECRSA-N 2 1 383.458 3.040 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CNC(=S)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000057817354 1407726502 /nfs/dbraw/zinc/72/65/02/1407726502.db2.gz MMBZCUFYVPSPFJ-LJQANCHMSA-N 2 1 392.638 3.049 20 0 GGADMP COc1ccccc1CNC(=O)C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000057843694 1407735215 /nfs/dbraw/zinc/73/52/15/1407735215.db2.gz LVHGXUSTHZBUDZ-UHFFFAOYSA-N 2 1 395.547 3.155 20 0 GGADMP COc1ccccc1[C@@H](C)NC(=O)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000057889101 1407747614 /nfs/dbraw/zinc/74/76/14/1407747614.db2.gz QCHALBMGKZBYTJ-LJQANCHMSA-N 2 1 387.568 3.460 20 0 GGADMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC2CC[NH+](CCOC(C)C)CC2)C1 ZINC000176349693 1428263075 /nfs/dbraw/zinc/26/30/75/1428263075.db2.gz XSKHCPBXQKSVTL-IBGZPJMESA-N 2 1 396.620 3.076 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000176351868 1428263962 /nfs/dbraw/zinc/26/39/62/1428263962.db2.gz DCCGONBAFWBEHS-SQNIBIBYSA-N 2 1 376.570 3.153 20 0 GGADMP CC(C)[N@H+](C)CC1CCN(C(=O)[C@@H](c2ccccc2)[NH+]2CCSCC2)CC1 ZINC000058861421 1407891015 /nfs/dbraw/zinc/89/10/15/1407891015.db2.gz LMTDRRHLOCCXKE-OAQYLSRUSA-N 2 1 389.609 3.355 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)[C@@H](c2ccccc2)[NH+]2CCSCC2)CC1 ZINC000058861421 1407891020 /nfs/dbraw/zinc/89/10/20/1407891020.db2.gz LMTDRRHLOCCXKE-OAQYLSRUSA-N 2 1 389.609 3.355 20 0 GGADMP Cc1cccc(C)c1NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368443 1407962342 /nfs/dbraw/zinc/96/23/42/1407962342.db2.gz XJFHUCCAIONZNF-HSALFYBXSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1cccc(C)c1NC(=O)[C@@H](C)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368443 1407962351 /nfs/dbraw/zinc/96/23/51/1407962351.db2.gz XJFHUCCAIONZNF-HSALFYBXSA-N 2 1 387.568 3.452 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368465 1407962510 /nfs/dbraw/zinc/96/25/10/1407962510.db2.gz PADZMROQCXMFMS-BBWFWOEESA-N 2 1 393.959 3.488 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368465 1407962516 /nfs/dbraw/zinc/96/25/16/1407962516.db2.gz PADZMROQCXMFMS-BBWFWOEESA-N 2 1 393.959 3.488 20 0 GGADMP Cc1ccc(-c2nnc(C[NH+]3CCC(C[N@@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)o2)cc1 ZINC000060368527 1407962542 /nfs/dbraw/zinc/96/25/42/1407962542.db2.gz CGUCZUMNOGDLTI-HDICACEKSA-N 2 1 384.524 3.366 20 0 GGADMP Cc1ccc(-c2nnc(C[NH+]3CCC(C[N@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)o2)cc1 ZINC000060368527 1407962548 /nfs/dbraw/zinc/96/25/48/1407962548.db2.gz CGUCZUMNOGDLTI-HDICACEKSA-N 2 1 384.524 3.366 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)[C@@H]1CCC[NH+]1Cc1ccccc1 ZINC000060581526 1408006362 /nfs/dbraw/zinc/00/63/62/1408006362.db2.gz UFNSIMJASUVTOO-QHCPKHFHSA-N 2 1 377.532 3.216 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000060581526 1408006372 /nfs/dbraw/zinc/00/63/72/1408006372.db2.gz UFNSIMJASUVTOO-QHCPKHFHSA-N 2 1 377.532 3.216 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000060581526 1408006379 /nfs/dbraw/zinc/00/63/79/1408006379.db2.gz UFNSIMJASUVTOO-QHCPKHFHSA-N 2 1 377.532 3.216 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N[C@@H]1CC[NH+](CC2CCCC2)C1 ZINC000176375629 1428282979 /nfs/dbraw/zinc/28/29/79/1428282979.db2.gz WKLHCSWZMUXWSM-XZOQPEGZSA-N 2 1 398.595 3.115 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC000176375629 1428282987 /nfs/dbraw/zinc/28/29/87/1428282987.db2.gz WKLHCSWZMUXWSM-XZOQPEGZSA-N 2 1 398.595 3.115 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000176375629 1428282994 /nfs/dbraw/zinc/28/29/94/1428282994.db2.gz WKLHCSWZMUXWSM-XZOQPEGZSA-N 2 1 398.595 3.115 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000060954812 1408056238 /nfs/dbraw/zinc/05/62/38/1408056238.db2.gz KORBQRQSAZHDKD-FGZHOGPDSA-N 2 1 380.536 3.253 20 0 GGADMP CCN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(OC)c(OC)c3)cc2)CC1 ZINC000061070126 1408073836 /nfs/dbraw/zinc/07/38/36/1408073836.db2.gz SLBBTUINVVLPDX-UHFFFAOYSA-N 2 1 383.536 3.131 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000061113364 1408078892 /nfs/dbraw/zinc/07/88/92/1408078892.db2.gz SYIRNTYHXSFAHE-RBUKOAKNSA-N 2 1 386.565 3.315 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)C[NH+]1CCCCC1 ZINC000061788924 1408176712 /nfs/dbraw/zinc/17/67/12/1408176712.db2.gz MWCHKKHSKOFXFU-GOSISDBHSA-N 2 1 390.597 3.479 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H](Cc2ccccc2)[NH+](C)C)c1 ZINC000061795578 1408179043 /nfs/dbraw/zinc/17/90/43/1408179043.db2.gz XFHIBRYBAGCQCZ-JOCHJYFZSA-N 2 1 382.552 3.110 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@@H](c2ccccc2OC)[NH+](C)C)c1 ZINC000061795516 1408179105 /nfs/dbraw/zinc/17/91/05/1408179105.db2.gz VHMSMDTYENRCIT-NRFANRHFSA-N 2 1 398.551 3.249 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H](c2ccccc2OC)[NH+](C)C)c1 ZINC000061795516 1408179111 /nfs/dbraw/zinc/17/91/11/1408179111.db2.gz VHMSMDTYENRCIT-NRFANRHFSA-N 2 1 398.551 3.249 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=S)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000063145024 1408307345 /nfs/dbraw/zinc/30/73/45/1408307345.db2.gz NWCYAJDDWYRHRM-IBGZPJMESA-N 2 1 388.625 3.380 20 0 GGADMP C[NH+](C)C1(CNC(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CCCCC1 ZINC000063464655 1408358883 /nfs/dbraw/zinc/35/88/83/1408358883.db2.gz WPIJMPFQGFQTOY-OAQYLSRUSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)c2)CCO1 ZINC000063524195 1408368010 /nfs/dbraw/zinc/36/80/10/1408368010.db2.gz ROBONPAUAVMHQY-FQEVSTJZSA-N 3 1 397.563 3.138 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)c2)CCO1 ZINC000063524195 1408368021 /nfs/dbraw/zinc/36/80/21/1408368021.db2.gz ROBONPAUAVMHQY-FQEVSTJZSA-N 3 1 397.563 3.138 20 0 GGADMP COc1cc(C[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)ccc1SC ZINC000063915677 1408445049 /nfs/dbraw/zinc/44/50/49/1408445049.db2.gz QYHLFDVTWSEGJQ-UHFFFAOYSA-N 2 1 385.577 3.454 20 0 GGADMP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000176452065 1428324649 /nfs/dbraw/zinc/32/46/49/1428324649.db2.gz BMCWLOMVWNIISZ-MSOLQXFVSA-N 2 1 385.487 3.088 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000176452065 1428324657 /nfs/dbraw/zinc/32/46/57/1428324657.db2.gz BMCWLOMVWNIISZ-MSOLQXFVSA-N 2 1 385.487 3.088 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NC[C@H](c2ccco2)[NH+](C)C)[NH+]2CCCC2)cc1 ZINC000064237634 1408519481 /nfs/dbraw/zinc/51/94/81/1408519481.db2.gz XTALBLUHIQFJEE-WOJBJXKFSA-N 2 1 384.524 3.327 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1)c1ccco1 ZINC000064251430 1408520689 /nfs/dbraw/zinc/52/06/89/1408520689.db2.gz WVFCPAANVICQLN-GOSISDBHSA-N 2 1 390.553 3.155 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000176467092 1428329807 /nfs/dbraw/zinc/32/98/07/1428329807.db2.gz RIAGAFVZXWUJPH-MOPGFXCFSA-N 2 1 390.597 3.228 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000064344492 1408537683 /nfs/dbraw/zinc/53/76/83/1408537683.db2.gz RLSWPVUPVHFVQI-INIZCTEOSA-N 2 1 379.932 3.101 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000176467689 1428329909 /nfs/dbraw/zinc/32/99/09/1428329909.db2.gz XRSGBDKVIJUHTN-OTWHNJEPSA-N 2 1 390.597 3.228 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000176467689 1428329914 /nfs/dbraw/zinc/32/99/14/1428329914.db2.gz XRSGBDKVIJUHTN-OTWHNJEPSA-N 2 1 390.597 3.228 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000176467689 1428329919 /nfs/dbraw/zinc/32/99/19/1428329919.db2.gz XRSGBDKVIJUHTN-OTWHNJEPSA-N 2 1 390.597 3.228 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NCCC[N@H+](C)Cc2ccccc2)[NH+](C)C)cc1 ZINC000065466989 1408673472 /nfs/dbraw/zinc/67/34/72/1408673472.db2.gz ZFCGNXLXPRCPJS-JOCHJYFZSA-N 2 1 382.552 3.419 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)[NH+](C)C)cc1 ZINC000065470043 1408673830 /nfs/dbraw/zinc/67/38/30/1408673830.db2.gz YCVHFEZESHIABU-FCHUYYIVSA-N 2 1 380.536 3.296 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)[NH+](C)C)cc1 ZINC000065470043 1408673834 /nfs/dbraw/zinc/67/38/34/1408673834.db2.gz YCVHFEZESHIABU-FCHUYYIVSA-N 2 1 380.536 3.296 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)NC[C@@H](C)[NH+]3CCC(C)CC3)CC2)cc1 ZINC000065477367 1408675498 /nfs/dbraw/zinc/67/54/98/1408675498.db2.gz YEDNKSRGHMDHQK-OAQYLSRUSA-N 2 1 386.584 3.333 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H](C)[N@H+]1CCc2ccccc2C1)c1ccco1 ZINC000065481473 1408676696 /nfs/dbraw/zinc/67/66/96/1408676696.db2.gz SDBDGXIDQRIKKX-WIYYLYMNSA-N 2 1 398.551 3.409 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[NH+](Cc2cccc(C)c2)CC1)c1ccco1 ZINC000065482692 1408677374 /nfs/dbraw/zinc/67/73/74/1408677374.db2.gz OKYIZYKQVQVTIB-OAQYLSRUSA-N 2 1 398.551 3.498 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000065518283 1408682567 /nfs/dbraw/zinc/68/25/67/1408682567.db2.gz GVAOOOLVMRKTRL-HSZRJFAPSA-N 2 1 394.563 3.460 20 0 GGADMP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000065521755 1408683650 /nfs/dbraw/zinc/68/36/50/1408683650.db2.gz OKSLFQQIWMWJSI-REWPJTCUSA-N 2 1 392.547 3.349 20 0 GGADMP C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)N2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000065521755 1408683654 /nfs/dbraw/zinc/68/36/54/1408683654.db2.gz OKSLFQQIWMWJSI-REWPJTCUSA-N 2 1 392.547 3.349 20 0 GGADMP CCc1ccc([C@H](CNC(=O)NCC[N@@H+](C)Cc2ccccc2)[NH+](C)C)cc1 ZINC000065541622 1408686272 /nfs/dbraw/zinc/68/62/72/1408686272.db2.gz XTYYJSKHBULKLR-QFIPXVFZSA-N 2 1 382.552 3.283 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000065542737 1408686577 /nfs/dbraw/zinc/68/65/77/1408686577.db2.gz KNUYFKYINATKCP-UHFFFAOYSA-N 2 1 394.563 3.344 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)NCC[NH+](C)Cc2ccccc2)CC1 ZINC000065542737 1408686583 /nfs/dbraw/zinc/68/65/83/1408686583.db2.gz KNUYFKYINATKCP-UHFFFAOYSA-N 2 1 394.563 3.344 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)NCC[NH+](C)Cc2ccccc2)CC1 ZINC000065542737 1408686589 /nfs/dbraw/zinc/68/65/89/1408686589.db2.gz KNUYFKYINATKCP-UHFFFAOYSA-N 2 1 394.563 3.344 20 0 GGADMP CC(C)[NH+]1CCN(c2ccc(C(=O)NC[C@H](C)[N@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000065750048 1408723893 /nfs/dbraw/zinc/72/38/93/1408723893.db2.gz KWPVEWSOWLLITF-PMACEKPBSA-N 2 1 386.584 3.067 20 0 GGADMP Cc1cc(C)cc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)c1 ZINC000065932474 1408757074 /nfs/dbraw/zinc/75/70/74/1408757074.db2.gz TVDGEOPIHRFQOQ-UHFFFAOYSA-N 2 1 381.520 3.254 20 0 GGADMP C[N@H+](CC(=O)Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)Cc1ccccc1 ZINC000066051809 1408779149 /nfs/dbraw/zinc/77/91/49/1408779149.db2.gz JZPXJOGIHYWACU-UHFFFAOYSA-N 2 1 392.547 3.289 20 0 GGADMP C[N@@H+](CC(=O)Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)Cc1ccccc1 ZINC000066051809 1408779154 /nfs/dbraw/zinc/77/91/54/1408779154.db2.gz JZPXJOGIHYWACU-UHFFFAOYSA-N 2 1 392.547 3.289 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)N2CC[C@H]([NH+]3CCCC3)C2)cc1 ZINC000066178601 1408787599 /nfs/dbraw/zinc/78/75/99/1408787599.db2.gz QZZMNAKNFAWIPX-UGKGYDQZSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)N1CC[C@H]([NH+]2CCCC2)C1 ZINC000066178603 1408787742 /nfs/dbraw/zinc/78/77/42/1408787742.db2.gz SQRSUUJWXSYIPM-UGKGYDQZSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N2CC[C@H]([NH+]3CCCC3)C2)C1 ZINC000066178617 1408787782 /nfs/dbraw/zinc/78/77/82/1408787782.db2.gz IDYKZMZFZZAPSN-UGKGYDQZSA-N 2 1 384.568 3.298 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000066192032 1408789457 /nfs/dbraw/zinc/78/94/57/1408789457.db2.gz FCNWGHFHRVVFMY-GOSISDBHSA-N 2 1 392.613 3.476 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@@H](c2ccccc2OC)[NH+]2CCCC2)cc1 ZINC000066242307 1408794658 /nfs/dbraw/zinc/79/46/58/1408794658.db2.gz ISLOOAQIGGQHSU-NRFANRHFSA-N 2 1 396.535 3.197 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000066243809 1408795257 /nfs/dbraw/zinc/79/52/57/1408795257.db2.gz JBSITVVZKKMFFY-OAQYLSRUSA-N 2 1 380.536 3.264 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)CC1 ZINC000066395424 1408830272 /nfs/dbraw/zinc/83/02/72/1408830272.db2.gz VUSGQSGITOZEGF-RTBURBONSA-N 2 1 387.568 3.242 20 0 GGADMP C[C@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)[N@H+]1CCc2ccccc2C1 ZINC000066410425 1408832609 /nfs/dbraw/zinc/83/26/09/1408832609.db2.gz SJJBQHZXZFGWSV-LJQANCHMSA-N 2 1 377.532 3.459 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(OC(C)C)cc3)CC2)CC1 ZINC000066568064 1408858599 /nfs/dbraw/zinc/85/85/99/1408858599.db2.gz MFVGHBQOIZXCOX-UHFFFAOYSA-N 2 1 387.568 3.240 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cccc(OC(F)F)c3)CC2)CC1 ZINC000066568086 1408858848 /nfs/dbraw/zinc/85/88/48/1408858848.db2.gz DNMVMEXTJWGKGD-UHFFFAOYSA-N 2 1 395.494 3.054 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)Nc1ccc(N2CC[NH+](C)CC2)c(C)c1)c1ccccc1 ZINC000066622329 1408871051 /nfs/dbraw/zinc/87/10/51/1408871051.db2.gz AXRWIQRVDDLDHR-QFIPXVFZSA-N 2 1 380.536 3.378 20 0 GGADMP CC[NH+]1CCC(n2nccc2NC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000066662676 1408878993 /nfs/dbraw/zinc/87/89/93/1408878993.db2.gz ZAKJPQZFXQQHIR-HXUWFJFHSA-N 2 1 395.551 3.391 20 0 GGADMP CC(C)[C@@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000066914747 1408950092 /nfs/dbraw/zinc/95/00/92/1408950092.db2.gz ULEIKGJILBUAPR-KNKQGSTJSA-N 2 1 387.568 3.032 20 0 GGADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3ccccc3N3CCOCC3)CC2)cc1 ZINC000066972370 1408969809 /nfs/dbraw/zinc/96/98/09/1408969809.db2.gz JKRMILVBVMHTAB-UHFFFAOYSA-N 2 1 379.548 3.320 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2ccccc2N2CCOCC2)cc1F ZINC000066989607 1408973320 /nfs/dbraw/zinc/97/33/20/1408973320.db2.gz PBHFPPCWXRNBAZ-UHFFFAOYSA-N 2 1 380.467 3.446 20 0 GGADMP C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2ccccc2OC(F)(F)F)c1 ZINC000066994624 1408974589 /nfs/dbraw/zinc/97/45/89/1408974589.db2.gz LNLDHWUMZJQQJU-UHFFFAOYSA-N 2 1 395.425 3.166 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(OCC(N)=O)cc2)C1 ZINC000067120843 1409012988 /nfs/dbraw/zinc/01/29/88/1409012988.db2.gz MUQWBHJHKNUXQU-GOSISDBHSA-N 2 1 381.520 3.072 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(OCC(N)=O)cc3)cc2)C1 ZINC000067120732 1409013272 /nfs/dbraw/zinc/01/32/72/1409013272.db2.gz UJPNIILPVQASEK-GOSISDBHSA-N 2 1 381.520 3.072 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccccc1OCC(=O)N(C)C ZINC000067188124 1409035706 /nfs/dbraw/zinc/03/57/06/1409035706.db2.gz MSICYAAPZMRKTP-UHFFFAOYSA-N 2 1 383.536 3.284 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)N2CCC(C[NH+](C)Cc3ccccc3)CC2)C1 ZINC000067282588 1409063690 /nfs/dbraw/zinc/06/36/90/1409063690.db2.gz KWIFALDLWAOFED-JOCHJYFZSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CC[C@H](CNC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1 ZINC000067282588 1409063694 /nfs/dbraw/zinc/06/36/94/1409063694.db2.gz KWIFALDLWAOFED-JOCHJYFZSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CC[C@H](CNC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C1 ZINC000067282588 1409063697 /nfs/dbraw/zinc/06/36/97/1409063697.db2.gz KWIFALDLWAOFED-JOCHJYFZSA-N 2 1 386.584 3.270 20 0 GGADMP COc1ccc(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1Br ZINC000067453117 1409122738 /nfs/dbraw/zinc/12/27/38/1409122738.db2.gz POISJXLYBLCSLS-GASCZTMLSA-N 2 1 385.346 3.437 20 0 GGADMP Cn1cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000067507070 1409139781 /nfs/dbraw/zinc/13/97/81/1409139781.db2.gz QRSNRCIVOSWGTO-FQEVSTJZSA-N 2 1 375.520 3.484 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCC[N@H+]2CCCC[C@H]2C)cc1F ZINC000067646349 1409195844 /nfs/dbraw/zinc/19/58/44/1409195844.db2.gz OBCNDIUEJANBGM-MRXNPFEDSA-N 2 1 387.503 3.384 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCC[N@@H+]2CCCC[C@H]2C)cc1F ZINC000067646349 1409195850 /nfs/dbraw/zinc/19/58/50/1409195850.db2.gz OBCNDIUEJANBGM-MRXNPFEDSA-N 2 1 387.503 3.384 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCc2ccc(C[NH+](C)C)cc2)cc1F ZINC000067646337 1409196105 /nfs/dbraw/zinc/19/61/05/1409196105.db2.gz UXZBADGJNWTVNB-UHFFFAOYSA-N 2 1 395.482 3.381 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1F ZINC000067646479 1409196123 /nfs/dbraw/zinc/19/61/23/1409196123.db2.gz DTOVDXZKMWCDKS-UHFFFAOYSA-N 2 1 387.503 3.428 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCC[NH+]2CCC(C)CC2)cc1F ZINC000067646275 1409196154 /nfs/dbraw/zinc/19/61/54/1409196154.db2.gz CXKVNMCUYRXPNZ-UHFFFAOYSA-N 2 1 387.503 3.241 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[C@H]([NH+]3CCCC3)C2)cc1F ZINC000067646745 1409197329 /nfs/dbraw/zinc/19/73/29/1409197329.db2.gz LNKWZEPXEZDILE-SFHVURJKSA-N 2 1 385.487 3.090 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@@H](C)C2)C1 ZINC000067683789 1409206155 /nfs/dbraw/zinc/20/61/55/1409206155.db2.gz YVGSHISVXPARFL-UXHICEINSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000067683789 1409206160 /nfs/dbraw/zinc/20/61/60/1409206160.db2.gz YVGSHISVXPARFL-UXHICEINSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000067683789 1409206168 /nfs/dbraw/zinc/20/61/68/1409206168.db2.gz YVGSHISVXPARFL-UXHICEINSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000067684751 1409207234 /nfs/dbraw/zinc/20/72/34/1409207234.db2.gz MYAXHXFSBWHBJB-FQEVSTJZSA-N 2 1 386.584 3.448 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000067691555 1409207615 /nfs/dbraw/zinc/20/76/15/1409207615.db2.gz RIXMYQULROHOSO-HXUWFJFHSA-N 2 1 387.568 3.290 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000067772753 1409227198 /nfs/dbraw/zinc/22/71/98/1409227198.db2.gz KHUTYGSSBROXAS-HXUWFJFHSA-N 2 1 384.524 3.094 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)c2)CCO1 ZINC000067976536 1409267810 /nfs/dbraw/zinc/26/78/10/1409267810.db2.gz ROBONPAUAVMHQY-HXUWFJFHSA-N 3 1 397.563 3.138 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)c2)CCO1 ZINC000067976536 1409267821 /nfs/dbraw/zinc/26/78/21/1409267821.db2.gz ROBONPAUAVMHQY-HXUWFJFHSA-N 3 1 397.563 3.138 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NCCC[NH+]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000068007626 1409275130 /nfs/dbraw/zinc/27/51/30/1409275130.db2.gz XCQBPNANXJZVIR-SLFFLAALSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NCCC[NH+]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000068007626 1409275132 /nfs/dbraw/zinc/27/51/32/1409275132.db2.gz XCQBPNANXJZVIR-SLFFLAALSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCCC[N@@H+]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000068007626 1409275134 /nfs/dbraw/zinc/27/51/34/1409275134.db2.gz XCQBPNANXJZVIR-SLFFLAALSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCCC[N@H+]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000068007626 1409275135 /nfs/dbraw/zinc/27/51/35/1409275135.db2.gz XCQBPNANXJZVIR-SLFFLAALSA-N 2 1 387.568 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H](C3CCCCC3)[NH+](C)C)CC2)cs1 ZINC000068277760 1409350209 /nfs/dbraw/zinc/35/02/09/1409350209.db2.gz QFLLFWQATCMKFN-FQEVSTJZSA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N3CCC[C@@H]3C[NH+]3CCCCC3)CC2)cs1 ZINC000068354250 1409376919 /nfs/dbraw/zinc/37/69/19/1409376919.db2.gz RDHLCXADEZXEMS-HXUWFJFHSA-N 2 1 390.597 3.140 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N3CCC[C@H]3C[NH+]3CCCCC3)CC2)cs1 ZINC000068354251 1409377050 /nfs/dbraw/zinc/37/70/50/1409377050.db2.gz RDHLCXADEZXEMS-FQEVSTJZSA-N 2 1 390.597 3.140 20 0 GGADMP C[NH+](C)CCC(=O)Nc1ccc(NC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000068441996 1409404041 /nfs/dbraw/zinc/40/40/41/1409404041.db2.gz YGTZSJWWZQJZPQ-OAQYLSRUSA-N 2 1 394.519 3.180 20 0 GGADMP CC(C)[N@@H+](C)CC(=O)N1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000068443998 1409404586 /nfs/dbraw/zinc/40/45/86/1409404586.db2.gz AFRURVONCWQMBX-UHFFFAOYSA-N 2 1 385.474 3.468 20 0 GGADMP CC(C)[NH+](C)CC(=O)N1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000068443998 1409404589 /nfs/dbraw/zinc/40/45/89/1409404589.db2.gz AFRURVONCWQMBX-UHFFFAOYSA-N 2 1 385.474 3.468 20 0 GGADMP CC(C)[NH+](C)CC(=O)N1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000068443998 1409404594 /nfs/dbraw/zinc/40/45/94/1409404594.db2.gz AFRURVONCWQMBX-UHFFFAOYSA-N 2 1 385.474 3.468 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C1 ZINC000068546747 1409434718 /nfs/dbraw/zinc/43/47/18/1409434718.db2.gz SDXDFQAMSWYSMP-GOSISDBHSA-N 2 1 380.964 3.145 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000068564293 1409439962 /nfs/dbraw/zinc/43/99/62/1409439962.db2.gz UXKYWXADXYKBIZ-HXUWFJFHSA-N 2 1 384.524 3.368 20 0 GGADMP CC(C)[N@H+]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)CC1 ZINC000068777508 1409490580 /nfs/dbraw/zinc/49/05/80/1409490580.db2.gz ROFYLXWJZUZLSZ-FQEVSTJZSA-N 2 1 397.485 3.384 20 0 GGADMP CC(C)[NH+]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000068777508 1409490583 /nfs/dbraw/zinc/49/05/83/1409490583.db2.gz ROFYLXWJZUZLSZ-FQEVSTJZSA-N 2 1 397.485 3.384 20 0 GGADMP CC(C)[NH+]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000068777508 1409490587 /nfs/dbraw/zinc/49/05/87/1409490587.db2.gz ROFYLXWJZUZLSZ-FQEVSTJZSA-N 2 1 397.485 3.384 20 0 GGADMP CC(C)OCC[NH+]1CCC(NC(=O)[C@@H]2CCCC[N@H+]2Cc2ccccc2)CC1 ZINC000176689765 1428409284 /nfs/dbraw/zinc/40/92/84/1428409284.db2.gz IUHVWOPYCFMLBP-QFIPXVFZSA-N 2 1 387.568 3.047 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)CCc1ccccc1F ZINC000068861186 1409509716 /nfs/dbraw/zinc/50/97/16/1409509716.db2.gz KRAIMTBQGHDZPH-IBGZPJMESA-N 2 1 397.538 3.469 20 0 GGADMP Cc1cc(C)c(NC(=O)C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000069017208 1409544410 /nfs/dbraw/zinc/54/44/10/1409544410.db2.gz XEZCHWKDYJCZOM-BGYRXZFFSA-N 2 1 387.568 3.372 20 0 GGADMP Cc1cc(C)c(NC(=O)C[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000069017208 1409544413 /nfs/dbraw/zinc/54/44/13/1409544413.db2.gz XEZCHWKDYJCZOM-BGYRXZFFSA-N 2 1 387.568 3.372 20 0 GGADMP C[C@@H](NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1)c1cc2ccccc2o1 ZINC000069028987 1409546903 /nfs/dbraw/zinc/54/69/03/1409546903.db2.gz NCQWAGCNSOGEFK-MSOLQXFVSA-N 2 1 399.535 3.043 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)c1ccc(C[NH+]2CCCC2)cc1)[NH+](C)C ZINC000069180384 1409582271 /nfs/dbraw/zinc/58/22/71/1409582271.db2.gz HZZWGVBLXAVPJB-NRFANRHFSA-N 2 1 381.520 3.324 20 0 GGADMP CC[NH+](CC)CCOc1ccccc1NC(=O)N1CCC[N@H+](C(C)C)CC1 ZINC000069624403 1409666499 /nfs/dbraw/zinc/66/64/99/1409666499.db2.gz IBSYDXFZCHKFFJ-UHFFFAOYSA-N 2 1 376.545 3.355 20 0 GGADMP C[NH+](C)CCOc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000069679199 1409673717 /nfs/dbraw/zinc/67/37/17/1409673717.db2.gz LCULWKLHSPEXQR-UHFFFAOYSA-N 3 1 381.564 3.424 20 0 GGADMP C[NH+](C)CCOc1ccc(CNC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000069679199 1409673718 /nfs/dbraw/zinc/67/37/18/1409673718.db2.gz LCULWKLHSPEXQR-UHFFFAOYSA-N 2 1 381.564 3.424 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CCC[C@H](C[NH+]3CCOCC3)C2)cc1)C(C)C ZINC000069743622 1409687530 /nfs/dbraw/zinc/68/75/30/1409687530.db2.gz SJPNLXHYCYLKJZ-OAQYLSRUSA-N 2 1 387.568 3.101 20 0 GGADMP CC[NH+](CC)CCOc1ccc(CNC(=O)N2CCC[N@H+](C(C)C)CC2)cc1 ZINC000069767103 1409693592 /nfs/dbraw/zinc/69/35/92/1409693592.db2.gz DFYWXYPBNZSFBE-UHFFFAOYSA-N 2 1 390.572 3.033 20 0 GGADMP Cc1cccc(C[NH+]2CCN(C(=O)NCc3ccc(C[NH+](C)C)cc3)CC2)c1 ZINC000071858455 1409827826 /nfs/dbraw/zinc/82/78/26/1409827826.db2.gz SSTVYKJLELPOCW-UHFFFAOYSA-N 2 1 380.536 3.084 20 0 GGADMP O=C(NCC1([NH+]2CCSCC2)CCCC1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000072027848 1409838606 /nfs/dbraw/zinc/83/86/06/1409838606.db2.gz WRFSBJDAQYXMQT-HXUWFJFHSA-N 2 1 387.593 3.129 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccccn2)cc1 ZINC000073404387 1409860584 /nfs/dbraw/zinc/86/05/84/1409860584.db2.gz RPXNBNWGMLBGLF-JOCHJYFZSA-N 2 1 380.536 3.204 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccn2)cc1 ZINC000073404387 1409860585 /nfs/dbraw/zinc/86/05/85/1409860585.db2.gz RPXNBNWGMLBGLF-JOCHJYFZSA-N 2 1 380.536 3.204 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccn2)cc1 ZINC000073404382 1409860646 /nfs/dbraw/zinc/86/06/46/1409860646.db2.gz RPXNBNWGMLBGLF-QFIPXVFZSA-N 2 1 380.536 3.204 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccn2)cc1 ZINC000073404382 1409860648 /nfs/dbraw/zinc/86/06/48/1409860648.db2.gz RPXNBNWGMLBGLF-QFIPXVFZSA-N 2 1 380.536 3.204 20 0 GGADMP CC(C)[N@H+](C)Cc1cccc(CNC(=O)[C@@H]2CCC[NH+]2Cc2ccccn2)c1 ZINC000073549364 1409862466 /nfs/dbraw/zinc/86/24/66/1409862466.db2.gz IENOZOPOIJUOIP-QFIPXVFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(CNC(=O)[C@@H]2CCC[NH+]2Cc2ccccn2)c1 ZINC000073549364 1409862469 /nfs/dbraw/zinc/86/24/69/1409862469.db2.gz IENOZOPOIJUOIP-QFIPXVFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[NH+](C)Cc1cccc(CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccn2)c1 ZINC000073549364 1409862470 /nfs/dbraw/zinc/86/24/70/1409862470.db2.gz IENOZOPOIJUOIP-QFIPXVFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[NH+](C)Cc1cccc(CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccn2)c1 ZINC000073549364 1409862472 /nfs/dbraw/zinc/86/24/72/1409862472.db2.gz IENOZOPOIJUOIP-QFIPXVFZSA-N 2 1 380.536 3.203 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000073618449 1409863222 /nfs/dbraw/zinc/86/32/22/1409863222.db2.gz JAKLMPQGNCRAGA-QFIPXVFZSA-N 2 1 386.584 3.209 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H](CC)[NH+]2CCc3ccccc3C2)C1 ZINC000073657208 1409863579 /nfs/dbraw/zinc/86/35/79/1409863579.db2.gz VJBHQWUIMVESCW-SIKLNZKXSA-N 2 1 386.584 3.197 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NC[C@@H](CC)[N@@H+]2CCc3ccccc3C2)C1 ZINC000073657208 1409863580 /nfs/dbraw/zinc/86/35/80/1409863580.db2.gz VJBHQWUIMVESCW-SIKLNZKXSA-N 2 1 386.584 3.197 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)NC[C@@H](CC)[N@H+]2CCc3ccccc3C2)C1 ZINC000073657208 1409863585 /nfs/dbraw/zinc/86/35/85/1409863585.db2.gz VJBHQWUIMVESCW-SIKLNZKXSA-N 2 1 386.584 3.197 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2)CC1 ZINC000073811052 1409866063 /nfs/dbraw/zinc/86/60/63/1409866063.db2.gz REFQXFJIHDACJW-BHIFYINESA-N 2 1 384.568 3.338 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)[NH+]2CCCC2)o1 ZINC000073981034 1409868001 /nfs/dbraw/zinc/86/80/01/1409868001.db2.gz DVPYZLUPUNHYJL-OALUTQOASA-N 2 1 376.545 3.241 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)[NH+]2CCCC2)o1 ZINC000073981035 1409868182 /nfs/dbraw/zinc/86/81/82/1409868182.db2.gz DVPYZLUPUNHYJL-RTBURBONSA-N 2 1 376.545 3.241 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1 ZINC000074084668 1409868966 /nfs/dbraw/zinc/86/89/66/1409868966.db2.gz VPFOMMNBJJHABK-FCHUYYIVSA-N 2 1 386.584 3.067 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000074084668 1409868967 /nfs/dbraw/zinc/86/89/67/1409868967.db2.gz VPFOMMNBJJHABK-FCHUYYIVSA-N 2 1 386.584 3.067 20 0 GGADMP CN(CC[C@H]1CCCC[NH+]1C)C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000074084668 1409868969 /nfs/dbraw/zinc/86/89/69/1409868969.db2.gz VPFOMMNBJJHABK-FCHUYYIVSA-N 2 1 386.584 3.067 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N1CC[C@@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC000074193520 1409870297 /nfs/dbraw/zinc/87/02/97/1409870297.db2.gz CNJVCVQZSFIEOE-LJQANCHMSA-N 2 1 377.598 3.184 20 0 GGADMP c1ccc(C[NH+]2CCC([NH2+]C[C@H](c3ccccc3)N3CCOCC3)CC2)cc1 ZINC000074230727 1409870659 /nfs/dbraw/zinc/87/06/59/1409870659.db2.gz VIKUBLPFVPBVAW-XMMPIXPASA-N 2 1 379.548 3.314 20 0 GGADMP c1ccc(C[NH+]2CCC([NH2+]C[C@@H](c3ccccc3)N3CCOCC3)CC2)cc1 ZINC000074230726 1409870830 /nfs/dbraw/zinc/87/08/30/1409870830.db2.gz VIKUBLPFVPBVAW-DEOSSOPVSA-N 2 1 379.548 3.314 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)N2CC[NH+](CCOC(C)C)CC2)cc1)C(C)C ZINC000074389596 1409872086 /nfs/dbraw/zinc/87/20/86/1409872086.db2.gz GZZVEJVZHARMOD-UHFFFAOYSA-N 2 1 375.557 3.100 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH+](CCOC(C)C)CC2)cc1)C(C)C ZINC000074389596 1409872088 /nfs/dbraw/zinc/87/20/88/1409872088.db2.gz GZZVEJVZHARMOD-UHFFFAOYSA-N 2 1 375.557 3.100 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000074849376 1409877570 /nfs/dbraw/zinc/87/75/70/1409877570.db2.gz CAVYMQKNQDFQLQ-QFIPXVFZSA-N 2 1 384.568 3.156 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[C@H](C[NH+](C)CC3CC3)C2)C1 ZINC000074852369 1409877585 /nfs/dbraw/zinc/87/75/85/1409877585.db2.gz DQICWKSRVUBERY-SVFBPWRDSA-N 2 1 378.605 3.118 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)C1 ZINC000074852369 1409877588 /nfs/dbraw/zinc/87/75/88/1409877588.db2.gz DQICWKSRVUBERY-SVFBPWRDSA-N 2 1 378.605 3.118 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)C1 ZINC000074852369 1409877590 /nfs/dbraw/zinc/87/75/90/1409877590.db2.gz DQICWKSRVUBERY-SVFBPWRDSA-N 2 1 378.605 3.118 20 0 GGADMP CC(C)[C@@H](CNC(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1)[NH+]1CCC(C)CC1 ZINC000074850587 1409877700 /nfs/dbraw/zinc/87/77/00/1409877700.db2.gz LBZMHKBRHFCGHD-NHCUHLMSSA-N 2 1 378.605 3.116 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)N2CC[C@H](C[NH+](C)CC3CC3)C2)C1 ZINC000074858077 1409878081 /nfs/dbraw/zinc/87/80/81/1409878081.db2.gz BDJZAKVZZKNAGU-WSTZPKSXSA-N 2 1 378.605 3.116 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)C1 ZINC000074858077 1409878083 /nfs/dbraw/zinc/87/80/83/1409878083.db2.gz BDJZAKVZZKNAGU-WSTZPKSXSA-N 2 1 378.605 3.116 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)C1 ZINC000074858077 1409878085 /nfs/dbraw/zinc/87/80/85/1409878085.db2.gz BDJZAKVZZKNAGU-WSTZPKSXSA-N 2 1 378.605 3.116 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2cc(C)ccc2C)CC1 ZINC000075007872 1409880073 /nfs/dbraw/zinc/88/00/73/1409880073.db2.gz JYTOVTYSNVOKNR-IBGZPJMESA-N 2 1 375.557 3.453 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2cc(C)ccc2C)CC1 ZINC000075007873 1409880235 /nfs/dbraw/zinc/88/02/35/1409880235.db2.gz JYTOVTYSNVOKNR-LJQANCHMSA-N 2 1 375.557 3.453 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2ccc(C)cc2C)CC1 ZINC000075007488 1409880240 /nfs/dbraw/zinc/88/02/40/1409880240.db2.gz SUPHUJPTFDENOC-LJQANCHMSA-N 2 1 375.557 3.453 20 0 GGADMP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(OC(F)F)cc3)cc2)CC1 ZINC000075820863 1409883134 /nfs/dbraw/zinc/88/31/34/1409883134.db2.gz WUWREUIZSFZUGP-UHFFFAOYSA-N 2 1 375.463 3.325 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CC[C@@H](CSc3ccccc3)C2)CC1 ZINC000075963888 1409884419 /nfs/dbraw/zinc/88/44/19/1409884419.db2.gz MWXMBAQUBQLQLZ-GOSISDBHSA-N 2 1 375.582 3.090 20 0 GGADMP CC(C)c1nc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)cs1 ZINC000076324881 1409887196 /nfs/dbraw/zinc/88/71/96/1409887196.db2.gz KJDWTHMNIOGKFO-UHFFFAOYSA-N 2 1 380.602 3.183 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)CCc1ccnc2ccccc12 ZINC000076588200 1409890110 /nfs/dbraw/zinc/89/01/10/1409890110.db2.gz LHAGEQVJOCLLSF-FQEVSTJZSA-N 2 1 382.552 3.042 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000077712090 1409899110 /nfs/dbraw/zinc/89/91/10/1409899110.db2.gz KYIPNYMGSMSQHN-JOCHJYFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N3CCC[N@H+]4CCC[C@@H]4C3)cc2)CC1 ZINC000077763928 1409899745 /nfs/dbraw/zinc/89/97/45/1409899745.db2.gz ZSAZQKXPCPYVFB-JOCHJYFZSA-N 2 1 384.568 3.298 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000077774186 1409899871 /nfs/dbraw/zinc/89/98/71/1409899871.db2.gz YLAWYWUEQGKEPK-PMACEKPBSA-N 2 1 386.584 3.113 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CCC[N@H+]3CCC[C@H]3C2)CC1 ZINC000077763957 1409899972 /nfs/dbraw/zinc/89/99/72/1409899972.db2.gz HNLZXCYPEDTBIQ-QFIPXVFZSA-N 2 1 384.568 3.298 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c2ccccc2)CC1 ZINC000077785543 1409900638 /nfs/dbraw/zinc/90/06/38/1409900638.db2.gz HSZOKBDOTHYJTK-FGZHOGPDSA-N 2 1 384.568 3.339 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000077800781 1409901865 /nfs/dbraw/zinc/90/18/65/1409901865.db2.gz YQOMDQJUFRQOTO-JOCHJYFZSA-N 2 1 384.568 3.442 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000077827840 1409902754 /nfs/dbraw/zinc/90/27/54/1409902754.db2.gz GZDMFWJAHPZMKR-JOCHJYFZSA-N 2 1 384.568 3.442 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000077983167 1409905768 /nfs/dbraw/zinc/90/57/68/1409905768.db2.gz YTRCECZJDPALAK-QFIPXVFZSA-N 2 1 378.520 3.323 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@@H]1CCC[N@H+]1Cc1ccccn1 ZINC000077983167 1409905787 /nfs/dbraw/zinc/90/57/87/1409905787.db2.gz YTRCECZJDPALAK-QFIPXVFZSA-N 2 1 378.520 3.323 20 0 GGADMP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)[C@H]1CCC[NH+]1Cc1ccccn1 ZINC000077981571 1409905868 /nfs/dbraw/zinc/90/58/68/1409905868.db2.gz NIWZUNDJVREJNM-JOCHJYFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@H]1CCC[NH+]1Cc1ccccn1 ZINC000077981571 1409905878 /nfs/dbraw/zinc/90/58/78/1409905878.db2.gz NIWZUNDJVREJNM-JOCHJYFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000077981571 1409905889 /nfs/dbraw/zinc/90/58/89/1409905889.db2.gz NIWZUNDJVREJNM-JOCHJYFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000077981571 1409905904 /nfs/dbraw/zinc/90/59/04/1409905904.db2.gz NIWZUNDJVREJNM-JOCHJYFZSA-N 2 1 380.536 3.203 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000077983163 1409906333 /nfs/dbraw/zinc/90/63/33/1409906333.db2.gz YTRCECZJDPALAK-JOCHJYFZSA-N 2 1 378.520 3.323 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000077983163 1409906344 /nfs/dbraw/zinc/90/63/44/1409906344.db2.gz YTRCECZJDPALAK-JOCHJYFZSA-N 2 1 378.520 3.323 20 0 GGADMP COc1cc(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(SC)cc1OC ZINC000078052184 1409907711 /nfs/dbraw/zinc/90/77/11/1409907711.db2.gz LZXBNRWQKNMAQT-IYBDPMFKSA-N 2 1 382.570 3.405 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000078522885 1409923347 /nfs/dbraw/zinc/92/33/47/1409923347.db2.gz BREFJFJZYVWGHK-ROUUACIJSA-N 2 1 378.586 3.305 20 0 GGADMP CC[C@@H](CNC(=O)NC1CC[NH+](CC(C)C)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079097223 1409956642 /nfs/dbraw/zinc/95/66/42/1409956642.db2.gz FJJCGILNNHVFMI-QFIPXVFZSA-N 2 1 386.584 3.243 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000079204563 1409962625 /nfs/dbraw/zinc/96/26/25/1409962625.db2.gz JUSCBGLZEUGMNO-MOPGFXCFSA-N 2 1 376.545 3.370 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000079224300 1409963588 /nfs/dbraw/zinc/96/35/88/1409963588.db2.gz RDDGTIOGSQJXHD-MSOLQXFVSA-N 2 1 378.586 3.449 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000079256951 1409963624 /nfs/dbraw/zinc/96/36/24/1409963624.db2.gz PAAHGOOYIYTLNS-FCHUYYIVSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)C1 ZINC000079267297 1409964333 /nfs/dbraw/zinc/96/43/33/1409964333.db2.gz OXIDZNCAYIGBSU-SCTDSRPQSA-N 2 1 380.602 3.408 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000079571342 1409981891 /nfs/dbraw/zinc/98/18/91/1409981891.db2.gz IPEZYMJJZMROSC-IBGZPJMESA-N 2 1 376.545 3.178 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000079571346 1409982589 /nfs/dbraw/zinc/98/25/89/1409982589.db2.gz IPEZYMJJZMROSC-LJQANCHMSA-N 2 1 376.545 3.178 20 0 GGADMP CC[C@H](CNC(=O)N1CCC(CC[NH+](C)C)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079601314 1409982834 /nfs/dbraw/zinc/98/28/34/1409982834.db2.gz RZVPRYOCSYFHHB-JOCHJYFZSA-N 2 1 386.584 3.197 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000079620473 1409984023 /nfs/dbraw/zinc/98/40/23/1409984023.db2.gz GKAQOUQMAKFEAI-UHFFFAOYSA-N 2 1 386.584 3.197 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)CC[N@H+]1Cc1ccccc1 ZINC000080164721 1410001948 /nfs/dbraw/zinc/00/19/48/1410001948.db2.gz JUFRSZWTPYNDDX-DENIHFKCSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]([NH+]3CCCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000080164978 1410002068 /nfs/dbraw/zinc/00/20/68/1410002068.db2.gz CANVQDIMRGSKLC-FCEUIQTBSA-N 2 1 384.568 3.309 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CC[NH+](C3CCCC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000080165714 1410002178 /nfs/dbraw/zinc/00/21/78/1410002178.db2.gz SZOUCCJXDPNBQM-PZJWPPBQSA-N 2 1 384.568 3.309 20 0 GGADMP CCc1ccc(NC(=O)[C@H](C)[NH+]2CCC(OCC[NH+](CC)CC)CC2)cc1 ZINC000080650721 1410009029 /nfs/dbraw/zinc/00/90/29/1410009029.db2.gz BJQHCWICLQMOGU-SFHVURJKSA-N 2 1 375.557 3.399 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2ccc(C)c(C)c2)CC1 ZINC000080650299 1410009188 /nfs/dbraw/zinc/00/91/88/1410009188.db2.gz IAASRJSEENGGDL-LJQANCHMSA-N 2 1 375.557 3.453 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@@H]3CCC[N@@H+]3Cc3ccccn3)C2)CC1 ZINC000081023360 1410014304 /nfs/dbraw/zinc/01/43/04/1410014304.db2.gz HEPWJVBWANQNEU-UNMCSNQZSA-N 2 1 384.568 3.017 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@@H]3CCC[N@H+]3Cc3ccccn3)C2)CC1 ZINC000081023360 1410014311 /nfs/dbraw/zinc/01/43/11/1410014311.db2.gz HEPWJVBWANQNEU-UNMCSNQZSA-N 2 1 384.568 3.017 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000081363204 1410018151 /nfs/dbraw/zinc/01/81/51/1410018151.db2.gz ZMUPRHNFQQMFOQ-WOJBJXKFSA-N 2 1 375.532 3.228 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)C1 ZINC000081363204 1410018159 /nfs/dbraw/zinc/01/81/59/1410018159.db2.gz ZMUPRHNFQQMFOQ-WOJBJXKFSA-N 2 1 375.532 3.228 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000081363204 1410018170 /nfs/dbraw/zinc/01/81/70/1410018170.db2.gz ZMUPRHNFQQMFOQ-WOJBJXKFSA-N 2 1 375.532 3.228 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(C[NH+]3CCSCC3)cc2)C1 ZINC000081361738 1410018734 /nfs/dbraw/zinc/01/87/34/1410018734.db2.gz GJWOAIRGMBUBAJ-LJQANCHMSA-N 2 1 375.582 3.039 20 0 GGADMP CC[NH+](CC)C[C@H]1CCN(C(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000081957149 1410025201 /nfs/dbraw/zinc/02/52/01/1410025201.db2.gz AOLALLJXCCIKOM-CTNGQTDRSA-N 2 1 375.532 3.371 20 0 GGADMP CC[NH+](CC)C[C@H]1CCN(C(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000081957149 1410025206 /nfs/dbraw/zinc/02/52/06/1410025206.db2.gz AOLALLJXCCIKOM-CTNGQTDRSA-N 2 1 375.532 3.371 20 0 GGADMP C[NH+](C)CCN(Cc1cccs1)C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000084442092 1410036427 /nfs/dbraw/zinc/03/64/27/1410036427.db2.gz SVCZNCKZYHUDOZ-SFHVURJKSA-N 2 1 378.586 3.086 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N(C)[C@H]3CC[N@@H+](C)C[C@@H]3C)cc2)CC1 ZINC000085389930 1410040734 /nfs/dbraw/zinc/04/07/34/1410040734.db2.gz WGMAYKYXMSYYRR-UGKGYDQZSA-N 2 1 386.584 3.400 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c2ccccc2)CC1 ZINC000085394126 1410040889 /nfs/dbraw/zinc/04/08/89/1410040889.db2.gz GKHAPDNBVSOANC-KSEOMHKRSA-N 2 1 386.584 3.441 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000085456471 1410042623 /nfs/dbraw/zinc/04/26/23/1410042623.db2.gz GIKAVQORIAVDKK-KDURUIRLSA-N 2 1 375.557 3.148 20 0 GGADMP COC(=O)c1sccc1C[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000088546717 1410050429 /nfs/dbraw/zinc/05/04/29/1410050429.db2.gz AEZZABMURJXFDI-HZPDHXFCSA-N 2 1 380.554 3.246 20 0 GGADMP COC(=O)c1cc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)s1 ZINC000089123758 1410051587 /nfs/dbraw/zinc/05/15/87/1410051587.db2.gz MEATVGXRQYWIJS-GASCZTMLSA-N 2 1 380.554 3.164 20 0 GGADMP CC1(C)C[C@H](NC2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)C[N@H+]1Cc1ccccc1 ZINC000090189477 1410063714 /nfs/dbraw/zinc/06/37/14/1410063714.db2.gz HUXOWKMCGOOGDJ-ZRBLBEILSA-N 2 1 385.596 3.397 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H](C)[C@H](OC2CCOCC2)c2ccccc2)CC1 ZINC000090605061 1410066159 /nfs/dbraw/zinc/06/61/59/1410066159.db2.gz NRUBBSOKCRLFSL-AVRDEDQJSA-N 2 1 376.541 3.012 20 0 GGADMP C[C@@H](CNC(=O)OC(C)(C)C)C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000090715389 1410067257 /nfs/dbraw/zinc/06/72/57/1410067257.db2.gz YQSSIJGATFRHRA-GOSISDBHSA-N 2 1 375.557 3.444 20 0 GGADMP CC[C@@H](CSC)[N@@H+](C)CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000091097159 1410070477 /nfs/dbraw/zinc/07/04/77/1410070477.db2.gz KOBDVGFDKFQQKE-FQEVSTJZSA-N 2 1 377.598 3.149 20 0 GGADMP C[NH+]1CCC[C@H](CNc2nc(NC[C@@H]3CCC[N@H+](C)C3)nc3ccccc32)C1 ZINC000091482886 1410074116 /nfs/dbraw/zinc/07/41/16/1410074116.db2.gz ZJPSHKASOFWFHJ-MSOLQXFVSA-N 2 1 382.556 3.137 20 0 GGADMP C[NH+]1CCC[C@@H](CNc2nc3ccccc3c(NC[C@H]3CCC[N@H+](C)C3)n2)C1 ZINC000091482886 1410074122 /nfs/dbraw/zinc/07/41/22/1410074122.db2.gz ZJPSHKASOFWFHJ-MSOLQXFVSA-N 2 1 382.556 3.137 20 0 GGADMP C[NH+]1CCC[C@@H](CNc2nc3ccccc3c(NC[C@H]3CCC[N@@H+](C)C3)n2)C1 ZINC000091482886 1410074129 /nfs/dbraw/zinc/07/41/29/1410074129.db2.gz ZJPSHKASOFWFHJ-MSOLQXFVSA-N 2 1 382.556 3.137 20 0 GGADMP COc1c(C)c[nH+]c(CN2CCC([N@H+](C)Cc3cnc4ccccn34)CC2)c1C ZINC000091708877 1410078418 /nfs/dbraw/zinc/07/84/18/1410078418.db2.gz URTYDGCXYFHPFO-UHFFFAOYSA-N 2 1 393.535 3.451 20 0 GGADMP COc1c(C)c[nH+]c(CN2CCC([N@@H+](C)Cc3cnc4ccccn34)CC2)c1C ZINC000091708877 1410078423 /nfs/dbraw/zinc/07/84/23/1410078423.db2.gz URTYDGCXYFHPFO-UHFFFAOYSA-N 2 1 393.535 3.451 20 0 GGADMP Cc1noc([C@H]2CCC[N@H+](Cc3ccccc3N(C)C3CC[NH+](C)CC3)C2)n1 ZINC000091832891 1410084596 /nfs/dbraw/zinc/08/45/96/1410084596.db2.gz FNLRRSKOEVWOAD-IBGZPJMESA-N 2 1 383.540 3.288 20 0 GGADMP Cc1ccc(NC(=O)[C@@H]2CCC[N@H+](Cc3ccc(OCC[NH+](C)C)cc3)C2)nc1 ZINC000092003952 1410096607 /nfs/dbraw/zinc/09/66/07/1410096607.db2.gz IQTYOCQTHZVCBR-HXUWFJFHSA-N 2 1 396.535 3.181 20 0 GGADMP Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)C1 ZINC000092011473 1410098261 /nfs/dbraw/zinc/09/82/61/1410098261.db2.gz PRLHEZIZJPKOSZ-SFTDATJTSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@@H](O)[C@H]1CCC[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)C1 ZINC000092011473 1410098267 /nfs/dbraw/zinc/09/82/67/1410098267.db2.gz PRLHEZIZJPKOSZ-SFTDATJTSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@@H](O)[C@H]1CCC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC000092011473 1410098273 /nfs/dbraw/zinc/09/82/73/1410098273.db2.gz PRLHEZIZJPKOSZ-SFTDATJTSA-N 2 1 384.568 3.324 20 0 GGADMP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CN1C(=O)SC(C)(C)C1=O ZINC000092294995 1410136986 /nfs/dbraw/zinc/13/69/86/1410136986.db2.gz OFIHDRSGPPIMJM-UHFFFAOYSA-N 2 1 376.526 3.051 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CN1C(=O)SC(C)(C)C1=O ZINC000092294995 1410136994 /nfs/dbraw/zinc/13/69/94/1410136994.db2.gz OFIHDRSGPPIMJM-UHFFFAOYSA-N 2 1 376.526 3.051 20 0 GGADMP COc1ccc(N2CCC[N@@H+](Cc3ccc(OCC[NH+](C)C)cc3)CC2)cc1 ZINC000092380636 1410148663 /nfs/dbraw/zinc/14/86/63/1410148663.db2.gz CGEXQXBZBNWIRA-UHFFFAOYSA-N 2 1 383.536 3.348 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNCc2c(Cl)cccc2N2CC[NH+](C)CC2)C1 ZINC000092389474 1410149041 /nfs/dbraw/zinc/14/90/41/1410149041.db2.gz XZWUKLBAWACUCY-GOSISDBHSA-N 2 1 378.992 3.302 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNCc2c(Cl)cccc2N2CC[NH+](C)CC2)C1 ZINC000092389476 1410149780 /nfs/dbraw/zinc/14/97/80/1410149780.db2.gz XZWUKLBAWACUCY-SFHVURJKSA-N 2 1 378.992 3.302 20 0 GGADMP CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000092400059 1410150647 /nfs/dbraw/zinc/15/06/47/1410150647.db2.gz QHSSCPYOIXFYIG-ICSRJNTNSA-N 2 1 375.557 3.144 20 0 GGADMP CC[C@@H](C)[N@@H+](C)CCNC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092488850 1410162272 /nfs/dbraw/zinc/16/22/72/1410162272.db2.gz HZYPBDVHRGZDND-GOSISDBHSA-N 2 1 375.561 3.060 20 0 GGADMP COCCCOc1cccc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000092587586 1410177218 /nfs/dbraw/zinc/17/72/18/1410177218.db2.gz FNJTYFHDZMGKAJ-BGYRXZFFSA-N 2 1 390.568 3.423 20 0 GGADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@@H+]1Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092644323 1410181097 /nfs/dbraw/zinc/18/10/97/1410181097.db2.gz FDFNHZXGCIWLTM-FGZHOGPDSA-N 2 1 379.552 3.387 20 0 GGADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092644323 1410181102 /nfs/dbraw/zinc/18/11/02/1410181102.db2.gz FDFNHZXGCIWLTM-FGZHOGPDSA-N 2 1 379.552 3.387 20 0 GGADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@@H+]1Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092644321 1410181171 /nfs/dbraw/zinc/18/11/71/1410181171.db2.gz FDFNHZXGCIWLTM-YADHBBJMSA-N 2 1 379.552 3.387 20 0 GGADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092644321 1410181180 /nfs/dbraw/zinc/18/11/80/1410181180.db2.gz FDFNHZXGCIWLTM-YADHBBJMSA-N 2 1 379.552 3.387 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)cc1 ZINC000092664408 1410183858 /nfs/dbraw/zinc/18/38/58/1410183858.db2.gz REDASARRIMYJDT-WOJBJXKFSA-N 2 1 381.568 3.376 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000092664401 1410184243 /nfs/dbraw/zinc/18/42/43/1410184243.db2.gz REDASARRIMYJDT-BGYRXZFFSA-N 2 1 381.568 3.376 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000092664401 1410184252 /nfs/dbraw/zinc/18/42/52/1410184252.db2.gz REDASARRIMYJDT-BGYRXZFFSA-N 2 1 381.568 3.376 20 0 GGADMP COc1ccc(-c2n[nH]cc2C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)cc1 ZINC000092666266 1410186277 /nfs/dbraw/zinc/18/62/77/1410186277.db2.gz CZIYZIISLUTAHJ-OALUTQOASA-N 2 1 397.567 3.076 20 0 GGADMP CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000092706613 1410191664 /nfs/dbraw/zinc/19/16/64/1410191664.db2.gz YZDHALFRUWMCCK-NRFANRHFSA-N 2 1 387.568 3.145 20 0 GGADMP CC[NH+]1CCN(c2ccccc2C[N@H+]2CC[C@@H](CNc3ccccn3)C2)CC1 ZINC000092812799 1410202886 /nfs/dbraw/zinc/20/28/86/1410202886.db2.gz QCNWLBZKYRSXMQ-FQEVSTJZSA-N 2 1 379.552 3.158 20 0 GGADMP CN(C)C(=O)[C@@H](c1ccccc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092820875 1410203120 /nfs/dbraw/zinc/20/31/20/1410203120.db2.gz VTVFJLMLRLKOTJ-JOCHJYFZSA-N 2 1 380.536 3.449 20 0 GGADMP CCCOc1c(C[N@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)cccc1OCC ZINC000093133023 1410223501 /nfs/dbraw/zinc/22/35/01/1410223501.db2.gz MKPIZNSCXMFTDV-HXUWFJFHSA-N 2 1 375.557 3.086 20 0 GGADMP CCOc1cc(C[N@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)ccc1OCC(C)C ZINC000093133389 1410224133 /nfs/dbraw/zinc/22/41/33/1410224133.db2.gz OMRSNECVVNEXMD-NRFANRHFSA-N 2 1 389.584 3.332 20 0 GGADMP CCCCOc1ccc(C[N@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)cc1OC ZINC000093133167 1410224155 /nfs/dbraw/zinc/22/41/55/1410224155.db2.gz WHPGOCDZMWXACH-HXUWFJFHSA-N 2 1 375.557 3.086 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cc4cccc(OC)c4o3)CC2)CC1 ZINC000093141574 1410225880 /nfs/dbraw/zinc/22/58/80/1410225880.db2.gz BGYVLMDFKNQWDC-UHFFFAOYSA-N 2 1 399.535 3.208 20 0 GGADMP CCCOc1cccc(C[NH+]2CCC(CC(=O)N3CC[NH+](CC)CC3)CC2)c1 ZINC000093141848 1410226678 /nfs/dbraw/zinc/22/66/78/1410226678.db2.gz CKXBYYKHNMWHMD-UHFFFAOYSA-N 2 1 387.568 3.242 20 0 GGADMP CN(C)C(=O)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)[nH]1 ZINC000176798263 1428466026 /nfs/dbraw/zinc/46/60/26/1428466026.db2.gz BWZMDBDIFHPCHP-UHFFFAOYSA-N 2 1 380.492 3.231 20 0 GGADMP C[N@@H+](Cc1ccccc1N1CCOCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093336969 1410236472 /nfs/dbraw/zinc/23/64/72/1410236472.db2.gz WGXSNJLPTNAZMJ-JOCHJYFZSA-N 2 1 379.548 3.477 20 0 GGADMP C[N@H+](Cc1ccccc1N1CCOCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093336969 1410236477 /nfs/dbraw/zinc/23/64/77/1410236477.db2.gz WGXSNJLPTNAZMJ-JOCHJYFZSA-N 2 1 379.548 3.477 20 0 GGADMP C[NH+](Cc1ccccc1N1CCOCC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000093336969 1410236483 /nfs/dbraw/zinc/23/64/83/1410236483.db2.gz WGXSNJLPTNAZMJ-JOCHJYFZSA-N 2 1 379.548 3.477 20 0 GGADMP C[NH+](Cc1ccccc1N1CCOCC1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000093336969 1410236486 /nfs/dbraw/zinc/23/64/86/1410236486.db2.gz WGXSNJLPTNAZMJ-JOCHJYFZSA-N 2 1 379.548 3.477 20 0 GGADMP C[C@H](c1cccnc1)N1CC[NH+](Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000093413628 1410243845 /nfs/dbraw/zinc/24/38/45/1410243845.db2.gz ISEAQOLYSJLNML-OAQYLSRUSA-N 2 1 394.563 3.435 20 0 GGADMP C[C@H](c1cccnc1)[NH+]1CCN(Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000093413628 1410243849 /nfs/dbraw/zinc/24/38/49/1410243849.db2.gz ISEAQOLYSJLNML-OAQYLSRUSA-N 2 1 394.563 3.435 20 0 GGADMP COc1ccc([C@H](CO)[N@@H+](C)Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000093415832 1410244704 /nfs/dbraw/zinc/24/47/04/1410244704.db2.gz HRASEYAEPWAVRX-QHCPKHFHSA-N 2 1 384.520 3.335 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+](CCc3ccc(F)cc3)C3CCCC3)cn2)CC1 ZINC000093548176 1410252525 /nfs/dbraw/zinc/25/25/25/1410252525.db2.gz MLCNNXIHDNVDCE-UHFFFAOYSA-N 2 1 397.542 3.355 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+](CCc3ccc(F)cc3)C3CCCC3)cn2)CC1 ZINC000093548176 1410252530 /nfs/dbraw/zinc/25/25/30/1410252530.db2.gz MLCNNXIHDNVDCE-UHFFFAOYSA-N 2 1 397.542 3.355 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+]3CCC[C@H]3CCCc3ccccc3)cn2)CC1 ZINC000093761786 1410264892 /nfs/dbraw/zinc/26/48/92/1410264892.db2.gz KUPAGILDHVEWRV-JOCHJYFZSA-N 2 1 379.552 3.216 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+]3CCC[C@H]3CCCc3ccccc3)cn2)CC1 ZINC000093761786 1410264899 /nfs/dbraw/zinc/26/48/99/1410264899.db2.gz KUPAGILDHVEWRV-JOCHJYFZSA-N 2 1 379.552 3.216 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cn(C)nc2-c2ccncc2)CC1 ZINC000093769471 1410265653 /nfs/dbraw/zinc/26/56/53/1410265653.db2.gz WJFSGZCSGATXAL-UHFFFAOYSA-N 2 1 385.556 3.053 20 0 GGADMP Cc1cc(C)n2c(C[NH+]3CCC(CC[N@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)cnc2n1 ZINC000093844322 1410274801 /nfs/dbraw/zinc/27/48/01/1410274801.db2.gz LOQMEXAYWLZGNG-KDURUIRLSA-N 2 1 385.556 3.057 20 0 GGADMP CN(c1ccccc1C[N@@H+](C)[C@H]1CCCc2c1cnn2C)C1CC[NH+](C)CC1 ZINC000093864100 1410275249 /nfs/dbraw/zinc/27/52/49/1410275249.db2.gz YJUSWKKGWBGPLQ-QFIPXVFZSA-N 2 1 381.568 3.460 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1N(C)C ZINC000093944914 1410289301 /nfs/dbraw/zinc/28/93/01/1410289301.db2.gz IUSGZDIQJOFJTQ-RXVVDRJESA-N 2 1 394.563 3.301 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)NCCC[N@H+](C)C1CCCCC1)[NH+](C)C ZINC000097357686 1410365905 /nfs/dbraw/zinc/36/59/05/1410365905.db2.gz GMLUJFMODUAKQH-HXUWFJFHSA-N 2 1 390.572 3.252 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)NCCC[N@@H+](C)C1CCCCC1)[NH+](C)C ZINC000097357686 1410365912 /nfs/dbraw/zinc/36/59/12/1410365912.db2.gz GMLUJFMODUAKQH-HXUWFJFHSA-N 2 1 390.572 3.252 20 0 GGADMP C[C@H](C[NH+]1CCCCC1)NC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000097428485 1410369172 /nfs/dbraw/zinc/36/91/72/1410369172.db2.gz DGYABZVHRXSMKW-GOSISDBHSA-N 2 1 392.975 3.432 20 0 GGADMP C[C@H](C[NH+]1CCCCC1)NC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000097428485 1410369177 /nfs/dbraw/zinc/36/91/77/1410369177.db2.gz DGYABZVHRXSMKW-GOSISDBHSA-N 2 1 392.975 3.432 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)NCC1([NH+]2CCSCC2)CCCC1 ZINC000097437697 1410370018 /nfs/dbraw/zinc/37/00/18/1410370018.db2.gz SBTJACVOGUXDLE-IBGZPJMESA-N 2 1 396.645 3.302 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CCC[NH+]1Cc1ccccc1 ZINC000097549244 1410375814 /nfs/dbraw/zinc/37/58/14/1410375814.db2.gz RIAYQESQFDWBOL-RPWUZVMVSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000097549244 1410375818 /nfs/dbraw/zinc/37/58/18/1410375818.db2.gz RIAYQESQFDWBOL-RPWUZVMVSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000097549244 1410375822 /nfs/dbraw/zinc/37/58/22/1410375822.db2.gz RIAYQESQFDWBOL-RPWUZVMVSA-N 2 1 391.559 3.332 20 0 GGADMP C[NH+](C)Cc1ccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)c(Cl)c2)cc1 ZINC000101517117 1410443356 /nfs/dbraw/zinc/44/33/56/1410443356.db2.gz XINQWBPQNYSGPD-UHFFFAOYSA-N 2 1 386.927 3.406 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)/C=C/c1nc2ccccc2s1 ZINC000101518563 1410444046 /nfs/dbraw/zinc/44/40/46/1410444046.db2.gz HKXFJHMECMVVMJ-FLVLSHQESA-N 2 1 386.565 3.184 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000101648504 1410485742 /nfs/dbraw/zinc/48/57/42/1410485742.db2.gz QEZUNJGSRWHRHZ-XHSDSOJGSA-N 2 1 379.495 3.307 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000101648504 1410485744 /nfs/dbraw/zinc/48/57/44/1410485744.db2.gz QEZUNJGSRWHRHZ-XHSDSOJGSA-N 2 1 379.495 3.307 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1)C[NH+]1CCCC1 ZINC000101796639 1410503476 /nfs/dbraw/zinc/50/34/76/1410503476.db2.gz ZEQAUDXXCFVLIR-OAQYLSRUSA-N 2 1 386.584 3.068 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NCC[N@@H+]1CCc2sccc2C1)c1ccco1 ZINC000101990156 1410537700 /nfs/dbraw/zinc/53/77/00/1410537700.db2.gz KHBDVWDWEKFCFP-KRWDZBQOSA-N 2 1 390.553 3.082 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NCC[N@H+]1CCc2sccc2C1)c1ccco1 ZINC000101990156 1410537704 /nfs/dbraw/zinc/53/77/04/1410537704.db2.gz KHBDVWDWEKFCFP-KRWDZBQOSA-N 2 1 390.553 3.082 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCC(C)CC1 ZINC000102005833 1410541904 /nfs/dbraw/zinc/54/19/04/1410541904.db2.gz PEYXQLQRBTWMKX-RTBURBONSA-N 2 1 392.613 3.380 20 0 GGADMP CC[NH+](CC)CCC[C@@H](C)NC(=O)[C@@H](c1ccccc1)[NH+]1CCSCC1 ZINC000102636787 1410681404 /nfs/dbraw/zinc/68/14/04/1410681404.db2.gz RXHZEKFEPSCUEP-UYAOXDASSA-N 2 1 377.598 3.403 20 0 GGADMP COc1ccccc1C[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000102781542 1410750021 /nfs/dbraw/zinc/75/00/21/1410750021.db2.gz YYOBOBSTHLPPJA-UHFFFAOYSA-N 2 1 384.520 3.475 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000102795359 1410760935 /nfs/dbraw/zinc/76/09/35/1410760935.db2.gz VPEBKZFENYZTRY-QFIPXVFZSA-N 2 1 386.584 3.450 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)[nH+]c1 ZINC000176882428 1428510866 /nfs/dbraw/zinc/51/08/66/1428510866.db2.gz ABIKCCMGDGBFJS-NRFANRHFSA-N 2 1 395.551 3.356 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)[nH+]c1 ZINC000176882428 1428510869 /nfs/dbraw/zinc/51/08/69/1428510869.db2.gz ABIKCCMGDGBFJS-NRFANRHFSA-N 2 1 395.551 3.356 20 0 GGADMP O=C(C[N@H+]1CC[C@H](Nc2ccccc2)C1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000102846095 1410800240 /nfs/dbraw/zinc/80/02/40/1410800240.db2.gz CVFSFFGNZYQLNV-QHCPKHFHSA-N 2 1 392.547 3.085 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000102935464 1410809796 /nfs/dbraw/zinc/80/97/96/1410809796.db2.gz AFPFPYBFLUEECB-FUHWJXTLSA-N 2 1 397.567 3.386 20 0 GGADMP COc1cc(CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc(OC)c1OC ZINC000103173895 1410834103 /nfs/dbraw/zinc/83/41/03/1410834103.db2.gz PNYXPVXPKVYOSC-LJQANCHMSA-N 2 1 384.520 3.367 20 0 GGADMP COc1cc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc(OC)c1OC ZINC000103173895 1410834105 /nfs/dbraw/zinc/83/41/05/1410834105.db2.gz PNYXPVXPKVYOSC-LJQANCHMSA-N 2 1 384.520 3.367 20 0 GGADMP COc1cc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc(OC)c1OC ZINC000103173895 1410834106 /nfs/dbraw/zinc/83/41/06/1410834106.db2.gz PNYXPVXPKVYOSC-LJQANCHMSA-N 2 1 384.520 3.367 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H](O)COCc2cccs2)CC1 ZINC000103228026 1410838609 /nfs/dbraw/zinc/83/86/09/1410838609.db2.gz GRJLDEHOSMBLAF-OAQYLSRUSA-N 2 1 388.577 3.470 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000103268348 1410842132 /nfs/dbraw/zinc/84/21/32/1410842132.db2.gz INLPQEWKXLUOTP-QHCPKHFHSA-N 2 1 394.563 3.112 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccco1 ZINC000103297792 1410844033 /nfs/dbraw/zinc/84/40/33/1410844033.db2.gz WUCRANQOLJKBKT-MOPGFXCFSA-N 2 1 376.545 3.180 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CCC(=O)Nc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000103481170 1410862638 /nfs/dbraw/zinc/86/26/38/1410862638.db2.gz KVSVRMLAVKMNNZ-CALCHBBNSA-N 2 1 393.959 3.490 20 0 GGADMP CC[N@H+]1CCCC[C@H]1C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)c(F)c1 ZINC000104409701 1410895035 /nfs/dbraw/zinc/89/50/35/1410895035.db2.gz MKSZODSLNWKWHG-FQEVSTJZSA-N 2 1 376.520 3.169 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CCN(c3cc(OC)cc[nH+]3)CC2)cc1)C(C)C ZINC000104521193 1410898863 /nfs/dbraw/zinc/89/88/63/1410898863.db2.gz HGLALEOCQHVWRD-UHFFFAOYSA-N 2 1 396.535 3.283 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000176938809 1428526093 /nfs/dbraw/zinc/52/60/93/1428526093.db2.gz NJJPZJMRUGSJSW-SFHVURJKSA-N 2 1 390.597 3.431 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000176938809 1428526102 /nfs/dbraw/zinc/52/61/02/1428526102.db2.gz NJJPZJMRUGSJSW-SFHVURJKSA-N 2 1 390.597 3.431 20 0 GGADMP COc1ccc([C@@H](CNC(=O)NC[C@H](C)[N@@H+](C)C2CC2)[NH+]2CCCCC2)cc1 ZINC000105077933 1411025036 /nfs/dbraw/zinc/02/50/36/1411025036.db2.gz OFLKRIZZMJMHRE-LAUBAEHRSA-N 2 1 388.556 3.004 20 0 GGADMP COc1ccc([C@H](CNC(=O)NC[C@H](C)[N@@H+](C)C2CC2)[NH+]2CCCCC2)cc1 ZINC000105077926 1411025495 /nfs/dbraw/zinc/02/54/95/1411025495.db2.gz OFLKRIZZMJMHRE-UWJYYQICSA-N 2 1 388.556 3.004 20 0 GGADMP CC[N@H+]1CCC[C@H](CNC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000105112849 1411030005 /nfs/dbraw/zinc/03/00/05/1411030005.db2.gz OMVYAOPWWFEYGL-JOCHJYFZSA-N 2 1 386.584 3.450 20 0 GGADMP CC[N@H+]1CCC[C@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)C1 ZINC000105113363 1411030411 /nfs/dbraw/zinc/03/04/11/1411030411.db2.gz PAHGYPFSZKMLDN-VQTJNVASSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+]1CCC[C@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000105113363 1411030421 /nfs/dbraw/zinc/03/04/21/1411030421.db2.gz PAHGYPFSZKMLDN-VQTJNVASSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+]1CCC[C@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000105113363 1411030429 /nfs/dbraw/zinc/03/04/29/1411030429.db2.gz PAHGYPFSZKMLDN-VQTJNVASSA-N 2 1 386.584 3.450 20 0 GGADMP CC[C@@H](CNC(=O)NC[C@@H]1CCC[N@H+](C(C)C)C1)[NH+]1CCc2ccccc2C1 ZINC000105126183 1411031530 /nfs/dbraw/zinc/03/15/30/1411031530.db2.gz WBARUAPVIRULDL-UGKGYDQZSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@@H](CNC(=O)NC[C@@H]1CCC[NH+](C(C)C)C1)[N@@H+]1CCc2ccccc2C1 ZINC000105126183 1411031540 /nfs/dbraw/zinc/03/15/40/1411031540.db2.gz WBARUAPVIRULDL-UGKGYDQZSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@@H](CNC(=O)NC[C@@H]1CCC[NH+](C(C)C)C1)[N@H+]1CCc2ccccc2C1 ZINC000105126183 1411031547 /nfs/dbraw/zinc/03/15/47/1411031547.db2.gz WBARUAPVIRULDL-UGKGYDQZSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@@H](CNC(=O)NC[C@H]1CCC[N@H+](C(C)C)C1)[NH+]1CCc2ccccc2C1 ZINC000105126188 1411032172 /nfs/dbraw/zinc/03/21/72/1411032172.db2.gz WBARUAPVIRULDL-KNQAVFIVSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@@H](CNC(=O)NC[C@H]1CCC[NH+](C(C)C)C1)[N@@H+]1CCc2ccccc2C1 ZINC000105126188 1411032184 /nfs/dbraw/zinc/03/21/84/1411032184.db2.gz WBARUAPVIRULDL-KNQAVFIVSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@@H](CNC(=O)NC[C@H]1CCC[NH+](C(C)C)C1)[N@H+]1CCc2ccccc2C1 ZINC000105126188 1411032192 /nfs/dbraw/zinc/03/21/92/1411032192.db2.gz WBARUAPVIRULDL-KNQAVFIVSA-N 2 1 386.584 3.243 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)NC[C@@H](C)[N@@H+](C)C1CC1)[NH+]1CCCCC1 ZINC000105165745 1411037323 /nfs/dbraw/zinc/03/73/23/1411037323.db2.gz PGPDXNQSVYDVJJ-YLJYHZDGSA-N 2 1 388.556 3.004 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)[NH+]2CCCC2)o1 ZINC000105222172 1411043693 /nfs/dbraw/zinc/04/36/93/1411043693.db2.gz INGFAFUYOPSFIR-OALUTQOASA-N 2 1 376.545 3.145 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)[NH+]2CCCC2)o1 ZINC000105222177 1411043889 /nfs/dbraw/zinc/04/38/89/1411043889.db2.gz INGFAFUYOPSFIR-MOPGFXCFSA-N 2 1 376.545 3.145 20 0 GGADMP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000105275852 1411048704 /nfs/dbraw/zinc/04/87/04/1411048704.db2.gz RMOOQMDJHBBABF-FQEVSTJZSA-N 2 1 390.547 3.163 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000105275852 1411048714 /nfs/dbraw/zinc/04/87/14/1411048714.db2.gz RMOOQMDJHBBABF-FQEVSTJZSA-N 2 1 390.547 3.163 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)C1 ZINC000105275852 1411048724 /nfs/dbraw/zinc/04/87/24/1411048724.db2.gz RMOOQMDJHBBABF-FQEVSTJZSA-N 2 1 390.547 3.163 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)C1 ZINC000105275852 1411048732 /nfs/dbraw/zinc/04/87/32/1411048732.db2.gz RMOOQMDJHBBABF-FQEVSTJZSA-N 2 1 390.547 3.163 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2F)C1 ZINC000105273548 1411049111 /nfs/dbraw/zinc/04/91/11/1411049111.db2.gz SGSXOUCHURSEPJ-QGZVFWFLSA-N 2 1 396.526 3.158 20 0 GGADMP Cc1nn(-c2ccccc2)c(Cl)c1C[NH2+]CC1CCN(CC[NH+](C)C)CC1 ZINC000105451488 1411067373 /nfs/dbraw/zinc/06/73/73/1411067373.db2.gz SDNGALOCWQTGTE-UHFFFAOYSA-N 2 1 389.975 3.197 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](CCC[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000105475536 1411070485 /nfs/dbraw/zinc/07/04/85/1411070485.db2.gz AAJCPFBZYFNUIN-OAHLLOKOSA-N 2 1 375.900 3.277 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000105475536 1411070492 /nfs/dbraw/zinc/07/04/92/1411070492.db2.gz AAJCPFBZYFNUIN-OAHLLOKOSA-N 2 1 375.900 3.277 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)CC1 ZINC000105476120 1411070506 /nfs/dbraw/zinc/07/05/06/1411070506.db2.gz IUYJPFBGRHTCJC-UHFFFAOYSA-N 2 1 395.595 3.342 20 0 GGADMP Cc1cc(C[NH2+]CCCN2CCC[N@H+](C)CC2)cc(C)c1OCc1ccccn1 ZINC000105476529 1411070863 /nfs/dbraw/zinc/07/08/63/1411070863.db2.gz WSIWABKHXPNFBQ-UHFFFAOYSA-N 2 1 396.579 3.395 20 0 GGADMP O=C(COc1ccccc1C[NH2+]C1CC[NH+](C2CCCC2)CC1)NCC1CC1 ZINC000176992412 1428544230 /nfs/dbraw/zinc/54/42/30/1428544230.db2.gz DQLVOFKTJBFTJL-UHFFFAOYSA-N 2 1 385.552 3.088 20 0 GGADMP C[C@@H](CN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000106485193 1411224415 /nfs/dbraw/zinc/22/44/15/1411224415.db2.gz OLGXOEXYUMKKDU-AWEZNQCLSA-N 2 1 392.887 3.234 20 0 GGADMP Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C[NH2+][C@@H](C)CN1CC[NH+](C)CC1 ZINC000106486052 1411224446 /nfs/dbraw/zinc/22/44/46/1411224446.db2.gz LYYKJHCYYDYNKB-AWEZNQCLSA-N 2 1 396.366 3.213 20 0 GGADMP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106518945 1411229649 /nfs/dbraw/zinc/22/96/49/1411229649.db2.gz NHRPCOJZAOJGLB-SJLPKXTDSA-N 2 1 376.570 3.201 20 0 GGADMP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000106518952 1411229848 /nfs/dbraw/zinc/22/98/48/1411229848.db2.gz NHRPCOJZAOJGLB-WMZOPIPTSA-N 2 1 376.570 3.201 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCCC1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000106522666 1411230671 /nfs/dbraw/zinc/23/06/71/1411230671.db2.gz QXLLWVWUELMYOD-NRFANRHFSA-N 2 1 384.568 3.489 20 0 GGADMP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000106522619 1411230776 /nfs/dbraw/zinc/23/07/76/1411230776.db2.gz FMYQFWVALUGZSI-NRFANRHFSA-N 2 1 384.568 3.489 20 0 GGADMP O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000106537792 1411237736 /nfs/dbraw/zinc/23/77/36/1411237736.db2.gz DWXHPOKZZARLDM-HXUWFJFHSA-N 2 1 388.531 3.106 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H]2CC[N@@H+](C3CCCC3)C2)cc1F ZINC000106545477 1411241294 /nfs/dbraw/zinc/24/12/94/1411241294.db2.gz CFOYIBXJUDTUHO-KRWDZBQOSA-N 2 1 385.487 3.136 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1F ZINC000106545477 1411241299 /nfs/dbraw/zinc/24/12/99/1411241299.db2.gz CFOYIBXJUDTUHO-KRWDZBQOSA-N 2 1 385.487 3.136 20 0 GGADMP CC(C)[N@@H+](C)CCNC(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000106555456 1411244868 /nfs/dbraw/zinc/24/48/68/1411244868.db2.gz HITHDCFFVZPTSK-UHFFFAOYSA-N 2 1 380.964 3.191 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(C(=O)Nc4ccccc4)cc3)C2)CC1 ZINC000107372008 1411366158 /nfs/dbraw/zinc/36/61/58/1411366158.db2.gz VWFUKPKQBRKMBJ-QHCPKHFHSA-N 2 1 392.547 3.151 20 0 GGADMP O=C(N[C@@H]1CC[NH+](CC2CC2)C1)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000108302672 1411467916 /nfs/dbraw/zinc/46/79/16/1411467916.db2.gz CPMAPMUGXHZWPX-QUCCMNQESA-N 2 1 395.469 3.042 20 0 GGADMP O=C(N[C@@H]1CC[N@H+](CC2CC2)C1)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1 ZINC000108302672 1411467925 /nfs/dbraw/zinc/46/79/25/1411467925.db2.gz CPMAPMUGXHZWPX-QUCCMNQESA-N 2 1 395.469 3.042 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@]1(C(F)(F)F)CC[NH+](Cc2ccccc2)C1 ZINC000108302672 1411467935 /nfs/dbraw/zinc/46/79/35/1411467935.db2.gz CPMAPMUGXHZWPX-QUCCMNQESA-N 2 1 395.469 3.042 20 0 GGADMP CC1CC[NH+](CCCNC(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)CC1 ZINC000108414303 1411494239 /nfs/dbraw/zinc/49/42/39/1411494239.db2.gz JWAVLZDPBGYDCH-UHFFFAOYSA-N 2 1 378.605 3.406 20 0 GGADMP CSc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000108420739 1411495281 /nfs/dbraw/zinc/49/52/81/1411495281.db2.gz CGJZFSICNUACQV-HXUWFJFHSA-N 2 1 383.561 3.396 20 0 GGADMP CC(C)Oc1ccccc1C[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000108420651 1411496115 /nfs/dbraw/zinc/49/61/15/1411496115.db2.gz ZZWAAVSUTHYKDZ-QFIPXVFZSA-N 2 1 395.547 3.461 20 0 GGADMP CCOc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000108421002 1411497169 /nfs/dbraw/zinc/49/71/69/1411497169.db2.gz PBVNHUBPCJIIFU-OAQYLSRUSA-N 2 1 381.520 3.072 20 0 GGADMP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)cc(Br)c1OC(F)F ZINC000108428147 1411498137 /nfs/dbraw/zinc/49/81/37/1411498137.db2.gz LTZMDKQABKVCAA-LLVKDONJSA-N 2 1 393.272 3.491 20 0 GGADMP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc(Br)c1OC(F)F ZINC000108428147 1411498144 /nfs/dbraw/zinc/49/81/44/1411498144.db2.gz LTZMDKQABKVCAA-LLVKDONJSA-N 2 1 393.272 3.491 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)NC[C@@H]2CCC[N@@H+](C)C2)c2cccs2)CC1 ZINC000108541050 1411533880 /nfs/dbraw/zinc/53/38/80/1411533880.db2.gz UYVUXMLQNIJLIP-ROUUACIJSA-N 2 1 378.586 3.162 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000108551979 1411537399 /nfs/dbraw/zinc/53/73/99/1411537399.db2.gz WCWMRTRTRGIDJR-LPHOPBHVSA-N 2 1 378.948 3.118 20 0 GGADMP CCC(CC)[C@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)[NH+]1CCOCC1 ZINC000108710245 1411580830 /nfs/dbraw/zinc/58/08/30/1411580830.db2.gz DMIBDIWUVUIHQH-QFIPXVFZSA-N 2 1 387.568 3.149 20 0 GGADMP O=C([C@H]1CCC[N@H+](Cc2ccccc2)C1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000108930776 1411641919 /nfs/dbraw/zinc/64/19/19/1411641919.db2.gz MDXYDNVAOMYNED-DEOSSOPVSA-N 2 1 391.559 3.286 20 0 GGADMP O=C([C@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000108930776 1411641921 /nfs/dbraw/zinc/64/19/21/1411641921.db2.gz MDXYDNVAOMYNED-DEOSSOPVSA-N 2 1 391.559 3.286 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)c1ccccc1 ZINC000109339906 1411744649 /nfs/dbraw/zinc/74/46/49/1411744649.db2.gz MUOVOAQYHMHEFD-UNMCSNQZSA-N 2 1 383.511 3.457 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1C(=O)NCc1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000109443226 1411765234 /nfs/dbraw/zinc/76/52/34/1411765234.db2.gz JOPGUUUQTBVTSE-XQBPLPMBSA-N 2 1 387.568 3.177 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1C(=O)NCc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000109443226 1411765240 /nfs/dbraw/zinc/76/52/40/1411765240.db2.gz JOPGUUUQTBVTSE-XQBPLPMBSA-N 2 1 387.568 3.177 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1C(=O)NCc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000109443226 1411765244 /nfs/dbraw/zinc/76/52/44/1411765244.db2.gz JOPGUUUQTBVTSE-XQBPLPMBSA-N 2 1 387.568 3.177 20 0 GGADMP CC[C@H](CNC(=O)N1CCC[N@H+](C(C)(C)C)CC1)[NH+]1CCc2ccccc2C1 ZINC000109481152 1411771804 /nfs/dbraw/zinc/77/18/04/1411771804.db2.gz WZNZKFZYBFGBQG-OAQYLSRUSA-N 2 1 386.584 3.339 20 0 GGADMP CC[C@H](CNC(=O)N1CCC[NH+](C(C)(C)C)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000109481152 1411771807 /nfs/dbraw/zinc/77/18/07/1411771807.db2.gz WZNZKFZYBFGBQG-OAQYLSRUSA-N 2 1 386.584 3.339 20 0 GGADMP CC[C@H](CNC(=O)N1CCC[NH+](C(C)(C)C)CC1)[N@H+]1CCc2ccccc2C1 ZINC000109481152 1411771816 /nfs/dbraw/zinc/77/18/16/1411771816.db2.gz WZNZKFZYBFGBQG-OAQYLSRUSA-N 2 1 386.584 3.339 20 0 GGADMP C[C@H](CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)[N@@H+](C)Cc1ccccc1 ZINC000110350431 1411845774 /nfs/dbraw/zinc/84/57/74/1411845774.db2.gz WSDZEQSTAMCXIO-LJQANCHMSA-N 2 1 397.588 3.486 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)[N@@H+](C)Cc1ccccc1 ZINC000110350427 1411845994 /nfs/dbraw/zinc/84/59/94/1411845994.db2.gz WSDZEQSTAMCXIO-IBGZPJMESA-N 2 1 397.588 3.486 20 0 GGADMP COc1cc2[nH+]c(NCCC[N@H+](C)Cc3ccccc3)nc(N)c2cc1OC ZINC000110678544 1411863633 /nfs/dbraw/zinc/86/36/33/1411863633.db2.gz LTDXFEMGXHFUQM-UHFFFAOYSA-N 2 1 381.480 3.163 20 0 GGADMP COc1cc2[nH+]c(NCCC[N@@H+](C)Cc3ccccc3)nc(N)c2cc1OC ZINC000110678544 1411863635 /nfs/dbraw/zinc/86/36/35/1411863635.db2.gz LTDXFEMGXHFUQM-UHFFFAOYSA-N 2 1 381.480 3.163 20 0 GGADMP Cc1nc(-c2ccc(Br)cc2)nn1C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000111163428 1411892846 /nfs/dbraw/zinc/89/28/46/1411892846.db2.gz JBQOJOIRYUPKAL-UHFFFAOYSA-N 2 1 392.345 3.247 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3cnc4c(c3)c(C)nn4C)CC2)cs1 ZINC000111397344 1411940480 /nfs/dbraw/zinc/94/04/80/1411940480.db2.gz QTMLZPUJTHWVDN-UHFFFAOYSA-N 2 1 398.580 3.297 20 0 GGADMP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)C1 ZINC000111466380 1411968990 /nfs/dbraw/zinc/96/89/90/1411968990.db2.gz NNACKKYTQQQPPA-SFHVURJKSA-N 2 1 398.555 3.276 20 0 GGADMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)C1 ZINC000111466380 1411969012 /nfs/dbraw/zinc/96/90/12/1411969012.db2.gz NNACKKYTQQQPPA-SFHVURJKSA-N 2 1 398.555 3.276 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1CNC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000111482376 1411978129 /nfs/dbraw/zinc/97/81/29/1411978129.db2.gz DWOVWULKAOEVFL-ZWKOTPCHSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCCC[C@@H]1CNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000111482376 1411978146 /nfs/dbraw/zinc/97/81/46/1411978146.db2.gz DWOVWULKAOEVFL-ZWKOTPCHSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCCC[C@@H]1CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000111482376 1411978161 /nfs/dbraw/zinc/97/81/61/1411978161.db2.gz DWOVWULKAOEVFL-ZWKOTPCHSA-N 2 1 378.586 3.134 20 0 GGADMP C[C@H](C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000111607637 1412001163 /nfs/dbraw/zinc/00/11/63/1412001163.db2.gz LEGVUUFWYRBUDI-IFMALSPDSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@H](C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000111607637 1412001171 /nfs/dbraw/zinc/00/11/71/1412001171.db2.gz LEGVUUFWYRBUDI-IFMALSPDSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@H](C(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000111607637 1412001178 /nfs/dbraw/zinc/00/11/78/1412001178.db2.gz LEGVUUFWYRBUDI-IFMALSPDSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@H](C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000111607637 1412001181 /nfs/dbraw/zinc/00/11/81/1412001181.db2.gz LEGVUUFWYRBUDI-IFMALSPDSA-N 2 1 391.559 3.114 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cs1 ZINC000111646516 1412007762 /nfs/dbraw/zinc/00/77/62/1412007762.db2.gz PAOCPDIQIDRNLQ-IXDOHACOSA-N 2 1 392.613 3.295 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cs1 ZINC000111646516 1412007768 /nfs/dbraw/zinc/00/77/68/1412007768.db2.gz PAOCPDIQIDRNLQ-IXDOHACOSA-N 2 1 392.613 3.295 20 0 GGADMP CC(C)[NH2+]C1CCN(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)CC1 ZINC000111834196 1412035797 /nfs/dbraw/zinc/03/57/97/1412035797.db2.gz DYQBETNMGGQHPO-UHFFFAOYSA-N 2 1 394.510 3.101 20 0 GGADMP O=C(C[N@H+]1CCS[C@@H]2CCCC[C@@H]21)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000177188741 1428622153 /nfs/dbraw/zinc/62/21/53/1428622153.db2.gz ZIOKKECBHSEBPG-LEWJYISDSA-N 2 1 387.593 3.259 20 0 GGADMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(CC[NH+](C)C)Cc2ccccn2)C1 ZINC000111881252 1412043054 /nfs/dbraw/zinc/04/30/54/1412043054.db2.gz PXQKPTPYWOCKKA-LJQANCHMSA-N 2 1 389.588 3.055 20 0 GGADMP CCOc1cc2[nH+]ccc(N3CC[C@H](N4CC[NH+](CC)CC4)C3)c2cc1OCC ZINC000112333126 1412132362 /nfs/dbraw/zinc/13/23/62/1412132362.db2.gz LOGIWWKMPGGQMM-SFHVURJKSA-N 2 1 398.551 3.248 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](CCCc2nc(-c3ccccc3)no2)CC1 ZINC000112649189 1412186711 /nfs/dbraw/zinc/18/67/11/1412186711.db2.gz MMJHZPMPYXIYEX-BGYRXZFFSA-N 2 1 397.567 3.160 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](CCCc2nc(-c3ccccc3)no2)CC1 ZINC000112649189 1412186721 /nfs/dbraw/zinc/18/67/21/1412186721.db2.gz MMJHZPMPYXIYEX-BGYRXZFFSA-N 2 1 397.567 3.160 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)[C@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)C[N@H+]1C1CC1 ZINC000177215659 1428636742 /nfs/dbraw/zinc/63/67/42/1428636742.db2.gz HNEPDHXMJHKCQS-MDYRTPRTSA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)[C@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)C[NH+]1C1CC1 ZINC000177215659 1428636745 /nfs/dbraw/zinc/63/67/45/1428636745.db2.gz HNEPDHXMJHKCQS-MDYRTPRTSA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C[NH+]1C1CC1 ZINC000177215659 1428636749 /nfs/dbraw/zinc/63/67/49/1428636749.db2.gz HNEPDHXMJHKCQS-MDYRTPRTSA-N 2 1 395.469 3.182 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000113197840 1412273546 /nfs/dbraw/zinc/27/35/46/1412273546.db2.gz SJBGBMXJSJGCBZ-HXUWFJFHSA-N 2 1 375.582 3.230 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000113197843 1412273685 /nfs/dbraw/zinc/27/36/85/1412273685.db2.gz SJBGBMXJSJGCBZ-FQEVSTJZSA-N 2 1 375.582 3.230 20 0 GGADMP CC[C@H]1CCCC[N@@H+]1CCNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000113198536 1412273973 /nfs/dbraw/zinc/27/39/73/1412273973.db2.gz XYHZXXVKSUGMEC-IBGZPJMESA-N 2 1 378.586 3.044 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000113198536 1412273980 /nfs/dbraw/zinc/27/39/80/1412273980.db2.gz XYHZXXVKSUGMEC-IBGZPJMESA-N 2 1 378.586 3.044 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177220484 1428638500 /nfs/dbraw/zinc/63/85/00/1428638500.db2.gz SMJGFSLGEUNPIG-ROUUACIJSA-N 2 1 381.586 3.242 20 0 GGADMP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2csc(COc3ccc(C)cc3)n2)CC1 ZINC000113321835 1412292158 /nfs/dbraw/zinc/29/21/58/1412292158.db2.gz KJLQCLQKPGJTNA-GOSISDBHSA-N 2 1 388.581 3.146 20 0 GGADMP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2csc(COc3ccccc3)n2)CC1 ZINC000113335734 1412294247 /nfs/dbraw/zinc/29/42/47/1412294247.db2.gz MDWXRWPTQABFKG-SFHVURJKSA-N 2 1 388.581 3.085 20 0 GGADMP C[C@@H]([NH2+]C1(CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CCCC1)c1ccccc1 ZINC000113595032 1412319349 /nfs/dbraw/zinc/31/93/49/1412319349.db2.gz DADKRAQNBFGOGV-RTBURBONSA-N 2 1 384.568 3.434 20 0 GGADMP C[C@@H]([NH2+]C1(CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CCCC1)c1ccccc1 ZINC000113595027 1412319604 /nfs/dbraw/zinc/31/96/04/1412319604.db2.gz DADKRAQNBFGOGV-MOPGFXCFSA-N 2 1 384.568 3.434 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CCCC1)c1ccccc1 ZINC000113595029 1412319635 /nfs/dbraw/zinc/31/96/35/1412319635.db2.gz DADKRAQNBFGOGV-RBUKOAKNSA-N 2 1 384.568 3.434 20 0 GGADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000113934493 1412355363 /nfs/dbraw/zinc/35/53/63/1412355363.db2.gz BFLDKNWQXIRDIL-RBUKOAKNSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000113934493 1412355365 /nfs/dbraw/zinc/35/53/65/1412355365.db2.gz BFLDKNWQXIRDIL-RBUKOAKNSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000113934493 1412355368 /nfs/dbraw/zinc/35/53/68/1412355368.db2.gz BFLDKNWQXIRDIL-RBUKOAKNSA-N 2 1 383.536 3.259 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000113934493 1412355370 /nfs/dbraw/zinc/35/53/70/1412355370.db2.gz BFLDKNWQXIRDIL-RBUKOAKNSA-N 2 1 383.536 3.259 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)CCn3cc[nH+]c3C(C)C)c(C)c2)CC1 ZINC000114161680 1412385285 /nfs/dbraw/zinc/38/52/85/1412385285.db2.gz HVEFSXLKTLSQKD-UHFFFAOYSA-N 2 1 383.540 3.486 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2cc(OC)ccc2OC)CC1 ZINC000114197243 1412392430 /nfs/dbraw/zinc/39/24/30/1412392430.db2.gz XDMOEEPHRVFKET-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2cc(OC)ccc2OC)CC1 ZINC000114197243 1412392438 /nfs/dbraw/zinc/39/24/38/1412392438.db2.gz XDMOEEPHRVFKET-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cc(OC)ccc2OC)CC1 ZINC000114197106 1412392564 /nfs/dbraw/zinc/39/25/64/1412392564.db2.gz BESNZNKDXIFJDB-QGZVFWFLSA-N 2 1 391.556 3.475 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cc(OC)ccc2OC)CC1 ZINC000114197106 1412392570 /nfs/dbraw/zinc/39/25/70/1412392570.db2.gz BESNZNKDXIFJDB-QGZVFWFLSA-N 2 1 391.556 3.475 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CC[NH+](C2CCCCC2)CC1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000177242658 1428647782 /nfs/dbraw/zinc/64/77/82/1428647782.db2.gz CNPOMEDGXNQGQF-OPYAIIAOSA-N 2 1 379.589 3.034 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000114424882 1412431643 /nfs/dbraw/zinc/43/16/43/1412431643.db2.gz AIEIMSXTDBDDQP-GOSISDBHSA-N 2 1 394.441 3.381 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000114424882 1412431650 /nfs/dbraw/zinc/43/16/50/1412431650.db2.gz AIEIMSXTDBDDQP-GOSISDBHSA-N 2 1 394.441 3.381 20 0 GGADMP COc1ccc(C[N@@H+](CC(=O)NC2CC[NH+](C(C)C)CC2)[C@H](C)C2CC2)cc1 ZINC000114455618 1412436790 /nfs/dbraw/zinc/43/67/90/1412436790.db2.gz LZBAGAPOIJWYPS-GOSISDBHSA-N 2 1 387.568 3.285 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CC=C(c3c[nH]c4cc(F)ccc43)CC2)CC1 ZINC000114455270 1412436870 /nfs/dbraw/zinc/43/68/70/1412436870.db2.gz XCCJPSWAKMQGPW-UHFFFAOYSA-N 2 1 398.526 3.385 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CC=C(c3c[nH]c4cc(F)ccc43)CC2)CC1 ZINC000114455270 1412436877 /nfs/dbraw/zinc/43/68/77/1412436877.db2.gz XCCJPSWAKMQGPW-UHFFFAOYSA-N 2 1 398.526 3.385 20 0 GGADMP C[N@H+](CCC(=O)Nc1ccc2c(c1)OCO2)C1CC[NH+](Cc2ccccc2)CC1 ZINC000114480975 1412442306 /nfs/dbraw/zinc/44/23/06/1412442306.db2.gz JJPHUWAXARFRLB-UHFFFAOYSA-N 2 1 395.503 3.340 20 0 GGADMP C[N@@H+](CCC(=O)Nc1ccc2c(c1)OCO2)C1CC[NH+](Cc2ccccc2)CC1 ZINC000114480975 1412442312 /nfs/dbraw/zinc/44/23/12/1412442312.db2.gz JJPHUWAXARFRLB-UHFFFAOYSA-N 2 1 395.503 3.340 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCN(CC(F)(F)F)C1=O ZINC000114748019 1412517790 /nfs/dbraw/zinc/51/77/90/1412517790.db2.gz QKEZPMPJQIIJOT-MAUKXSAKSA-N 2 1 383.458 3.314 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCN(CC(F)(F)F)C2=O)C1 ZINC000114748006 1412518079 /nfs/dbraw/zinc/51/80/79/1412518079.db2.gz OAWZEENNSAPBMA-MAUKXSAKSA-N 2 1 383.458 3.171 20 0 GGADMP Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000114752849 1412519340 /nfs/dbraw/zinc/51/93/40/1412519340.db2.gz NCSONGFYZMKRQQ-NVXWUHKLSA-N 2 1 384.524 3.111 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC000114783432 1412522696 /nfs/dbraw/zinc/52/26/96/1412522696.db2.gz KTZBNTZKXLWUGB-JOCHJYFZSA-N 2 1 380.536 3.212 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC(=O)Nc2cccc(C[NH+](C)C)c2)[C@H](C)C1 ZINC000115640094 1412741524 /nfs/dbraw/zinc/74/15/24/1412741524.db2.gz RGZAAEOFNNGMJX-XLIONFOSSA-N 2 1 376.545 3.007 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1)c1cccc(OC)c1 ZINC000115790470 1412789679 /nfs/dbraw/zinc/78/96/79/1412789679.db2.gz KJAJVPCMJUDMAU-NQIIRXRSSA-N 2 1 390.572 3.061 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000177306515 1428680651 /nfs/dbraw/zinc/68/06/51/1428680651.db2.gz MVHRNNYJNMDOED-NRFANRHFSA-N 2 1 381.520 3.286 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000177306515 1428680652 /nfs/dbraw/zinc/68/06/52/1428680652.db2.gz MVHRNNYJNMDOED-NRFANRHFSA-N 2 1 381.520 3.286 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)CC2)cs1 ZINC000116230997 1412845610 /nfs/dbraw/zinc/84/56/10/1412845610.db2.gz BXGXUVPDORTKAT-GOSISDBHSA-N 2 1 380.602 3.146 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000116434717 1412859553 /nfs/dbraw/zinc/85/95/53/1412859553.db2.gz UASBDUHLMVWRQS-OAQYLSRUSA-N 2 1 383.536 3.390 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)cc1 ZINC000116440901 1412861315 /nfs/dbraw/zinc/86/13/15/1412861315.db2.gz NUWHAOOFAJQMGH-OAQYLSRUSA-N 2 1 383.511 3.416 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)C1 ZINC000116449630 1412862018 /nfs/dbraw/zinc/86/20/18/1412862018.db2.gz JJJQJQDLCBJYLX-SFHLNBCPSA-N 2 1 386.584 3.166 20 0 GGADMP CC(C)(C)OC(=O)N1CCC([NH2+]CC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC000177325523 1428690096 /nfs/dbraw/zinc/69/00/96/1428690096.db2.gz PZLVTMTYZWGJAK-UHFFFAOYSA-N 2 1 381.561 3.011 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)CC1 ZINC000118421216 1413159319 /nfs/dbraw/zinc/15/93/19/1413159319.db2.gz ZCLJVDAEPCSJQS-UTKZUKDTSA-N 2 1 375.582 3.154 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)CC1 ZINC000118421216 1413159329 /nfs/dbraw/zinc/15/93/29/1413159329.db2.gz ZCLJVDAEPCSJQS-UTKZUKDTSA-N 2 1 375.582 3.154 20 0 GGADMP CN(CC[N@H+](C)Cc1cccc(C(=O)Nc2ccccc2)c1)C1CC[NH+](C)CC1 ZINC000177376454 1428709873 /nfs/dbraw/zinc/70/98/73/1428709873.db2.gz DOPFJJYFSDQVQI-UHFFFAOYSA-N 2 1 394.563 3.397 20 0 GGADMP CN(CC[N@@H+](C)Cc1cccc(C(=O)Nc2ccccc2)c1)C1CC[NH+](C)CC1 ZINC000177376454 1428709875 /nfs/dbraw/zinc/70/98/75/1428709875.db2.gz DOPFJJYFSDQVQI-UHFFFAOYSA-N 2 1 394.563 3.397 20 0 GGADMP COc1ccc([C@H](CNC(=O)CCn2cc[nH+]c2C(C)C)[NH+]2CCCC2)cc1 ZINC000118754377 1413215624 /nfs/dbraw/zinc/21/56/24/1413215624.db2.gz FBFWLNDFJCQQQC-FQEVSTJZSA-N 2 1 384.524 3.359 20 0 GGADMP CN(CC[N@@H+](C)Cc1c(-c2ccccc2)nc2ccccn21)C1CC[NH+](C)CC1 ZINC000177377640 1428710563 /nfs/dbraw/zinc/71/05/63/1428710563.db2.gz VWJBQJOBUSFWRD-UHFFFAOYSA-N 2 1 391.563 3.459 20 0 GGADMP CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000118814006 1413230558 /nfs/dbraw/zinc/23/05/58/1413230558.db2.gz NZXGCVBRZNXYTJ-IBGZPJMESA-N 2 1 390.597 3.083 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cc(=O)oc4cc(C)c(C(C)C)cc34)C2)CC1 ZINC000118834570 1413237992 /nfs/dbraw/zinc/23/79/92/1413237992.db2.gz JDBRTCRSAZSWJL-FQEVSTJZSA-N 2 1 397.563 3.437 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)N[C@@H](c2nccs2)c2ccccc2)CC1 ZINC000118868420 1413254940 /nfs/dbraw/zinc/25/49/40/1413254940.db2.gz VVNOAXDZSHHXPQ-HXUWFJFHSA-N 2 1 386.565 3.012 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)N[C@H](c2nccs2)c2ccccc2)CC1 ZINC000118868418 1413255050 /nfs/dbraw/zinc/25/50/50/1413255050.db2.gz VVNOAXDZSHHXPQ-FQEVSTJZSA-N 2 1 386.565 3.012 20 0 GGADMP CC(C)CCO[C@@H]1CC[N@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000177371524 1428708126 /nfs/dbraw/zinc/70/81/26/1428708126.db2.gz QWUULPYVLXAJNM-JOCHJYFZSA-N 2 1 387.568 3.036 20 0 GGADMP CC(C)CCO[C@@H]1CC[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000177371524 1428708129 /nfs/dbraw/zinc/70/81/29/1428708129.db2.gz QWUULPYVLXAJNM-JOCHJYFZSA-N 2 1 387.568 3.036 20 0 GGADMP Cc1c(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)cnn1-c1cc[nH+]cc1 ZINC000119002623 1413300655 /nfs/dbraw/zinc/30/06/55/1413300655.db2.gz ZZLZNKGZIROBGU-OAQYLSRUSA-N 2 1 375.476 3.143 20 0 GGADMP Cc1c(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cnn1-c1cc[nH+]cc1 ZINC000119012081 1413303161 /nfs/dbraw/zinc/30/31/61/1413303161.db2.gz HGBVJFAMCHVLAK-YLJYHZDGSA-N 2 1 389.503 3.359 20 0 GGADMP Cc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cnn1-c1cc[nH+]cc1 ZINC000119012081 1413303170 /nfs/dbraw/zinc/30/31/70/1413303170.db2.gz HGBVJFAMCHVLAK-YLJYHZDGSA-N 2 1 389.503 3.359 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+]2CCc3ccccc3[C@H]2Cc2ccccc2)CC1 ZINC000119038435 1413312800 /nfs/dbraw/zinc/31/28/00/1413312800.db2.gz OAFFFNACBYHZTP-XMMPIXPASA-N 2 1 391.559 3.429 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+]2CCc3ccccc3[C@@H]2Cc2ccccc2)CC1 ZINC000119038266 1413312966 /nfs/dbraw/zinc/31/29/66/1413312966.db2.gz OAFFFNACBYHZTP-DEOSSOPVSA-N 2 1 391.559 3.429 20 0 GGADMP CC[NH+](CC)Cc1ccccc1CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C ZINC000119040925 1413313737 /nfs/dbraw/zinc/31/37/37/1413313737.db2.gz CQMUVMNYJQXIHL-UHFFFAOYSA-N 2 1 377.492 3.348 20 0 GGADMP Cc1c(C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)cnn1-c1cc[nH+]cc1 ZINC000119046835 1413315756 /nfs/dbraw/zinc/31/57/56/1413315756.db2.gz BEDWKDRHACSDIF-UHFFFAOYSA-N 2 1 389.503 3.492 20 0 GGADMP CCc1cc(N2CCC[C@@H]([NH2+]C3CC[NH+](CCc4ccccc4)CC3)C2)ncn1 ZINC000119055181 1413319070 /nfs/dbraw/zinc/31/90/70/1413319070.db2.gz ULDPYVKKARZBDT-HSZRJFAPSA-N 2 1 393.579 3.305 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cc(Cl)ccc3F)c2)C1 ZINC000119145597 1413354594 /nfs/dbraw/zinc/35/45/94/1413354594.db2.gz DUTXIUICQUTJPC-KRWDZBQOSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(Cl)ccc3F)c2)C1 ZINC000119145597 1413354602 /nfs/dbraw/zinc/35/46/02/1413354602.db2.gz DUTXIUICQUTJPC-KRWDZBQOSA-N 2 1 389.902 3.466 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)[NH+]2CCCC2)o1 ZINC000119184917 1413369722 /nfs/dbraw/zinc/36/97/22/1413369722.db2.gz GXVLABOWKLPVCU-RTBURBONSA-N 2 1 376.545 3.002 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](CCC[NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000119270109 1413395269 /nfs/dbraw/zinc/39/52/69/1413395269.db2.gz YQXTYCDIHKOIFC-FQEVSTJZSA-N 2 1 399.510 3.082 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000119270109 1413395278 /nfs/dbraw/zinc/39/52/78/1413395278.db2.gz YQXTYCDIHKOIFC-FQEVSTJZSA-N 2 1 399.510 3.082 20 0 GGADMP CCc1noc(C)c1C[NH+]1CCC(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000119402764 1413435235 /nfs/dbraw/zinc/43/52/35/1413435235.db2.gz HMCJYIBESVDBAA-UHFFFAOYSA-N 2 1 398.551 3.006 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000119714711 1413542498 /nfs/dbraw/zinc/54/24/98/1413542498.db2.gz MVTWCEIASIWVNL-KRWDZBQOSA-N 2 1 391.581 3.139 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)N[C@@H]2CC[NH+](CC3CC3)C2)CC1 ZINC000119880349 1413603109 /nfs/dbraw/zinc/60/31/09/1413603109.db2.gz VZQUAUKAXAFJCB-WIYYLYMNSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)N[C@@H]2CC[N@H+](CC3CC3)C2)CC1 ZINC000119880349 1413603113 /nfs/dbraw/zinc/60/31/13/1413603113.db2.gz VZQUAUKAXAFJCB-WIYYLYMNSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000119880349 1413603118 /nfs/dbraw/zinc/60/31/18/1413603118.db2.gz VZQUAUKAXAFJCB-WIYYLYMNSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@]1(C(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CCC[NH2+]C1 ZINC000119900187 1413610603 /nfs/dbraw/zinc/61/06/03/1413610603.db2.gz MZIGDHJLMYRUMS-LJQANCHMSA-N 2 1 383.458 3.129 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc4ncccc4c3)CC2)CC1 ZINC000119992738 1413645145 /nfs/dbraw/zinc/64/51/45/1413645145.db2.gz DJBIVONFROHTHM-UHFFFAOYSA-N 2 1 380.536 3.001 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NCC1([NH+]2CCCCC2)CCCCC1 ZINC000120009984 1413652397 /nfs/dbraw/zinc/65/23/97/1413652397.db2.gz JICHQWZNJBZCJQ-UHFFFAOYSA-N 2 1 375.561 3.412 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)N(C)CCCn1cc[nH+]c1C)[NH+]1CCCC1 ZINC000120077318 1413678478 /nfs/dbraw/zinc/67/84/78/1413678478.db2.gz WGCCYXOTROIOKM-HXUWFJFHSA-N 2 1 399.539 3.069 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000120092793 1413684524 /nfs/dbraw/zinc/68/45/24/1413684524.db2.gz LJJMWXZQDFTONW-QGZVFWFLSA-N 2 1 375.542 3.122 20 0 GGADMP CC(C)[NH+](CCNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)C ZINC000120110542 1413691953 /nfs/dbraw/zinc/69/19/53/1413691953.db2.gz XWIPVNJGXDIONM-SFHVURJKSA-N 2 1 380.602 3.378 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)c1ccco1 ZINC000120153836 1413709229 /nfs/dbraw/zinc/70/92/29/1413709229.db2.gz DHILKVCSBLIJTE-IBGZPJMESA-N 2 1 376.545 3.180 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1OCC(F)F ZINC000120236788 1413745152 /nfs/dbraw/zinc/74/51/52/1413745152.db2.gz FTMROZCVKXRNBN-MRXNPFEDSA-N 2 1 398.498 3.210 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)c1ccccc1 ZINC000120410385 1413812110 /nfs/dbraw/zinc/81/21/10/1413812110.db2.gz FNSYVGDVBNYDBN-NRFANRHFSA-N 2 1 377.492 3.389 20 0 GGADMP Cc1c(C(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)cnn1-c1cc[nH+]cc1 ZINC000120707740 1413880504 /nfs/dbraw/zinc/88/05/04/1413880504.db2.gz GTVDTYXZAFHBKW-GOSISDBHSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1c(C(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)cnn1-c1cc[nH+]cc1 ZINC000120707740 1413880505 /nfs/dbraw/zinc/88/05/05/1413880505.db2.gz GTVDTYXZAFHBKW-GOSISDBHSA-N 2 1 389.503 3.312 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCc2ccc(C[NH+](C)C)cc2)C[N@H+]1Cc1ccccc1 ZINC000120713189 1413882199 /nfs/dbraw/zinc/88/21/99/1413882199.db2.gz UWDGZCNGHXXLQF-GCJKJVERSA-N 2 1 380.536 3.210 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCc2ccc(C[NH+](C)C)cc2)C[N@H+]1Cc1ccccc1 ZINC000120713486 1413882816 /nfs/dbraw/zinc/88/28/16/1413882816.db2.gz UWDGZCNGHXXLQF-XMSQKQJNSA-N 2 1 380.536 3.210 20 0 GGADMP Cc1cc(-c2noc([C@@H](C)[NH+]3CCC(C[NH+]4CCOCC4)CC3)n2)ccc1F ZINC000120721391 1413884560 /nfs/dbraw/zinc/88/45/60/1413884560.db2.gz XTHHLHPJZLMWKM-MRXNPFEDSA-N 2 1 388.487 3.289 20 0 GGADMP C[NH+](C)[C@@H](C(=O)Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccccc1 ZINC000120721886 1413885088 /nfs/dbraw/zinc/88/50/88/1413885088.db2.gz ALVGBYFGJBLATA-JOCHJYFZSA-N 2 1 381.520 3.132 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000120854720 1413927852 /nfs/dbraw/zinc/92/78/52/1413927852.db2.gz ANPCLYJFQHOOPH-FQEVSTJZSA-N 2 1 387.568 3.145 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000120854720 1413927854 /nfs/dbraw/zinc/92/78/54/1413927854.db2.gz ANPCLYJFQHOOPH-FQEVSTJZSA-N 2 1 387.568 3.145 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(CC[NH+](C)C)Cc2ccco2)cc1F ZINC000120884046 1413936744 /nfs/dbraw/zinc/93/67/44/1413936744.db2.gz NJNHRWFTTNUCNW-UHFFFAOYSA-N 2 1 399.470 3.186 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)C1 ZINC000120898505 1413941703 /nfs/dbraw/zinc/94/17/03/1413941703.db2.gz PMXKPCBADFVZFO-VQTJNVASSA-N 2 1 386.584 3.489 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)C1 ZINC000120898662 1413941781 /nfs/dbraw/zinc/94/17/81/1413941781.db2.gz PMXKPCBADFVZFO-PMACEKPBSA-N 2 1 386.584 3.489 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3cccc(C(=O)N(C)C)c3)CC2)C[C@H](C)O1 ZINC000177495594 1428768772 /nfs/dbraw/zinc/76/87/72/1428768772.db2.gz LFVSGUXGLDKNLE-KDURUIRLSA-N 2 1 387.568 3.100 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3cc(F)cc4c3OCOC4)CC2)C[C@H](C)O1 ZINC000177497365 1428770098 /nfs/dbraw/zinc/77/00/98/1428770098.db2.gz NRAGOJFVTOYNFS-CALCHBBNSA-N 2 1 392.515 3.404 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)o1 ZINC000121039004 1413985743 /nfs/dbraw/zinc/98/57/43/1413985743.db2.gz HYEYPBJTZZBOFP-UHFFFAOYSA-N 2 1 379.508 3.015 20 0 GGADMP CCc1ccccc1NC(=O)C[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000177502872 1428771903 /nfs/dbraw/zinc/77/19/03/1428771903.db2.gz LPMSHAREXFRAGS-RTBURBONSA-N 2 1 387.568 3.399 20 0 GGADMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000121112480 1414011775 /nfs/dbraw/zinc/01/17/75/1414011775.db2.gz MFQQYVBBYPNSCB-HNNXBMFYSA-N 2 1 376.932 3.255 20 0 GGADMP Cc1cccc(NC(=O)C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c1C ZINC000177507253 1428774514 /nfs/dbraw/zinc/77/45/14/1428774514.db2.gz WTXWIHFTGFMMJH-OALUTQOASA-N 2 1 387.568 3.453 20 0 GGADMP Cc1ccc(C)c(NC(=O)C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000177510002 1428776088 /nfs/dbraw/zinc/77/60/88/1428776088.db2.gz WWCLZMREBDLDDR-BGYRXZFFSA-N 2 1 387.568 3.453 20 0 GGADMP Cc1ccc(C)c(NC(=O)C[NH+]2CCC(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000177510002 1428776092 /nfs/dbraw/zinc/77/60/92/1428776092.db2.gz WWCLZMREBDLDDR-BGYRXZFFSA-N 2 1 387.568 3.453 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@@H](c1ccc(C)cc1)[NH+]1CCCC1 ZINC000121276559 1414068651 /nfs/dbraw/zinc/06/86/51/1414068651.db2.gz FNZYNUJJIFVPTN-NRFANRHFSA-N 2 1 383.540 3.369 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000121280353 1414069326 /nfs/dbraw/zinc/06/93/26/1414069326.db2.gz HIVLQZGFZJCNIH-GOSISDBHSA-N 2 1 383.540 3.449 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)Cc1ccccc1 ZINC000121465777 1414137077 /nfs/dbraw/zinc/13/70/77/1414137077.db2.gz BTZNAYWTGFCVOH-NRFANRHFSA-N 2 1 391.519 3.259 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000121490338 1414147255 /nfs/dbraw/zinc/14/72/55/1414147255.db2.gz UNXWURKLKFXLSZ-KBPBESRZSA-N 2 1 378.904 3.497 20 0 GGADMP Cc1c(C(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)cnn1-c1cc[nH+]cc1 ZINC000121543687 1414169954 /nfs/dbraw/zinc/16/99/54/1414169954.db2.gz FISQMKPQMQAHRE-UHFFFAOYSA-N 2 1 389.503 3.312 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1C)c1ccsc1 ZINC000121676954 1414220414 /nfs/dbraw/zinc/22/04/14/1414220414.db2.gz UEZMHZGEAFXJLN-IBGZPJMESA-N 2 1 383.521 3.450 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3cnn(Cc4ccccc4)c3)c2)CCO1 ZINC000121689086 1414224626 /nfs/dbraw/zinc/22/46/26/1414224626.db2.gz VNFSTKJJECFBAZ-HXUWFJFHSA-N 2 1 390.531 3.442 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3cnn(Cc4ccccc4)c3)c2)CCO1 ZINC000121689086 1414224628 /nfs/dbraw/zinc/22/46/28/1414224628.db2.gz VNFSTKJJECFBAZ-HXUWFJFHSA-N 2 1 390.531 3.442 20 0 GGADMP C[C@@H](CC(=O)Nc1ccccc1)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000121690598 1414225157 /nfs/dbraw/zinc/22/51/57/1414225157.db2.gz SGPAIFBYCZYTAW-RBUKOAKNSA-N 2 1 381.520 3.414 20 0 GGADMP C[C@@H](CC(=O)Nc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000121690598 1414225163 /nfs/dbraw/zinc/22/51/63/1414225163.db2.gz SGPAIFBYCZYTAW-RBUKOAKNSA-N 2 1 381.520 3.414 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc(-n4ccnc4)cc3)c2)CCO1 ZINC000121694961 1414226016 /nfs/dbraw/zinc/22/60/16/1414226016.db2.gz RMRKWMWEHWHCIF-IBGZPJMESA-N 2 1 376.504 3.383 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(-n4ccnc4)cc3)c2)CCO1 ZINC000121694961 1414226020 /nfs/dbraw/zinc/22/60/20/1414226020.db2.gz RMRKWMWEHWHCIF-IBGZPJMESA-N 2 1 376.504 3.383 20 0 GGADMP CC(C)n1nccc1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000121825882 1414270360 /nfs/dbraw/zinc/27/03/60/1414270360.db2.gz VLTYYWQZTNUTLW-SFHVURJKSA-N 2 1 375.561 3.379 20 0 GGADMP CC(C)N(CC(F)(F)F)C(=O)C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000121944407 1414317149 /nfs/dbraw/zinc/31/71/49/1414317149.db2.gz LZGSGIZKTQBYPS-UHFFFAOYSA-N 2 1 377.495 3.374 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000121976282 1414329203 /nfs/dbraw/zinc/32/92/03/1414329203.db2.gz YFQZVCKKRDOWEC-NQIIRXRSSA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000121976282 1414329208 /nfs/dbraw/zinc/32/92/08/1414329208.db2.gz YFQZVCKKRDOWEC-NQIIRXRSSA-N 2 1 383.540 3.276 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H]2CCN(c3ccccc3F)C2=O)CC1 ZINC000122049724 1414349261 /nfs/dbraw/zinc/34/92/61/1414349261.db2.gz YXPKAUKLQMOEJK-OAQYLSRUSA-N 2 1 391.531 3.001 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H]2CCN(c3ccccc3F)C2=O)CC1 ZINC000122049724 1414349270 /nfs/dbraw/zinc/34/92/70/1414349270.db2.gz YXPKAUKLQMOEJK-OAQYLSRUSA-N 2 1 391.531 3.001 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000122179564 1414381128 /nfs/dbraw/zinc/38/11/28/1414381128.db2.gz ROAZHTQGKQFEKC-IBGZPJMESA-N 2 1 385.556 3.399 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000122179564 1414381140 /nfs/dbraw/zinc/38/11/40/1414381140.db2.gz ROAZHTQGKQFEKC-IBGZPJMESA-N 2 1 385.556 3.399 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)CC(=O)Nc2cccnc2Cl)[C@H](C)C1 ZINC000122229180 1414394854 /nfs/dbraw/zinc/39/48/54/1414394854.db2.gz ZPRDSNPHBZYELH-IKGGRYGDSA-N 2 1 396.963 3.179 20 0 GGADMP Clc1ccccc1[C@@H](C[NH2+]C1CC[NH+](CC2CC2)CC1)N1CCOCC1 ZINC000122701222 1414542335 /nfs/dbraw/zinc/54/23/35/1414542335.db2.gz WEXNTEROYYPOFW-OAQYLSRUSA-N 2 1 377.960 3.177 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)c(OC)c1 ZINC000122725961 1414550167 /nfs/dbraw/zinc/55/01/67/1414550167.db2.gz ZINFFJCJXCLEMC-DLBZAZTESA-N 2 1 377.529 3.275 20 0 GGADMP C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000122754333 1414557216 /nfs/dbraw/zinc/55/72/16/1414557216.db2.gz VWFLTMOWRXPSRZ-INIZCTEOSA-N 2 1 386.927 3.490 20 0 GGADMP C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000122754333 1414557220 /nfs/dbraw/zinc/55/72/20/1414557220.db2.gz VWFLTMOWRXPSRZ-INIZCTEOSA-N 2 1 386.927 3.490 20 0 GGADMP CC[NH+]1CCN(C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC1 ZINC000122791022 1414565649 /nfs/dbraw/zinc/56/56/49/1414565649.db2.gz FUASPIYMOOFFGJ-UHFFFAOYSA-N 2 1 380.536 3.262 20 0 GGADMP CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000122915690 1414595678 /nfs/dbraw/zinc/59/56/78/1414595678.db2.gz XKRNHKCRZUGBIC-MSOLQXFVSA-N 2 1 381.561 3.057 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)c1ccccc1 ZINC000123043275 1414626293 /nfs/dbraw/zinc/62/62/93/1414626293.db2.gz XIPBKAWMFOZGLC-NRFANRHFSA-N 2 1 397.567 3.467 20 0 GGADMP COc1ccc(-c2noc(C[NH+]3CCC(CCC[NH+](C)C)CC3)n2)c(OC)c1 ZINC000123120262 1414646839 /nfs/dbraw/zinc/64/68/39/1414646839.db2.gz SUVRDJTYOREXAE-UHFFFAOYSA-N 2 1 388.512 3.308 20 0 GGADMP CC(C)[NH+]1CCN(c2cccc(NC(=O)C[N@@H+](C)Cc3ccccc3)c2)CC1 ZINC000123289701 1414688454 /nfs/dbraw/zinc/68/84/54/1414688454.db2.gz CFGVVHCCEIZUIP-UHFFFAOYSA-N 2 1 380.536 3.288 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH+]2CCC(CCC[NH+](C)C)CC2)c(OC)c1 ZINC000123407949 1414720620 /nfs/dbraw/zinc/72/06/20/1414720620.db2.gz RADYTCSQBWWMRB-INIZCTEOSA-N 2 1 377.529 3.085 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)CC2)nc(C)[nH+]1 ZINC000123412840 1414723006 /nfs/dbraw/zinc/72/30/06/1414723006.db2.gz IEFCEWWKOGNEPY-ROUUACIJSA-N 2 1 389.544 3.098 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)[NH+]1CCc2ccccc2C1 ZINC000123440794 1414732849 /nfs/dbraw/zinc/73/28/49/1414732849.db2.gz UDGSMZSBTXMWDN-JMUQELJHSA-N 2 1 396.579 3.092 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000123440794 1414732862 /nfs/dbraw/zinc/73/28/62/1414732862.db2.gz UDGSMZSBTXMWDN-JMUQELJHSA-N 2 1 396.579 3.092 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000123440794 1414732870 /nfs/dbraw/zinc/73/28/70/1414732870.db2.gz UDGSMZSBTXMWDN-JMUQELJHSA-N 2 1 396.579 3.092 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3cc4ccccc4[nH]c3=O)c2)CCO1 ZINC000123446254 1414734579 /nfs/dbraw/zinc/73/45/79/1414734579.db2.gz WXUPZBBWYCNMBH-KRWDZBQOSA-N 2 1 377.488 3.451 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3cc4ccccc4[nH]c3=O)c2)CCO1 ZINC000123446254 1414734584 /nfs/dbraw/zinc/73/45/84/1414734584.db2.gz WXUPZBBWYCNMBH-KRWDZBQOSA-N 2 1 377.488 3.451 20 0 GGADMP C[C@H](NC(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)c1ccc2c(c1)CCCC2 ZINC000123528829 1414764496 /nfs/dbraw/zinc/76/44/96/1414764496.db2.gz URGTVMBFYKKORW-RBUKOAKNSA-N 2 1 394.563 3.431 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)c1ccc2c(c1)CCCC2 ZINC000123528829 1414764506 /nfs/dbraw/zinc/76/45/06/1414764506.db2.gz URGTVMBFYKKORW-RBUKOAKNSA-N 2 1 394.563 3.431 20 0 GGADMP Cc1ccsc1-c1nnc(NC(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)o1 ZINC000123599685 1414790232 /nfs/dbraw/zinc/79/02/32/1414790232.db2.gz KDLSMJIMEHHYNM-UHFFFAOYSA-N 2 1 391.541 3.099 20 0 GGADMP C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123656953 1414805334 /nfs/dbraw/zinc/80/53/34/1414805334.db2.gz ZKZPJGBYBZYYLL-INIZCTEOSA-N 2 1 383.544 3.312 20 0 GGADMP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+]([C@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000123677489 1414808130 /nfs/dbraw/zinc/80/81/30/1414808130.db2.gz PDGZVPLXJFKYHP-KNQAVFIVSA-N 2 1 380.536 3.428 20 0 GGADMP Cn1cc[nH+]c1C[C@H]1CCC[N@H+]([C@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000123677489 1414808132 /nfs/dbraw/zinc/80/81/32/1414808132.db2.gz PDGZVPLXJFKYHP-KNQAVFIVSA-N 2 1 380.536 3.428 20 0 GGADMP C[C@H](C(=O)Nc1cccc2ncccc21)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000123773229 1414822767 /nfs/dbraw/zinc/82/27/67/1414822767.db2.gz JTFHTRRXKUOELO-IAGOWNOFSA-N 2 1 377.492 3.250 20 0 GGADMP C[C@H](C(=O)Nc1cccc2ncccc21)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123773229 1414822771 /nfs/dbraw/zinc/82/27/71/1414822771.db2.gz JTFHTRRXKUOELO-IAGOWNOFSA-N 2 1 377.492 3.250 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000123805339 1414827079 /nfs/dbraw/zinc/82/70/79/1414827079.db2.gz IZMHACVNQXUBQS-RTBURBONSA-N 2 1 397.567 3.380 20 0 GGADMP COc1cccc2c(NCc3cccc(C(=O)NCC[NH+](C)C)c3)cc(C)[nH+]c12 ZINC000124297201 1414932337 /nfs/dbraw/zinc/93/23/37/1414932337.db2.gz QYYCCXKZODYOMQ-UHFFFAOYSA-N 2 1 392.503 3.455 20 0 GGADMP COC[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000124469152 1414976036 /nfs/dbraw/zinc/97/60/36/1414976036.db2.gz PEQNFYUKDYXZMQ-LJQANCHMSA-N 2 1 387.490 3.256 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C[NH2+]C3CCN(CC(F)(F)F)CC3)cc2)C[C@H](C)O1 ZINC000124583571 1414999095 /nfs/dbraw/zinc/99/90/95/1414999095.db2.gz ZDABWGHOQPJSPR-CALCHBBNSA-N 2 1 399.501 3.412 20 0 GGADMP CC1(C)CN(C(=O)NCc2ccn3ccnc3c2)CC[N@H+]1Cc1ccccc1 ZINC000177792006 1428859263 /nfs/dbraw/zinc/85/92/63/1428859263.db2.gz GPWCEBDOWZNZAZ-UHFFFAOYSA-N 2 1 377.492 3.140 20 0 GGADMP CC1(C)CN(C(=O)NCc2ccn3ccnc3c2)CCN1Cc1ccccc1 ZINC000177792006 1428859265 /nfs/dbraw/zinc/85/92/65/1428859265.db2.gz GPWCEBDOWZNZAZ-UHFFFAOYSA-N 2 1 377.492 3.140 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000124876458 1415064584 /nfs/dbraw/zinc/06/45/84/1415064584.db2.gz UZEYEZJZCSSYAY-RCLSDMTESA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000124876458 1415064592 /nfs/dbraw/zinc/06/45/92/1415064592.db2.gz UZEYEZJZCSSYAY-RCLSDMTESA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000124876458 1415064598 /nfs/dbraw/zinc/06/45/98/1415064598.db2.gz UZEYEZJZCSSYAY-RCLSDMTESA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCc2cccc(C[NH+](C)C)c2)C[N@H+]1Cc1ccccc1 ZINC000124883270 1415066010 /nfs/dbraw/zinc/06/60/10/1415066010.db2.gz IBKCHXUCGBZINS-XMSQKQJNSA-N 2 1 380.536 3.210 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCc2cccc(C[NH+](C)C)c2)C[N@H+]1Cc1ccccc1 ZINC000124883017 1415066070 /nfs/dbraw/zinc/06/60/70/1415066070.db2.gz IBKCHXUCGBZINS-AVRDEDQJSA-N 2 1 380.536 3.210 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@@H]2CCc3ccccc32)c1 ZINC000125005372 1415090787 /nfs/dbraw/zinc/09/07/87/1415090787.db2.gz FCISKJDYPMRLTG-JOCHJYFZSA-N 2 1 379.504 3.125 20 0 GGADMP CCCOc1ccc(NC(=O)N(CC[NH+](C)C)C[C@H]2CCC[N@H+]2CC)cc1 ZINC000125014866 1415091665 /nfs/dbraw/zinc/09/16/65/1415091665.db2.gz QKIYVBJUYYJDNV-LJQANCHMSA-N 2 1 376.545 3.355 20 0 GGADMP C[C@@H](CSC(C)(C)C)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125024440 1415094069 /nfs/dbraw/zinc/09/40/69/1415094069.db2.gz YDJOBZHLKWYXLL-KRWDZBQOSA-N 2 1 393.597 3.357 20 0 GGADMP Cc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(NC(=O)CC[NH+]3CCOCC3)c1)CC2 ZINC000125037763 1415096996 /nfs/dbraw/zinc/09/69/96/1415096996.db2.gz KZNCXWUMXNDROI-HSZRJFAPSA-N 2 1 393.531 3.433 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C(=O)N3CCCC3)cc2)[C@H](C)C1 ZINC000177845693 1428871263 /nfs/dbraw/zinc/87/12/63/1428871263.db2.gz MXERPCXYIDBDHF-DENIHFKCSA-N 2 1 387.568 3.149 20 0 GGADMP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000177848607 1428872043 /nfs/dbraw/zinc/87/20/43/1428872043.db2.gz PFCNSZWVJZPIIO-UIFIKXQLSA-N 2 1 386.540 3.170 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000177848607 1428872048 /nfs/dbraw/zinc/87/20/48/1428872048.db2.gz PFCNSZWVJZPIIO-UIFIKXQLSA-N 2 1 386.540 3.170 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)C1 ZINC000177849315 1428872183 /nfs/dbraw/zinc/87/21/83/1428872183.db2.gz XRZDMVAXRDFOIE-PMACEKPBSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000177849315 1428872186 /nfs/dbraw/zinc/87/21/86/1428872186.db2.gz XRZDMVAXRDFOIE-PMACEKPBSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000177849315 1428872189 /nfs/dbraw/zinc/87/21/89/1428872189.db2.gz XRZDMVAXRDFOIE-PMACEKPBSA-N 2 1 386.584 3.402 20 0 GGADMP CCOc1ccc2cc(C(=O)N(CC[NH+](C)C)C[C@H]3CCC[N@H+]3CC)[nH]c2c1 ZINC000125588612 1415233010 /nfs/dbraw/zinc/23/30/10/1415233010.db2.gz CCDSTXOUETULJZ-GOSISDBHSA-N 2 1 386.540 3.055 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)C1 ZINC000125633591 1415242187 /nfs/dbraw/zinc/24/21/87/1415242187.db2.gz FMWMIPVBWRMJNZ-HXUWFJFHSA-N 2 1 378.605 3.308 20 0 GGADMP CC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000177882313 1428881981 /nfs/dbraw/zinc/88/19/81/1428881981.db2.gz NEPHCOHLQWZSAI-IBGZPJMESA-N 2 1 398.551 3.395 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000177882313 1428881986 /nfs/dbraw/zinc/88/19/86/1428881986.db2.gz NEPHCOHLQWZSAI-IBGZPJMESA-N 2 1 398.551 3.395 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000177882313 1428881987 /nfs/dbraw/zinc/88/19/87/1428881987.db2.gz NEPHCOHLQWZSAI-IBGZPJMESA-N 2 1 398.551 3.395 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000177882313 1428881990 /nfs/dbraw/zinc/88/19/90/1428881990.db2.gz NEPHCOHLQWZSAI-IBGZPJMESA-N 2 1 398.551 3.395 20 0 GGADMP CC[N@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000177882331 1428882069 /nfs/dbraw/zinc/88/20/69/1428882069.db2.gz NEPHCOHLQWZSAI-LJQANCHMSA-N 2 1 398.551 3.395 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000177882331 1428882071 /nfs/dbraw/zinc/88/20/71/1428882071.db2.gz NEPHCOHLQWZSAI-LJQANCHMSA-N 2 1 398.551 3.395 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000177882331 1428882073 /nfs/dbraw/zinc/88/20/73/1428882073.db2.gz NEPHCOHLQWZSAI-LJQANCHMSA-N 2 1 398.551 3.395 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000177882331 1428882076 /nfs/dbraw/zinc/88/20/76/1428882076.db2.gz NEPHCOHLQWZSAI-LJQANCHMSA-N 2 1 398.551 3.395 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000125654794 1415247646 /nfs/dbraw/zinc/24/76/46/1415247646.db2.gz HYWAFPWPRZICJV-NRFANRHFSA-N 2 1 378.605 3.404 20 0 GGADMP C[C@H]1CN(C(=O)c2ccc(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000177922854 1428892064 /nfs/dbraw/zinc/89/20/64/1428892064.db2.gz XDJBWNUKJQAMRD-ROUUACIJSA-N 2 1 387.568 3.289 20 0 GGADMP COc1ccc(NC(=O)C[C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(OC)c1 ZINC000125748914 1415269782 /nfs/dbraw/zinc/26/97/82/1415269782.db2.gz BVZLFBFJNZHIIP-DLBZAZTESA-N 2 1 377.529 3.131 20 0 GGADMP C[C@@H]1CN(C(=O)c2ccc(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2)C[C@@H](C)O1 ZINC000177922869 1428892283 /nfs/dbraw/zinc/89/22/83/1428892283.db2.gz XDJBWNUKJQAMRD-QZTJIDSGSA-N 2 1 387.568 3.289 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)NC[C@@H]2CC[NH+](C3CC3)C2)C1 ZINC000125804053 1415285782 /nfs/dbraw/zinc/28/57/82/1415285782.db2.gz VTWOGZJGXKVXGQ-ZCNNSNEGSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000125804053 1415285790 /nfs/dbraw/zinc/28/57/90/1415285790.db2.gz VTWOGZJGXKVXGQ-ZCNNSNEGSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)C1 ZINC000125804053 1415285798 /nfs/dbraw/zinc/28/57/98/1415285798.db2.gz VTWOGZJGXKVXGQ-ZCNNSNEGSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1)N1CCOCC1 ZINC000125828173 1415292041 /nfs/dbraw/zinc/29/20/41/1415292041.db2.gz MNOUJGGDJIPXAH-QFUCXCTJSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000125828173 1415292043 /nfs/dbraw/zinc/29/20/43/1415292043.db2.gz MNOUJGGDJIPXAH-QFUCXCTJSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000125828173 1415292048 /nfs/dbraw/zinc/29/20/48/1415292048.db2.gz MNOUJGGDJIPXAH-QFUCXCTJSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccccc2OCC(=O)N2CCCC2)C1 ZINC000125894617 1415307393 /nfs/dbraw/zinc/30/73/93/1415307393.db2.gz XDCWKAAAZRCOLQ-WOJBJXKFSA-N 2 1 387.568 3.145 20 0 GGADMP CCC[N@@H+]1CCC[C@H]1C(=O)Nc1ccc(C)c(NC(=O)C[NH+]2CCCCC2)c1 ZINC000125949885 1415320102 /nfs/dbraw/zinc/32/01/02/1415320102.db2.gz HEGWAARKSVDEIA-FQEVSTJZSA-N 2 1 386.540 3.232 20 0 GGADMP CCC[N@H+]1CCC[C@H]1C(=O)Nc1ccc(C)c(NC(=O)C[NH+]2CCCCC2)c1 ZINC000125949885 1415320113 /nfs/dbraw/zinc/32/01/13/1415320113.db2.gz HEGWAARKSVDEIA-FQEVSTJZSA-N 2 1 386.540 3.232 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000126028346 1415339720 /nfs/dbraw/zinc/33/97/20/1415339720.db2.gz CDWBDIFFQZFXHL-INIZCTEOSA-N 2 1 375.904 3.371 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000126028346 1415339727 /nfs/dbraw/zinc/33/97/27/1415339727.db2.gz CDWBDIFFQZFXHL-INIZCTEOSA-N 2 1 375.904 3.371 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C[N@@H+]1C1CC1 ZINC000126175295 1415377301 /nfs/dbraw/zinc/37/73/01/1415377301.db2.gz WWNPZMGHWNJJLO-YLJYHZDGSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C[N@H+]1C1CC1 ZINC000126175295 1415377302 /nfs/dbraw/zinc/37/73/02/1415377302.db2.gz WWNPZMGHWNJJLO-YLJYHZDGSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C[NH+]1C1CC1 ZINC000126175295 1415377309 /nfs/dbraw/zinc/37/73/09/1415377309.db2.gz WWNPZMGHWNJJLO-YLJYHZDGSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C[NH+]1C1CC1 ZINC000126175295 1415377313 /nfs/dbraw/zinc/37/73/13/1415377313.db2.gz WWNPZMGHWNJJLO-YLJYHZDGSA-N 2 1 396.535 3.336 20 0 GGADMP CNS(=O)(=O)c1cccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c1 ZINC000177978644 1428912609 /nfs/dbraw/zinc/91/26/09/1428912609.db2.gz FTZSSTVQGZMEFJ-KRWDZBQOSA-N 2 1 389.565 3.286 20 0 GGADMP O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000126363386 1415427628 /nfs/dbraw/zinc/42/76/28/1415427628.db2.gz YRFRQJWOGFXKHR-OXJNMPFZSA-N 2 1 390.959 3.260 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](c1ccco1)[NH+](C)C)c1ccsc1 ZINC000126386060 1415433612 /nfs/dbraw/zinc/43/36/12/1415433612.db2.gz QFRPVTYQTFOWAX-DLBZAZTESA-N 2 1 378.542 3.326 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NCC3CC[NH+](Cc4ccccc4)CC3)CC[C@@H]21 ZINC000178000511 1428925524 /nfs/dbraw/zinc/92/55/24/1428925524.db2.gz JLWVEVOSNADQIM-YADHBBJMSA-N 2 1 384.568 3.024 20 0 GGADMP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)CCCO2 ZINC000126663246 1415520851 /nfs/dbraw/zinc/52/08/51/1415520851.db2.gz CKANQAZEXMFYQK-YJBOKZPZSA-N 2 1 379.932 3.039 20 0 GGADMP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)CCCO2 ZINC000126663246 1415520858 /nfs/dbraw/zinc/52/08/58/1415520858.db2.gz CKANQAZEXMFYQK-YJBOKZPZSA-N 2 1 379.932 3.039 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc2c(c1)OCCO2 ZINC000126705723 1415531942 /nfs/dbraw/zinc/53/19/42/1415531942.db2.gz XJKSLARIMMJHSQ-GOSISDBHSA-N 2 1 381.520 3.056 20 0 GGADMP COCc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)ccc1OC ZINC000126719663 1415538176 /nfs/dbraw/zinc/53/81/76/1415538176.db2.gz XMWHTYGJCSUCAX-IBGZPJMESA-N 2 1 397.563 3.440 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C)[NH+](C)C ZINC000126750441 1415547645 /nfs/dbraw/zinc/54/76/45/1415547645.db2.gz GDVYSQOZRJDSIS-ICSRJNTNSA-N 2 1 390.572 3.252 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCC[N@H+]1CCCC[C@@H]1C)[NH+](C)C ZINC000126750441 1415547648 /nfs/dbraw/zinc/54/76/48/1415547648.db2.gz GDVYSQOZRJDSIS-ICSRJNTNSA-N 2 1 390.572 3.252 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCC[N@@H+]1CCCC[C@H]1C)[NH+](C)C ZINC000126750195 1415547706 /nfs/dbraw/zinc/54/77/06/1415547706.db2.gz GDVYSQOZRJDSIS-QUCCMNQESA-N 2 1 390.572 3.252 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCC[N@H+]1CCCC[C@H]1C)[NH+](C)C ZINC000126750195 1415547712 /nfs/dbraw/zinc/54/77/12/1415547712.db2.gz GDVYSQOZRJDSIS-QUCCMNQESA-N 2 1 390.572 3.252 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c2cccs2)CC1 ZINC000126775849 1415555448 /nfs/dbraw/zinc/55/54/48/1415555448.db2.gz QSHGJCBEVXYOGH-MJGOQNOKSA-N 2 1 390.597 3.305 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]C2CCN(CCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000178036884 1428949575 /nfs/dbraw/zinc/94/95/75/1428949575.db2.gz QSWMBUKASPVDLH-BGYRXZFFSA-N 2 1 391.575 3.312 20 0 GGADMP C[C@@H]1C[N@@H+](CCCC[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000178036884 1428949581 /nfs/dbraw/zinc/94/95/81/1428949581.db2.gz QSWMBUKASPVDLH-BGYRXZFFSA-N 3 1 391.575 3.312 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000178036884 1428949582 /nfs/dbraw/zinc/94/95/82/1428949582.db2.gz QSWMBUKASPVDLH-BGYRXZFFSA-N 3 1 391.575 3.312 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(CNC(=O)Nc3cccc(C[NH+](C)C)c3)c2)CCO1 ZINC000127261249 1415707744 /nfs/dbraw/zinc/70/77/44/1415707744.db2.gz VFLLZYOKGWLFRK-SFHVURJKSA-N 2 1 396.535 3.291 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(CNC(=O)Nc3cccc(C[NH+](C)C)c3)c2)CCO1 ZINC000127261249 1415707756 /nfs/dbraw/zinc/70/77/56/1415707756.db2.gz VFLLZYOKGWLFRK-SFHVURJKSA-N 2 1 396.535 3.291 20 0 GGADMP CCN1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)CC1 ZINC000127295340 1415723760 /nfs/dbraw/zinc/72/37/60/1415723760.db2.gz JAACZZAIXBEHBS-MSOLQXFVSA-N 2 1 376.564 3.349 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C[N@@H+](C)Cc1ccc(OC(F)F)cc1)c1ccccc1 ZINC000178113061 1428987588 /nfs/dbraw/zinc/98/75/88/1428987588.db2.gz CFBJRTWUOZHBIA-IBGZPJMESA-N 2 1 391.462 3.139 20 0 GGADMP CCO[C@@H]1C[C@H]([N@@H+](C)CC(=O)NC2CC[NH+](C(C)C)CC2)C12CCCCC2 ZINC000127377331 1415758679 /nfs/dbraw/zinc/75/86/79/1415758679.db2.gz SHHDCWKZOZBBAO-VQTJNVASSA-N 2 1 379.589 3.035 20 0 GGADMP CCO[C@H]1C[C@H]([N@@H+](C)CC(=O)NC2CC[NH+](C(C)C)CC2)C12CCCCC2 ZINC000127377523 1415758792 /nfs/dbraw/zinc/75/87/92/1415758792.db2.gz SHHDCWKZOZBBAO-PMACEKPBSA-N 2 1 379.589 3.035 20 0 GGADMP CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1 ZINC000127413373 1415770782 /nfs/dbraw/zinc/77/07/82/1415770782.db2.gz OYZJLYALJKUNLP-IBGZPJMESA-N 2 1 388.556 3.357 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)C1 ZINC000127438426 1415778576 /nfs/dbraw/zinc/77/85/76/1415778576.db2.gz NDZNIYAGKZWKQP-IBGZPJMESA-N 2 1 388.556 3.357 20 0 GGADMP Cc1[nH+]ccn1CCC[NH+]1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000127441157 1415779768 /nfs/dbraw/zinc/77/97/68/1415779768.db2.gz ITCYUOVZIXKHPY-UHFFFAOYSA-N 2 1 380.536 3.485 20 0 GGADMP C[N@H+]1CCCN(c2ccc(NC(=O)[C@@H]3CC[NH+](C4CCCCC4)C3)cc2)CC1 ZINC000178133048 1428993782 /nfs/dbraw/zinc/99/37/82/1428993782.db2.gz FBMNFEZSMKMBIX-LJQANCHMSA-N 2 1 384.568 3.422 20 0 GGADMP C[NH+]1CCCN(c2ccc(NC(=O)[C@@H]3CC[N@@H+](C4CCCCC4)C3)cc2)CC1 ZINC000178133048 1428993785 /nfs/dbraw/zinc/99/37/85/1428993785.db2.gz FBMNFEZSMKMBIX-LJQANCHMSA-N 2 1 384.568 3.422 20 0 GGADMP C[NH+]1CCCN(c2ccc(NC(=O)[C@@H]3CC[N@H+](C4CCCCC4)C3)cc2)CC1 ZINC000178133048 1428993787 /nfs/dbraw/zinc/99/37/87/1428993787.db2.gz FBMNFEZSMKMBIX-LJQANCHMSA-N 2 1 384.568 3.422 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc(C[NH+](C)C)c(F)c1 ZINC000127463048 1415787960 /nfs/dbraw/zinc/78/79/60/1415787960.db2.gz RFEQHZBHRHOHEJ-VGSWGCGISA-N 2 1 398.526 3.207 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(CC[NH+](C)C)CC(C)C)cc1F ZINC000127650194 1415825725 /nfs/dbraw/zinc/82/57/25/1415825725.db2.gz UBLXLCNLOZVADG-UHFFFAOYSA-N 2 1 375.492 3.049 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C[N@H+]1C1CC1 ZINC000127651193 1415826311 /nfs/dbraw/zinc/82/63/11/1415826311.db2.gz ITYVRFJVFHCNJT-DNVCBOLYSA-N 2 1 390.959 3.229 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C[N@H+]1C1CC1 ZINC000127650705 1415826367 /nfs/dbraw/zinc/82/63/67/1415826367.db2.gz ITYVRFJVFHCNJT-BEFAXECRSA-N 2 1 390.959 3.229 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CC[NH+](C2CCCCC2)C1 ZINC000178203481 1429017739 /nfs/dbraw/zinc/01/77/39/1429017739.db2.gz LHCJAISWTGHNKE-FCHUYYIVSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000178203481 1429017745 /nfs/dbraw/zinc/01/77/45/1429017745.db2.gz LHCJAISWTGHNKE-FCHUYYIVSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000178203481 1429017755 /nfs/dbraw/zinc/01/77/55/1429017755.db2.gz LHCJAISWTGHNKE-FCHUYYIVSA-N 2 1 383.580 3.322 20 0 GGADMP Cc1ccc(NCCCNC(=O)c2ccc(C[NH+]3CCSCC3)cc2)[nH+]c1 ZINC000127798499 1415852965 /nfs/dbraw/zinc/85/29/65/1415852965.db2.gz YPWQNSNYXPZQAM-UHFFFAOYSA-N 2 1 384.549 3.171 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000127862354 1415865172 /nfs/dbraw/zinc/86/51/72/1415865172.db2.gz WNKWDMDQQGUSND-PMACEKPBSA-N 2 1 390.572 3.474 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC(C[NH+](C)Cc3ccccc3)CC2)C[N@H+]1C1CC1 ZINC000127968596 1415885340 /nfs/dbraw/zinc/88/53/40/1415885340.db2.gz CDZYEZWESHVYKM-NQIIRXRSSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C[NH+]1C1CC1 ZINC000127968596 1415885341 /nfs/dbraw/zinc/88/53/41/1415885341.db2.gz CDZYEZWESHVYKM-NQIIRXRSSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C[NH+]1C1CC1 ZINC000127968596 1415885342 /nfs/dbraw/zinc/88/53/42/1415885342.db2.gz CDZYEZWESHVYKM-NQIIRXRSSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CCN(C(=O)c3ccc(C[NH+](C)C)cc3)CC2)C[C@H](C)O1 ZINC000178239758 1429028036 /nfs/dbraw/zinc/02/80/36/1429028036.db2.gz YWAODGBJBBZQTR-KDURUIRLSA-N 2 1 387.568 3.100 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(CN3CCCC3=O)cc2)[C@H](C)C1 ZINC000128496675 1416000415 /nfs/dbraw/zinc/00/04/15/1416000415.db2.gz YRUHEEPFDPYRKS-KNQAVFIVSA-N 2 1 387.568 3.036 20 0 GGADMP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000128531726 1416007693 /nfs/dbraw/zinc/00/76/93/1416007693.db2.gz RYGZGECQKKEMRK-HSZRJFAPSA-N 2 1 393.531 3.430 20 0 GGADMP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000128531726 1416007701 /nfs/dbraw/zinc/00/77/01/1416007701.db2.gz RYGZGECQKKEMRK-HSZRJFAPSA-N 2 1 393.531 3.430 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCc2ccccc2-n2ccnc2)C[N@H+]1Cc1ccccc1 ZINC000128900503 1416096419 /nfs/dbraw/zinc/09/64/19/1416096419.db2.gz IFKBJJZSSSUYSF-RXVVDRJESA-N 2 1 389.503 3.335 20 0 GGADMP C[C@@H](NC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1)C(C)(C)C[NH+](C)C ZINC000129079556 1416140141 /nfs/dbraw/zinc/14/01/41/1416140141.db2.gz WKZOTWDQEZKHOA-IAGOWNOFSA-N 2 1 376.545 3.178 20 0 GGADMP Cc1c(C(=O)N2c3ccc(C)cc3[C@@H]3C[N@H+](C)CC[C@@H]32)cnn1-c1cc[nH+]cc1 ZINC000129128355 1416152628 /nfs/dbraw/zinc/15/26/28/1416152628.db2.gz CZLCQXJOBLXRCF-UNMCSNQZSA-N 2 1 387.487 3.332 20 0 GGADMP Cc1c(C(=O)N2c3ccc(C)cc3[C@@H]3C[N@@H+](C)CC[C@@H]32)cnn1-c1cc[nH+]cc1 ZINC000129128355 1416152631 /nfs/dbraw/zinc/15/26/31/1416152631.db2.gz CZLCQXJOBLXRCF-UNMCSNQZSA-N 2 1 387.487 3.332 20 0 GGADMP Cc1c(C(=O)Nc2cccc(C[NH+]3CCSCC3)c2)cnn1-c1cc[nH+]cc1 ZINC000129372016 1416198572 /nfs/dbraw/zinc/19/85/72/1416198572.db2.gz KTYWJLVCFNDGEX-UHFFFAOYSA-N 2 1 393.516 3.377 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)N3CC[C@H](C[NH+](C)C)C3)cc2)C1 ZINC000129492341 1416218394 /nfs/dbraw/zinc/21/83/94/1416218394.db2.gz BGUJXJCRUNCNLS-XQBPLPMBSA-N 2 1 386.584 3.258 20 0 GGADMP C[C@H]1CC[N@@H+](C/C=C/C[NH+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129595057 1416234332 /nfs/dbraw/zinc/23/43/32/1416234332.db2.gz QRTZKENKHXEOIW-FCOCTOGTSA-N 2 1 382.556 3.102 20 0 GGADMP C[C@H]1CC[NH+](C/C=C/C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129595057 1416234335 /nfs/dbraw/zinc/23/43/35/1416234335.db2.gz QRTZKENKHXEOIW-FCOCTOGTSA-N 2 1 382.556 3.102 20 0 GGADMP C[C@H]1CC[NH+](C/C=C/C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129595057 1416234338 /nfs/dbraw/zinc/23/43/38/1416234338.db2.gz QRTZKENKHXEOIW-FCOCTOGTSA-N 2 1 382.556 3.102 20 0 GGADMP C[C@@H]1CC[NH+](CCCC[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129658725 1416244564 /nfs/dbraw/zinc/24/45/64/1416244564.db2.gz WSEOMDFXEQCRAB-ZDNVTZCJSA-N 2 1 384.572 3.326 20 0 GGADMP C[C@@H]1CC[N@@H+](CCCC[NH+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129658725 1416244566 /nfs/dbraw/zinc/24/45/66/1416244566.db2.gz WSEOMDFXEQCRAB-ZDNVTZCJSA-N 2 1 384.572 3.326 20 0 GGADMP C[C@@H]1CC[N@H+](CCCC[NH+]2CC[C@H](C)[C@H](n3ccnc3)C2)C[C@@H]1n1ccnc1 ZINC000129658725 1416244570 /nfs/dbraw/zinc/24/45/70/1416244570.db2.gz WSEOMDFXEQCRAB-ZDNVTZCJSA-N 2 1 384.572 3.326 20 0 GGADMP Cc1c(C(=O)N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cnn1-c1cc[nH+]cc1 ZINC000129705232 1416251627 /nfs/dbraw/zinc/25/16/27/1416251627.db2.gz NOHQQWDFPNZHDT-LJQANCHMSA-N 2 1 381.524 3.160 20 0 GGADMP CC(C)CC[NH+]1CCC(CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000129983900 1416296201 /nfs/dbraw/zinc/29/62/01/1416296201.db2.gz ZDAIMFBMVKQLCS-IRLDBZIGSA-N 2 1 390.616 3.403 20 0 GGADMP O=C1C[C@H]([NH+]2CCC(CCC[NH+]3CCCC3)CC2)C(=O)N1c1ccc(F)cc1 ZINC000130059716 1416310376 /nfs/dbraw/zinc/31/03/76/1416310376.db2.gz JGULNDGISQLAAY-FQEVSTJZSA-N 2 1 387.499 3.046 20 0 GGADMP C[N@@H+](C[C@@H](O)COc1ccccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000130099090 1416317482 /nfs/dbraw/zinc/31/74/82/1416317482.db2.gz XONNUXUJEQHRRQ-LJQANCHMSA-N 2 1 389.927 3.323 20 0 GGADMP COc1ccccc1N1CC[C@H]([N@@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)C1=O ZINC000130099979 1416317965 /nfs/dbraw/zinc/31/79/65/1416317965.db2.gz DROCLDOUUCMDOY-NRFANRHFSA-N 2 1 394.519 3.044 20 0 GGADMP COc1ccccc1N1CC[C@@H]([N@@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)C1=O ZINC000130099773 1416318174 /nfs/dbraw/zinc/31/81/74/1416318174.db2.gz DROCLDOUUCMDOY-OAQYLSRUSA-N 2 1 394.519 3.044 20 0 GGADMP C[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000130132169 1416324126 /nfs/dbraw/zinc/32/41/26/1416324126.db2.gz NIWCNIJKSBFZFB-GOSISDBHSA-N 2 1 384.524 3.005 20 0 GGADMP C[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000130132169 1416324135 /nfs/dbraw/zinc/32/41/35/1416324135.db2.gz NIWCNIJKSBFZFB-GOSISDBHSA-N 2 1 384.524 3.005 20 0 GGADMP Cc1cc(C[NH+](C)C)cc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC(O)CC2)c1 ZINC000130281045 1416351111 /nfs/dbraw/zinc/35/11/11/1416351111.db2.gz SSOGXKGNGVRAPK-JOCHJYFZSA-N 2 1 381.520 3.193 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C[N@H+]1C1CC1 ZINC000130316701 1416356821 /nfs/dbraw/zinc/35/68/21/1416356821.db2.gz FOWOZUOFPRTRGV-MAUKXSAKSA-N 2 1 378.948 3.038 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O ZINC000130452059 1416380427 /nfs/dbraw/zinc/38/04/27/1416380427.db2.gz LAWPUJBIFOYUKX-QGZVFWFLSA-N 2 1 396.413 3.218 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O ZINC000130452059 1416380430 /nfs/dbraw/zinc/38/04/30/1416380430.db2.gz LAWPUJBIFOYUKX-QGZVFWFLSA-N 2 1 396.413 3.218 20 0 GGADMP CC[NH+]1CCN(CCC(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)CC1 ZINC000130545461 1416396786 /nfs/dbraw/zinc/39/67/86/1416396786.db2.gz DNKMCBQGNMLNGV-UHFFFAOYSA-N 2 1 386.584 3.417 20 0 GGADMP CCN1CC[NH+](CCC(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000130545461 1416396791 /nfs/dbraw/zinc/39/67/91/1416396791.db2.gz DNKMCBQGNMLNGV-UHFFFAOYSA-N 2 1 386.584 3.417 20 0 GGADMP CCN1CC[NH+](CCC(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)CC1 ZINC000130545461 1416396798 /nfs/dbraw/zinc/39/67/98/1416396798.db2.gz DNKMCBQGNMLNGV-UHFFFAOYSA-N 2 1 386.584 3.417 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)C1 ZINC000130651263 1416417350 /nfs/dbraw/zinc/41/73/50/1416417350.db2.gz AGJFEUWKMFHRJA-FQEVSTJZSA-N 2 1 392.563 3.267 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000130707662 1416430638 /nfs/dbraw/zinc/43/06/38/1416430638.db2.gz KZDSHYSKZLCUEK-QNGMFEMESA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC000130734020 1416437755 /nfs/dbraw/zinc/43/77/55/1416437755.db2.gz SPZQQQZUYPJBIN-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC000130734020 1416437759 /nfs/dbraw/zinc/43/77/59/1416437759.db2.gz SPZQQQZUYPJBIN-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC000130734020 1416437765 /nfs/dbraw/zinc/43/77/65/1416437765.db2.gz SPZQQQZUYPJBIN-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H](Cc2ccccc2)[NH+](C)C)c1 ZINC000130742428 1416440355 /nfs/dbraw/zinc/44/03/55/1416440355.db2.gz XFHIBRYBAGCQCZ-QFIPXVFZSA-N 2 1 382.552 3.110 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2ccccc2F)C1 ZINC000130790870 1416452474 /nfs/dbraw/zinc/45/24/74/1416452474.db2.gz IGPMNGLSIHECMJ-IBGZPJMESA-N 2 1 392.563 3.267 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]CC2CCN(C(=O)OC(C)(C)C)CC2)cn1 ZINC000130869080 1416472043 /nfs/dbraw/zinc/47/20/43/1416472043.db2.gz HDHHTUPTKRYHGH-UHFFFAOYSA-N 2 1 385.512 3.312 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC000130884239 1416475155 /nfs/dbraw/zinc/47/51/55/1416475155.db2.gz SDGXFKVUKHZFLV-QHCPKHFHSA-N 2 1 395.547 3.046 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC000130884239 1416475159 /nfs/dbraw/zinc/47/51/59/1416475159.db2.gz SDGXFKVUKHZFLV-QHCPKHFHSA-N 2 1 395.547 3.046 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)C1 ZINC000131094051 1416507564 /nfs/dbraw/zinc/50/75/64/1416507564.db2.gz YNZKVEHQNPAWNL-RTBURBONSA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)C1 ZINC000131094051 1416507567 /nfs/dbraw/zinc/50/75/67/1416507567.db2.gz YNZKVEHQNPAWNL-RTBURBONSA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)C1 ZINC000131094233 1416507733 /nfs/dbraw/zinc/50/77/33/1416507733.db2.gz YNZKVEHQNPAWNL-MOPGFXCFSA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)C1 ZINC000131094233 1416507736 /nfs/dbraw/zinc/50/77/36/1416507736.db2.gz YNZKVEHQNPAWNL-MOPGFXCFSA-N 2 1 375.561 3.160 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NC[C@@H](c2ccco2)[NH+](C)C)[NH+]2CCCC2)cc1 ZINC000131119169 1416511913 /nfs/dbraw/zinc/51/19/13/1416511913.db2.gz XTALBLUHIQFJEE-UXHICEINSA-N 2 1 384.524 3.327 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000131129464 1416513117 /nfs/dbraw/zinc/51/31/17/1416513117.db2.gz YDNLZFDMTQXSIC-NRFANRHFSA-N 2 1 384.568 3.346 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)[C@H](C)[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c(C)c1 ZINC000131270477 1416533041 /nfs/dbraw/zinc/53/30/41/1416533041.db2.gz HHWYICDKZXLJHV-ZWKOTPCHSA-N 2 1 397.523 3.028 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)[C@H](C)[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c(C)c1 ZINC000131270477 1416533045 /nfs/dbraw/zinc/53/30/45/1416533045.db2.gz HHWYICDKZXLJHV-ZWKOTPCHSA-N 2 1 397.523 3.028 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000131397363 1416550860 /nfs/dbraw/zinc/55/08/60/1416550860.db2.gz KAKZQABBFSUOJY-RTWAWAEBSA-N 2 1 387.593 3.253 20 0 GGADMP CC[C@@H]1c2ccsc2CCN1C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131399813 1416551264 /nfs/dbraw/zinc/55/12/64/1416551264.db2.gz ULOXINRZNPTJOD-SJLPKXTDSA-N 2 1 386.565 3.272 20 0 GGADMP CC[C@@H]1c2ccsc2CCN1C(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131399813 1416551270 /nfs/dbraw/zinc/55/12/70/1416551270.db2.gz ULOXINRZNPTJOD-SJLPKXTDSA-N 2 1 386.565 3.272 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N(CC[NH+](C)C)Cc1ccco1 ZINC000131470125 1416562630 /nfs/dbraw/zinc/56/26/30/1416562630.db2.gz PKTQWACTVLZQTR-KNQAVFIVSA-N 2 1 398.551 3.263 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N(CC[NH+](C)C)Cc1ccco1 ZINC000131470371 1416562788 /nfs/dbraw/zinc/56/27/88/1416562788.db2.gz PKTQWACTVLZQTR-UGKGYDQZSA-N 2 1 398.551 3.263 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000131583943 1416580001 /nfs/dbraw/zinc/58/00/01/1416580001.db2.gz NSYWGBKVLWCVNV-WOJBJXKFSA-N 2 1 376.932 3.287 20 0 GGADMP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000131586579 1416580475 /nfs/dbraw/zinc/58/04/75/1416580475.db2.gz JHXVAJHHSDOXQT-HSZRJFAPSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000131586579 1416580478 /nfs/dbraw/zinc/58/04/78/1416580478.db2.gz JHXVAJHHSDOXQT-HSZRJFAPSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000131586579 1416580483 /nfs/dbraw/zinc/58/04/83/1416580483.db2.gz JHXVAJHHSDOXQT-HSZRJFAPSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000131586579 1416580485 /nfs/dbraw/zinc/58/04/85/1416580485.db2.gz JHXVAJHHSDOXQT-HSZRJFAPSA-N 2 1 395.547 3.044 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+][C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2)CCO1 ZINC000131785999 1416619696 /nfs/dbraw/zinc/61/96/96/1416619696.db2.gz LKZHTWPUPMKKDJ-YLJYHZDGSA-N 2 1 389.540 3.006 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2)CCO1 ZINC000131785999 1416619704 /nfs/dbraw/zinc/61/97/04/1416619704.db2.gz LKZHTWPUPMKKDJ-YLJYHZDGSA-N 2 1 389.540 3.006 20 0 GGADMP CNS(=O)(=O)Cc1ccc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000131903302 1416646747 /nfs/dbraw/zinc/64/67/47/1416646747.db2.gz YZOQZHKUKNTYJF-MRXNPFEDSA-N 2 1 398.532 3.081 20 0 GGADMP C[C@H](C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1)[NH+]1CCSCC1 ZINC000131937648 1416655827 /nfs/dbraw/zinc/65/58/27/1416655827.db2.gz OEXLIWCPPMCUNI-MRXNPFEDSA-N 2 1 396.000 3.106 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2cn(-c3ccccc3)nc2C(C)(C)C)CC1 ZINC000132152777 1416708567 /nfs/dbraw/zinc/70/85/67/1416708567.db2.gz MEFZIQUBDAHTHT-UHFFFAOYSA-N 2 1 383.584 3.287 20 0 GGADMP CC(C)c1ncc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)s1 ZINC000132277949 1416728275 /nfs/dbraw/zinc/72/82/75/1416728275.db2.gz HDOZPVWSNMAOCG-GOSISDBHSA-N 2 1 386.565 3.254 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)[C@@H](c2ccccc2)[NH+]2CCSCC2)CC1 ZINC000132335366 1416739102 /nfs/dbraw/zinc/73/91/02/1416739102.db2.gz DSGOBPLQROKSOT-OAQYLSRUSA-N 2 1 389.609 3.357 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccc(NS(C)(=O)=O)c1 ZINC000132356617 1416744366 /nfs/dbraw/zinc/74/43/66/1416744366.db2.gz SQBAAZYYBKGRHB-KRWDZBQOSA-N 2 1 387.549 3.373 20 0 GGADMP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000178667121 1429133482 /nfs/dbraw/zinc/13/34/82/1429133482.db2.gz NLARYDIPOOWCPC-LJQANCHMSA-N 2 1 381.520 3.080 20 0 GGADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CCC(=O)N1CC[NH+](C)CC1 ZINC000178668654 1429133584 /nfs/dbraw/zinc/13/35/84/1429133584.db2.gz KGJRRXNPMRQQFR-CQSZACIVSA-N 2 1 390.528 3.072 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[NH+]1CCSCC1 ZINC000133112803 1416853312 /nfs/dbraw/zinc/85/33/12/1416853312.db2.gz KZDLQQJVUJJFIB-ZWKOTPCHSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)[NH+]1CCSCC1 ZINC000133112803 1416853313 /nfs/dbraw/zinc/85/33/13/1416853313.db2.gz KZDLQQJVUJJFIB-ZWKOTPCHSA-N 2 1 375.582 3.115 20 0 GGADMP O=C(c1ccoc1)N1CCC([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000133278404 1416873448 /nfs/dbraw/zinc/87/34/48/1416873448.db2.gz WFFPOPLBLNFWBV-UHFFFAOYSA-N 2 1 399.510 3.320 20 0 GGADMP CC(C)[N@H+](C)Cc1cccc(CNC(=O)[C@H]2C[NH+](Cc3ccccc3)CCO2)c1 ZINC000133313073 1416877789 /nfs/dbraw/zinc/87/77/89/1416877789.db2.gz CAYLQQOPNPTOLD-HSZRJFAPSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(CNC(=O)[C@H]2C[NH+](Cc3ccccc3)CCO2)c1 ZINC000133313073 1416877793 /nfs/dbraw/zinc/87/77/93/1416877793.db2.gz CAYLQQOPNPTOLD-HSZRJFAPSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[NH+](C)Cc1cccc(CNC(=O)[C@H]2C[N@H+](Cc3ccccc3)CCO2)c1 ZINC000133313073 1416877794 /nfs/dbraw/zinc/87/77/94/1416877794.db2.gz CAYLQQOPNPTOLD-HSZRJFAPSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[NH+](C)Cc1cccc(CNC(=O)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c1 ZINC000133313073 1416877797 /nfs/dbraw/zinc/87/77/97/1416877797.db2.gz CAYLQQOPNPTOLD-HSZRJFAPSA-N 2 1 395.547 3.044 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1 ZINC000178698385 1429144651 /nfs/dbraw/zinc/14/46/51/1429144651.db2.gz GJCVEPHZTLWAMG-SJORKVTESA-N 2 1 392.569 3.209 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1 ZINC000178698401 1429144868 /nfs/dbraw/zinc/14/48/68/1429144868.db2.gz GJCVEPHZTLWAMG-DLBZAZTESA-N 2 1 392.569 3.209 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)N2CCC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000133734968 1416953631 /nfs/dbraw/zinc/95/36/31/1416953631.db2.gz GEUANPQUXQMSSR-HXUWFJFHSA-N 2 1 390.547 3.021 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000133734968 1416953635 /nfs/dbraw/zinc/95/36/35/1416953635.db2.gz GEUANPQUXQMSSR-HXUWFJFHSA-N 2 1 390.547 3.021 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)C1 ZINC000133734968 1416953641 /nfs/dbraw/zinc/95/36/41/1416953641.db2.gz GEUANPQUXQMSSR-HXUWFJFHSA-N 2 1 390.547 3.021 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)C1 ZINC000133734968 1416953650 /nfs/dbraw/zinc/95/36/50/1416953650.db2.gz GEUANPQUXQMSSR-HXUWFJFHSA-N 2 1 390.547 3.021 20 0 GGADMP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)C1 ZINC000133845881 1416976485 /nfs/dbraw/zinc/97/64/85/1416976485.db2.gz VWEVNNQDXIWBOM-PXNSSMCTSA-N 2 1 393.597 3.070 20 0 GGADMP CCOc1c(Cl)cc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cc1OC ZINC000134076791 1417018592 /nfs/dbraw/zinc/01/85/92/1417018592.db2.gz DKNYBQWECNXKDW-UHFFFAOYSA-N 2 1 382.932 3.292 20 0 GGADMP C[C@@H](COc1ccc(C(C)(C)C)cc1)[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000134220689 1417039827 /nfs/dbraw/zinc/03/98/27/1417039827.db2.gz SHXGUTFWJXHSLL-SFHVURJKSA-N 2 1 397.567 3.083 20 0 GGADMP C[N@@H+]1CC[C@H](NC(=O)N[C@@H]2CC[NH+](C3CCCC3)C2)[C@@H]1c1ccc(Cl)cc1 ZINC000134259948 1417045609 /nfs/dbraw/zinc/04/56/09/1417045609.db2.gz DITYMXSGVPLNCV-HOJAQTOUSA-N 2 1 390.959 3.401 20 0 GGADMP C[N@H+]1CC[C@H](NC(=O)N[C@@H]2CC[NH+](C3CCCC3)C2)[C@@H]1c1ccc(Cl)cc1 ZINC000134259948 1417045613 /nfs/dbraw/zinc/04/56/13/1417045613.db2.gz DITYMXSGVPLNCV-HOJAQTOUSA-N 2 1 390.959 3.401 20 0 GGADMP C[NH+]1CC[C@H](NC(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)[C@@H]1c1ccc(Cl)cc1 ZINC000134259948 1417045615 /nfs/dbraw/zinc/04/56/15/1417045615.db2.gz DITYMXSGVPLNCV-HOJAQTOUSA-N 2 1 390.959 3.401 20 0 GGADMP C[NH+]1CC[C@H](NC(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)[C@@H]1c1ccc(Cl)cc1 ZINC000134259948 1417045621 /nfs/dbraw/zinc/04/56/21/1417045621.db2.gz DITYMXSGVPLNCV-HOJAQTOUSA-N 2 1 390.959 3.401 20 0 GGADMP C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000134264793 1417046240 /nfs/dbraw/zinc/04/62/40/1417046240.db2.gz SDYIETCXEKNIKI-AWEZNQCLSA-N 2 1 394.350 3.256 20 0 GGADMP COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000134383863 1417063169 /nfs/dbraw/zinc/06/31/69/1417063169.db2.gz XVWBYWDXRWKMST-HXUWFJFHSA-N 2 1 383.540 3.114 20 0 GGADMP CS[C@H]1CCCC[N@@H+](CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)C1 ZINC000134608614 1417096111 /nfs/dbraw/zinc/09/61/11/1417096111.db2.gz YVMKIKQGYQDMGX-IBGZPJMESA-N 2 1 393.622 3.391 20 0 GGADMP Cn1ccnc1COc1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000134867620 1417136515 /nfs/dbraw/zinc/13/65/15/1417136515.db2.gz PPZBNFRBEUYFCP-KNQAVFIVSA-N 2 1 380.536 3.448 20 0 GGADMP Cn1ccnc1COc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000134867620 1417136516 /nfs/dbraw/zinc/13/65/16/1417136516.db2.gz PPZBNFRBEUYFCP-KNQAVFIVSA-N 2 1 380.536 3.448 20 0 GGADMP Cn1ccnc1COc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000134867620 1417136519 /nfs/dbraw/zinc/13/65/19/1417136519.db2.gz PPZBNFRBEUYFCP-KNQAVFIVSA-N 2 1 380.536 3.448 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134883613 1417139594 /nfs/dbraw/zinc/13/95/94/1417139594.db2.gz HFLMDVDHIBWNOJ-DYESRHJHSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134883613 1417139600 /nfs/dbraw/zinc/13/96/00/1417139600.db2.gz HFLMDVDHIBWNOJ-DYESRHJHSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134883613 1417139606 /nfs/dbraw/zinc/13/96/06/1417139606.db2.gz HFLMDVDHIBWNOJ-DYESRHJHSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134883613 1417139610 /nfs/dbraw/zinc/13/96/10/1417139610.db2.gz HFLMDVDHIBWNOJ-DYESRHJHSA-N 2 1 381.520 3.012 20 0 GGADMP O=C(CC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)NCc1ccccc1Cl ZINC000134888598 1417140208 /nfs/dbraw/zinc/14/02/08/1417140208.db2.gz SKHDHAXHVGGHHP-XLIONFOSSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)NCc1ccccc1Cl ZINC000134888598 1417140212 /nfs/dbraw/zinc/14/02/12/1417140212.db2.gz SKHDHAXHVGGHHP-XLIONFOSSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)NCc1ccccc1Cl ZINC000134888598 1417140216 /nfs/dbraw/zinc/14/02/16/1417140216.db2.gz SKHDHAXHVGGHHP-XLIONFOSSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)NCc1ccccc1Cl ZINC000134888598 1417140220 /nfs/dbraw/zinc/14/02/20/1417140220.db2.gz SKHDHAXHVGGHHP-XLIONFOSSA-N 2 1 375.944 3.295 20 0 GGADMP C[C@@H](C(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000134928232 1417146461 /nfs/dbraw/zinc/14/64/61/1417146461.db2.gz QKKCXYNOUBJELO-SFHVURJKSA-N 2 1 381.520 3.149 20 0 GGADMP C[C@@H](C(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)[N@H+]1CCc2ccccc2C1 ZINC000134928232 1417146463 /nfs/dbraw/zinc/14/64/63/1417146463.db2.gz QKKCXYNOUBJELO-SFHVURJKSA-N 2 1 381.520 3.149 20 0 GGADMP C[C@H](C(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000134928251 1417146545 /nfs/dbraw/zinc/14/65/45/1417146545.db2.gz QKKCXYNOUBJELO-GOSISDBHSA-N 2 1 381.520 3.149 20 0 GGADMP C[C@H](C(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)[N@H+]1CCc2ccccc2C1 ZINC000134928251 1417146549 /nfs/dbraw/zinc/14/65/49/1417146549.db2.gz QKKCXYNOUBJELO-GOSISDBHSA-N 2 1 381.520 3.149 20 0 GGADMP c1ccc(-c2nnn(CCCCC[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)n2)cc1 ZINC000134946408 1417150232 /nfs/dbraw/zinc/15/02/32/1417150232.db2.gz DGAGIQABMHPXAM-IRLDBZIGSA-N 2 1 394.567 3.459 20 0 GGADMP c1ccc(-c2nnn(CCCCC[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)n2)cc1 ZINC000134946408 1417150238 /nfs/dbraw/zinc/15/02/38/1417150238.db2.gz DGAGIQABMHPXAM-IRLDBZIGSA-N 2 1 394.567 3.459 20 0 GGADMP c1ccc(-c2nnn(CCCCC[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)n2)cc1 ZINC000134946408 1417150247 /nfs/dbraw/zinc/15/02/47/1417150247.db2.gz DGAGIQABMHPXAM-IRLDBZIGSA-N 2 1 394.567 3.459 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)NCc1ccc(C[NH+](C)C)c(F)c1 ZINC000135139378 1417176986 /nfs/dbraw/zinc/17/69/86/1417176986.db2.gz LHENERPRMMBRRI-KRWDZBQOSA-N 2 1 378.536 3.341 20 0 GGADMP C[N@@H+](CC(=O)NC[C@@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1)[C@@H]1CCSC1 ZINC000135211134 1417188906 /nfs/dbraw/zinc/18/89/06/1417188906.db2.gz JFIDDYWUWUZFEU-KHYOSLBOSA-N 2 1 399.963 3.025 20 0 GGADMP C[NH+](CC(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1)[C@@H]1CCSC1 ZINC000135211134 1417188916 /nfs/dbraw/zinc/18/89/16/1417188916.db2.gz JFIDDYWUWUZFEU-KHYOSLBOSA-N 2 1 399.963 3.025 20 0 GGADMP C[NH+](CC(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1)[C@@H]1CCSC1 ZINC000135211134 1417188918 /nfs/dbraw/zinc/18/89/18/1417188918.db2.gz JFIDDYWUWUZFEU-KHYOSLBOSA-N 2 1 399.963 3.025 20 0 GGADMP CC(C)[N@@H+](C)CCNC(=O)NC[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135343704 1417209780 /nfs/dbraw/zinc/20/97/80/1417209780.db2.gz DHKTZMMJHJRFQW-CRAIPNDOSA-N 2 1 384.927 3.111 20 0 GGADMP CC(C)[NH+](C)CCNC(=O)NC[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135343704 1417209787 /nfs/dbraw/zinc/20/97/87/1417209787.db2.gz DHKTZMMJHJRFQW-CRAIPNDOSA-N 2 1 384.927 3.111 20 0 GGADMP CC(C)[NH+](C)CCNC(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135343704 1417209792 /nfs/dbraw/zinc/20/97/92/1417209792.db2.gz DHKTZMMJHJRFQW-CRAIPNDOSA-N 2 1 384.927 3.111 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000136017017 1417286305 /nfs/dbraw/zinc/28/63/05/1417286305.db2.gz SWOKNTZEQWJMJW-QIDMFYOTSA-N 2 1 397.567 3.428 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000136017017 1417286308 /nfs/dbraw/zinc/28/63/08/1417286308.db2.gz SWOKNTZEQWJMJW-QIDMFYOTSA-N 2 1 397.567 3.428 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cc(F)c(F)cc3F)c2)C1 ZINC000136090009 1417291652 /nfs/dbraw/zinc/29/16/52/1417291652.db2.gz ZEKBUJHOGNOYSK-MRXNPFEDSA-N 2 1 391.437 3.091 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(F)c(F)cc3F)c2)C1 ZINC000136090009 1417291656 /nfs/dbraw/zinc/29/16/56/1417291656.db2.gz ZEKBUJHOGNOYSK-MRXNPFEDSA-N 2 1 391.437 3.091 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C1 ZINC000136169518 1417297946 /nfs/dbraw/zinc/29/79/46/1417297946.db2.gz UURLYGANKCLHIX-SFHVURJKSA-N 2 1 378.536 3.055 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(Cl)cc3C)CC2)CC1 ZINC000136190174 1417299038 /nfs/dbraw/zinc/29/90/38/1417299038.db2.gz QPRFVHJNXFNTIZ-UHFFFAOYSA-N 2 1 377.960 3.415 20 0 GGADMP C[NH+](C)CCOc1cc(C[NH2+]Cc2ccc(F)cc2Br)ccn1 ZINC000136221398 1417302372 /nfs/dbraw/zinc/30/23/72/1417302372.db2.gz OWBVNGMFFRRPIW-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP Cc1ccc(C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c(Br)c1 ZINC000136225893 1417302552 /nfs/dbraw/zinc/30/25/52/1417302552.db2.gz YWRWOTHYZNXTBQ-UHFFFAOYSA-N 2 1 378.314 3.383 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cc1F ZINC000136224006 1417302824 /nfs/dbraw/zinc/30/28/24/1417302824.db2.gz TVTWOVXDMJWXRX-UHFFFAOYSA-N 2 1 398.526 3.305 20 0 GGADMP O[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc(F)c(Br)c2)CC1 ZINC000136565258 1417326676 /nfs/dbraw/zinc/32/66/76/1417326676.db2.gz ISIMKFDCEVUCNF-ROUUACIJSA-N 2 1 385.321 3.446 20 0 GGADMP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc(F)c(Br)c2)CC1 ZINC000136565295 1417326921 /nfs/dbraw/zinc/32/69/21/1417326921.db2.gz ISIMKFDCEVUCNF-QZTJIDSGSA-N 2 1 385.321 3.446 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NCc3ccc(C[NH+]4CCCCC4)cc3)CC[C@@H]21 ZINC000136580567 1417328430 /nfs/dbraw/zinc/32/84/30/1417328430.db2.gz BJIDCKCODHBNPU-YADHBBJMSA-N 2 1 384.568 3.298 20 0 GGADMP CCCOc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)ccc1OC ZINC000136582404 1417329113 /nfs/dbraw/zinc/32/91/13/1417329113.db2.gz LMVJMKANHXFBID-VQTJNVASSA-N 2 1 376.541 3.342 20 0 GGADMP CCCOc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1OC ZINC000136580982 1417329140 /nfs/dbraw/zinc/32/91/40/1417329140.db2.gz QNVNJGWABAJQBW-PMACEKPBSA-N 2 1 376.541 3.342 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1 ZINC000136586130 1417329786 /nfs/dbraw/zinc/32/97/86/1417329786.db2.gz ZABNOUXSSAPVFJ-GOTSBHOMSA-N 2 1 382.552 3.347 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)ccc1OC(C)C ZINC000136595754 1417330449 /nfs/dbraw/zinc/33/04/49/1417330449.db2.gz LFHWELPRTJTPQG-VQTJNVASSA-N 2 1 376.541 3.340 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NCc3ccccc3C[N@@H+](C)C(C)C)CC2)c1 ZINC000136749588 1417343303 /nfs/dbraw/zinc/34/33/03/1417343303.db2.gz ZSMRWNABTKZUQY-UHFFFAOYSA-N 2 1 395.551 3.262 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NCc3ccccc3C[N@H+](C)C(C)C)CC2)c1 ZINC000136749588 1417343312 /nfs/dbraw/zinc/34/33/12/1417343312.db2.gz ZSMRWNABTKZUQY-UHFFFAOYSA-N 2 1 395.551 3.262 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NCc3cccc(C[NH+]4CCCC4)c3)CC2)c1 ZINC000136781016 1417345702 /nfs/dbraw/zinc/34/57/02/1417345702.db2.gz REEFYIFOBQUTIN-UHFFFAOYSA-N 2 1 393.535 3.018 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)N2CCC[N@H+](C3CCCC3)CC2)CC1 ZINC000178808615 1429177217 /nfs/dbraw/zinc/17/72/17/1429177217.db2.gz JPLHBMJIIARBMC-IBGZPJMESA-N 2 1 399.583 3.267 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[N@@H+](C)C/C=C/C[NH+](C)[C@H]1CCCc2c1cnn2C ZINC000136824274 1417347665 /nfs/dbraw/zinc/34/76/65/1417347665.db2.gz WGQRGNZXPRNQHK-VGIQHARFSA-N 2 1 382.556 3.028 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[NH+](C)C/C=C/C[N@H+](C)[C@H]1CCCc2c1cnn2C ZINC000136824274 1417347670 /nfs/dbraw/zinc/34/76/70/1417347670.db2.gz WGQRGNZXPRNQHK-VGIQHARFSA-N 2 1 382.556 3.028 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[NH+](C)C/C=C/C[N@@H+](C)[C@H]1CCCc2c1cnn2C ZINC000136824274 1417347676 /nfs/dbraw/zinc/34/76/76/1417347676.db2.gz WGQRGNZXPRNQHK-VGIQHARFSA-N 2 1 382.556 3.028 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)N[C@@H](C[NH+]3CCCC3)c3ccccc3)CC2)c1 ZINC000136837502 1417349283 /nfs/dbraw/zinc/34/92/83/1417349283.db2.gz QXVYPJLYPPEHFH-NRFANRHFSA-N 2 1 393.535 3.059 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)N[C@H](C[NH+]3CCCC3)c3ccccc3)CC2)c1 ZINC000136837544 1417349579 /nfs/dbraw/zinc/34/95/79/1417349579.db2.gz QXVYPJLYPPEHFH-OAQYLSRUSA-N 2 1 393.535 3.059 20 0 GGADMP Cc1cccc(N2CCC([NH2+][C@@H](C)CCCOc3ccccc3C(N)=O)CC2)[nH+]1 ZINC000137467582 1417386991 /nfs/dbraw/zinc/38/69/91/1417386991.db2.gz RJHIKSDUXRSGFK-KRWDZBQOSA-N 2 1 396.535 3.295 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)[NH+]2CCCC2)cc1 ZINC000138026528 1417401553 /nfs/dbraw/zinc/40/15/53/1417401553.db2.gz OHLAZNJFMPDCJW-FSSWDIPSSA-N 2 1 384.568 3.258 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NC[C@@H]3CCC[NH+](Cc4cccs4)C3)CC[C@@H]21 ZINC000138061210 1417404319 /nfs/dbraw/zinc/40/43/19/1417404319.db2.gz MDJNCUSCWVZLBW-NSHGMRRFSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CCC[C@@H]2CN(C(=O)NC[C@@H]3CCC[N@H+](Cc4cccs4)C3)CC[C@@H]21 ZINC000138061210 1417404325 /nfs/dbraw/zinc/40/43/25/1417404325.db2.gz MDJNCUSCWVZLBW-NSHGMRRFSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CCC[C@@H]2CN(C(=O)NC[C@@H]3CCC[N@@H+](Cc4cccs4)C3)CC[C@@H]21 ZINC000138061210 1417404329 /nfs/dbraw/zinc/40/43/29/1417404329.db2.gz MDJNCUSCWVZLBW-NSHGMRRFSA-N 2 1 390.597 3.086 20 0 GGADMP C[C@@H](CCCOc1ccccc1C(N)=O)[NH2+]C[C@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000138178506 1417406718 /nfs/dbraw/zinc/40/67/18/1417406718.db2.gz YUCKROWRBBWCPC-FGSXEWAUSA-N 2 1 375.557 3.433 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C)C3)cc(=O)oc2c1 ZINC000139882090 1417478285 /nfs/dbraw/zinc/47/82/85/1417478285.db2.gz JEVQROLYCJEVSB-BEFAXECRSA-N 2 1 399.491 3.278 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C)C3)cc(=O)oc2c1 ZINC000139882090 1417478289 /nfs/dbraw/zinc/47/82/89/1417478289.db2.gz JEVQROLYCJEVSB-BEFAXECRSA-N 2 1 399.491 3.278 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C)C3)cc(=O)oc2c1 ZINC000139882090 1417478297 /nfs/dbraw/zinc/47/82/97/1417478297.db2.gz JEVQROLYCJEVSB-BEFAXECRSA-N 2 1 399.491 3.278 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C)C3)cc(=O)oc2c1 ZINC000139882090 1417478299 /nfs/dbraw/zinc/47/82/99/1417478299.db2.gz JEVQROLYCJEVSB-BEFAXECRSA-N 2 1 399.491 3.278 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000139912063 1417480046 /nfs/dbraw/zinc/48/00/46/1417480046.db2.gz GTFXXDLCLLLNOC-TZIWHRDSSA-N 2 1 395.551 3.234 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000139912063 1417480048 /nfs/dbraw/zinc/48/00/48/1417480048.db2.gz GTFXXDLCLLLNOC-TZIWHRDSSA-N 2 1 395.551 3.234 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000139912063 1417480053 /nfs/dbraw/zinc/48/00/53/1417480053.db2.gz GTFXXDLCLLLNOC-TZIWHRDSSA-N 2 1 395.551 3.234 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NCC(C)(C)[NH2+][C@H](C)c3ccccc3)CC2)c1 ZINC000140399694 1417501284 /nfs/dbraw/zinc/50/12/84/1417501284.db2.gz FTVHCVUMHHUHCW-LJQANCHMSA-N 2 1 395.551 3.351 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)CC1 ZINC000141137285 1417527691 /nfs/dbraw/zinc/52/76/91/1417527691.db2.gz KJUMTHKMNDOHMU-SYYKKAFVSA-N 2 1 384.568 3.338 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000178847887 1429194360 /nfs/dbraw/zinc/19/43/60/1429194360.db2.gz GFQCHJMQTWWARX-JTHBVZDNSA-N 2 1 396.579 3.441 20 0 GGADMP C[C@@H](CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000142202152 1417576143 /nfs/dbraw/zinc/57/61/43/1417576143.db2.gz OHCGHQWXAHUFIU-ROUUACIJSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H]([NH3+])C1CCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000178850926 1429195611 /nfs/dbraw/zinc/19/56/11/1429195611.db2.gz ALEDAURMKTVLSV-KXBFYZLASA-N 2 1 383.458 3.027 20 0 GGADMP C[N@H+](CC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)Cc1ccccc1 ZINC000146048339 1417708097 /nfs/dbraw/zinc/70/80/97/1417708097.db2.gz HSOCGZJFRRYWCW-UHFFFAOYSA-N 2 1 383.561 3.348 20 0 GGADMP C[N@@H+](CC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)Cc1ccccc1 ZINC000146048339 1417708102 /nfs/dbraw/zinc/70/81/02/1417708102.db2.gz HSOCGZJFRRYWCW-UHFFFAOYSA-N 2 1 383.561 3.348 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCC[C@@H](C)C1 ZINC000148547383 1417765807 /nfs/dbraw/zinc/76/58/07/1417765807.db2.gz FFOOQACZDUZLOI-WCIQWLHISA-N 2 1 387.568 3.146 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCC[C@@H](C)C1 ZINC000148547383 1417765812 /nfs/dbraw/zinc/76/58/12/1417765812.db2.gz FFOOQACZDUZLOI-WCIQWLHISA-N 2 1 387.568 3.146 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000148547383 1417765817 /nfs/dbraw/zinc/76/58/17/1417765817.db2.gz FFOOQACZDUZLOI-WCIQWLHISA-N 2 1 387.568 3.146 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000148547383 1417765820 /nfs/dbraw/zinc/76/58/20/1417765820.db2.gz FFOOQACZDUZLOI-WCIQWLHISA-N 2 1 387.568 3.146 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000150736832 1417795042 /nfs/dbraw/zinc/79/50/42/1417795042.db2.gz KHQKDOJTWLBODI-UNMCSNQZSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000150736832 1417795050 /nfs/dbraw/zinc/79/50/50/1417795050.db2.gz KHQKDOJTWLBODI-UNMCSNQZSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000150736832 1417795064 /nfs/dbraw/zinc/79/50/64/1417795064.db2.gz KHQKDOJTWLBODI-UNMCSNQZSA-N 2 1 386.584 3.270 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]Cc3ccnc(-n4cccn4)c3)CC2)cc1 ZINC000151093975 1417871188 /nfs/dbraw/zinc/87/11/88/1417871188.db2.gz YWGQMRHLAJPCGU-UHFFFAOYSA-N 2 1 379.483 3.203 20 0 GGADMP Cc1cccc(NC[C@H]2CC[N@H+](C[C@H](O)COc3ccccc3Cl)C2)[nH+]1 ZINC000151114966 1417875089 /nfs/dbraw/zinc/87/50/89/1417875089.db2.gz CWPSTMGSZPMVIP-SJORKVTESA-N 2 1 375.900 3.217 20 0 GGADMP Cc1cccc(NC[C@H]2CC[N@@H+](C[C@H](O)COc3ccccc3Cl)C2)[nH+]1 ZINC000151114966 1417875091 /nfs/dbraw/zinc/87/50/91/1417875091.db2.gz CWPSTMGSZPMVIP-SJORKVTESA-N 2 1 375.900 3.217 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCc2nc3ccccc3c(=O)[nH]2)CC1 ZINC000151139263 1417880352 /nfs/dbraw/zinc/88/03/52/1417880352.db2.gz GMEBMHQXJIPTJP-SFHVURJKSA-N 2 1 382.552 3.442 20 0 GGADMP Cc1cc(-c2noc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)n2)ccc1F ZINC000151250414 1417903935 /nfs/dbraw/zinc/90/39/35/1417903935.db2.gz VYTSROGAZZTVIY-UHFFFAOYSA-N 2 1 388.487 3.261 20 0 GGADMP CC[C@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000151488551 1418000600 /nfs/dbraw/zinc/00/06/00/1418000600.db2.gz XEMONXXOOICZOS-XZOQPEGZSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000151488551 1418000608 /nfs/dbraw/zinc/00/06/08/1418000608.db2.gz XEMONXXOOICZOS-XZOQPEGZSA-N 2 1 395.547 3.158 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1)[NH+](C)C1CC1 ZINC000151759481 1418080151 /nfs/dbraw/zinc/08/01/51/1418080151.db2.gz SKLQJYCYWXSXNR-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)[N@H+](C)C1CC1 ZINC000151759481 1418080160 /nfs/dbraw/zinc/08/01/60/1418080160.db2.gz SKLQJYCYWXSXNR-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)[N@@H+](C)C1CC1 ZINC000151759481 1418080166 /nfs/dbraw/zinc/08/01/66/1418080166.db2.gz SKLQJYCYWXSXNR-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@@H](C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000152303952 1418199084 /nfs/dbraw/zinc/19/90/84/1418199084.db2.gz FXIIGWIUEOFTMA-WIYYLYMNSA-N 2 1 395.551 3.239 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)C1 ZINC000152303952 1418199091 /nfs/dbraw/zinc/19/90/91/1418199091.db2.gz FXIIGWIUEOFTMA-WIYYLYMNSA-N 2 1 395.551 3.239 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CCn1cnc2ccccc2c1=O ZINC000179390542 1429355338 /nfs/dbraw/zinc/35/53/38/1429355338.db2.gz NZTZVRGTBCNPNG-UHFFFAOYSA-N 2 1 391.519 3.030 20 0 GGADMP C[N@H+](CCC(=O)Nc1cc(N)ccc1F)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179390527 1429355574 /nfs/dbraw/zinc/35/55/74/1429355574.db2.gz HGAJCDQNWYLGSK-UHFFFAOYSA-N 2 1 399.514 3.370 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H](O)COCc1cccs1 ZINC000179394215 1429357648 /nfs/dbraw/zinc/35/76/48/1429357648.db2.gz ZDAKIXNGIXZATC-FQEVSTJZSA-N 2 1 389.565 3.259 20 0 GGADMP Cc1cccn2c(=O)cc(C[N@@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)nc12 ZINC000179397644 1429358793 /nfs/dbraw/zinc/35/87/93/1429358793.db2.gz QLBLCNPXOBXJMN-UHFFFAOYSA-N 2 1 391.519 3.136 20 0 GGADMP Cc1cc2ncc([C@@H](C)[NH2+]Cc3cccc(C[N@@H+]4CCO[C@H](C)C4)c3)c(C)n2n1 ZINC000179407402 1429362406 /nfs/dbraw/zinc/36/24/06/1429362406.db2.gz CEZVATXHIMGLLW-QZTJIDSGSA-N 2 1 393.535 3.418 20 0 GGADMP Cc1cc2ncc([C@@H](C)[NH2+]Cc3cccc(C[N@H+]4CCO[C@H](C)C4)c3)c(C)n2n1 ZINC000179407402 1429362416 /nfs/dbraw/zinc/36/24/16/1429362416.db2.gz CEZVATXHIMGLLW-QZTJIDSGSA-N 2 1 393.535 3.418 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)N1CCc2sccc2C1 ZINC000179389549 1429354707 /nfs/dbraw/zinc/35/47/07/1429354707.db2.gz UIWAEZCSNXURPA-UHFFFAOYSA-N 2 1 398.576 3.266 20 0 GGADMP CCC[C@@H]1CN(C(=O)CCCC[NH+]2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000179660503 1429495618 /nfs/dbraw/zinc/49/56/18/1429495618.db2.gz CACGVVDJOQBSNE-JOCHJYFZSA-N 2 1 387.568 3.002 20 0 GGADMP CCC[C@@H]1CN(C(=O)CCCC[NH+]2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000179660503 1429495622 /nfs/dbraw/zinc/49/56/22/1429495622.db2.gz CACGVVDJOQBSNE-JOCHJYFZSA-N 2 1 387.568 3.002 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cc(F)cc3c2OCOC3)CC1 ZINC000179679609 1429504932 /nfs/dbraw/zinc/50/49/32/1429504932.db2.gz DWRYABSWMJWLDL-UHFFFAOYSA-N 2 1 380.504 3.263 20 0 GGADMP Cc1cc(NC(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)n(-c2ccc(C)cc2)n1 ZINC000179698083 1429511676 /nfs/dbraw/zinc/51/16/76/1429511676.db2.gz JTBMQINISFXEJM-UHFFFAOYSA-N 2 1 397.567 3.481 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H](C)C[N@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000152482219 1422116220 /nfs/dbraw/zinc/11/62/20/1422116220.db2.gz IFFQHPGEDGPKHS-ZSYWTGECSA-N 2 1 375.561 3.158 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000152482219 1422116222 /nfs/dbraw/zinc/11/62/22/1422116222.db2.gz IFFQHPGEDGPKHS-ZSYWTGECSA-N 2 1 375.561 3.158 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(-c2ncco2)c1 ZINC000152518017 1422129103 /nfs/dbraw/zinc/12/91/03/1422129103.db2.gz VCLJRWIHYHPPTN-IBGZPJMESA-N 2 1 385.512 3.221 20 0 GGADMP CCc1nc2c(s1)[C@@H]([N@H+](C)CC(=O)NC1CC[NH+](C(C)C)CC1)CCC2 ZINC000152604514 1422160707 /nfs/dbraw/zinc/16/07/07/1422160707.db2.gz BCXBNTSFMWUINC-KRWDZBQOSA-N 2 1 378.586 3.004 20 0 GGADMP CCc1nc2c(s1)[C@@H]([N@@H+](C)CC(=O)NC1CC[NH+](C(C)C)CC1)CCC2 ZINC000152604514 1422160722 /nfs/dbraw/zinc/16/07/22/1422160722.db2.gz BCXBNTSFMWUINC-KRWDZBQOSA-N 2 1 378.586 3.004 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N3CC[C@H]4[C@H](CCC[N@H+]4C)C3)CC2)CC1 ZINC000152745879 1422234361 /nfs/dbraw/zinc/23/43/61/1422234361.db2.gz OJQLLWVABAYIHE-UEKLYDJUSA-N 2 1 376.589 3.155 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N(C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000152769309 1422242044 /nfs/dbraw/zinc/24/20/44/1422242044.db2.gz GYKNJMHFKFGSTL-BAGYTPMASA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000152769309 1422242047 /nfs/dbraw/zinc/24/20/47/1422242047.db2.gz GYKNJMHFKFGSTL-BAGYTPMASA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000152769309 1422242057 /nfs/dbraw/zinc/24/20/57/1422242057.db2.gz GYKNJMHFKFGSTL-BAGYTPMASA-N 2 1 386.584 3.413 20 0 GGADMP CC[C@@H]([NH3+])C(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)c(Cl)c1 ZINC000152855831 1422272513 /nfs/dbraw/zinc/27/25/13/1422272513.db2.gz NYPBLDLUVNRKHU-LJQANCHMSA-N 2 1 386.927 3.338 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC2CC[NH+](C3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000153094052 1422353956 /nfs/dbraw/zinc/35/39/56/1422353956.db2.gz ZWJXNHBDEYVJOF-NQIIRXRSSA-N 2 1 384.568 3.356 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NC2CC[NH+](C3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000153094175 1422354899 /nfs/dbraw/zinc/35/48/99/1422354899.db2.gz ZWJXNHBDEYVJOF-RXVVDRJESA-N 2 1 384.568 3.356 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCOc2ccc(S(C)(=O)=O)cc2)cc1 ZINC000153110973 1422360465 /nfs/dbraw/zinc/36/04/65/1422360465.db2.gz RYKDHHPLLDXCDA-MRXNPFEDSA-N 2 1 399.516 3.314 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cc(C)nc(-c4ccc(Cl)cc4)n3)C2)CC1 ZINC000153146339 1422371459 /nfs/dbraw/zinc/37/14/59/1422371459.db2.gz DPOQUAAMUZLJQS-NRFANRHFSA-N 2 1 399.970 3.317 20 0 GGADMP O=C(c1ccc(C[NH+]2CCSCC2)cc1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000153652865 1422678515 /nfs/dbraw/zinc/67/85/15/1422678515.db2.gz BIBZJXKEEMLWCL-IRLDBZIGSA-N 2 1 399.604 3.324 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC2(N3CCSCC3)CCCC2)[C@H](C)C1 ZINC000153811525 1422771836 /nfs/dbraw/zinc/77/18/36/1422771836.db2.gz WHWRHEPONILEQM-UXHICEINSA-N 2 1 383.646 3.075 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H](NCC2([NH+]3CCSCC3)CCCC2)[C@H](C)C1 ZINC000153811525 1422771850 /nfs/dbraw/zinc/77/18/50/1422771850.db2.gz WHWRHEPONILEQM-UXHICEINSA-N 2 1 383.646 3.075 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCC2([NH+]3CCSCC3)CCCC2)[C@H](C)C1 ZINC000153811525 1422771862 /nfs/dbraw/zinc/77/18/62/1422771862.db2.gz WHWRHEPONILEQM-UXHICEINSA-N 2 1 383.646 3.075 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC[C@@H](c2ccc(C)o2)[NH+]2CCCC2)[C@H](C)C1 ZINC000154024523 1422827688 /nfs/dbraw/zinc/82/76/88/1422827688.db2.gz JRBAOBFYKCBHNK-GIVPXCGWSA-N 2 1 377.573 3.452 20 0 GGADMP OC[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC1CC[NH+](C2CCCCC2)CC1 ZINC000154040890 1422830382 /nfs/dbraw/zinc/83/03/82/1422830382.db2.gz ZXNNEUKISUXWHE-XUZZJYLKSA-N 2 1 385.596 3.256 20 0 GGADMP OC[C@@H]1CCN(Cc2ccccc2)C[C@H]1[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000154040890 1422830384 /nfs/dbraw/zinc/83/03/84/1422830384.db2.gz ZXNNEUKISUXWHE-XUZZJYLKSA-N 2 1 385.596 3.256 20 0 GGADMP O=C(C[N@@H+]1CCC[C@H]1c1ccncc1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000154091825 1422838986 /nfs/dbraw/zinc/83/89/86/1422838986.db2.gz BWAKAKOYSHVZIS-QFIPXVFZSA-N 2 1 378.520 3.131 20 0 GGADMP O=C(C[N@H+]1CCC[C@H]1c1ccncc1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000154091825 1422838987 /nfs/dbraw/zinc/83/89/87/1422838987.db2.gz BWAKAKOYSHVZIS-QFIPXVFZSA-N 2 1 378.520 3.131 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@]2(N3CCOCC3)CCSC2)cc1 ZINC000154443654 1422889545 /nfs/dbraw/zinc/88/95/45/1422889545.db2.gz HKXVAGVBHQEFKK-UTKZUKDTSA-N 2 1 386.565 3.039 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCC(=O)N3CCc4sccc4C3)C2)CC1 ZINC000154709162 1423008085 /nfs/dbraw/zinc/00/80/85/1423008085.db2.gz XOMUNUJBVIKDCD-IBGZPJMESA-N 2 1 389.609 3.467 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCC(=O)NC(=O)Nc3ccccc3)C2)CC1 ZINC000154742186 1423018213 /nfs/dbraw/zinc/01/82/13/1423018213.db2.gz WUUJDHIGTMDYFM-LJQANCHMSA-N 2 1 386.540 3.169 20 0 GGADMP Fc1cccc(F)c1-n1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)n1 ZINC000154755632 1423023029 /nfs/dbraw/zinc/02/30/29/1423023029.db2.gz RKJKHUQGJKQFRH-UHFFFAOYSA-N 2 1 390.478 3.227 20 0 GGADMP CNS(=O)(=O)c1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cc1 ZINC000154881890 1423066117 /nfs/dbraw/zinc/06/61/17/1423066117.db2.gz CUYUSBCVIGLIEO-QGZVFWFLSA-N 2 1 389.565 3.286 20 0 GGADMP CCCS(=O)(=O)N1CCC([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000154920397 1423080431 /nfs/dbraw/zinc/08/04/31/1423080431.db2.gz AHNGNGJGRVGXII-MRXNPFEDSA-N 2 1 390.553 3.036 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cn(C)nc3-c3ccccc3)CC2)C[C@H](C)O1 ZINC000179884369 1429624213 /nfs/dbraw/zinc/62/42/13/1429624213.db2.gz AHVUKNRLTKYTOV-KDURUIRLSA-N 2 1 382.552 3.408 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCN(c3ccc(F)cc3F)C2)[C@H](C)C1 ZINC000155436338 1423362821 /nfs/dbraw/zinc/36/28/21/1423362821.db2.gz OBEOMXMYXWZXBE-POAQFYNOSA-N 2 1 381.511 3.270 20 0 GGADMP Cc1ccc2oc(=O)n(C[N@@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)c2c1 ZINC000179916696 1429639380 /nfs/dbraw/zinc/63/93/80/1429639380.db2.gz LRZBVURSGMNRNZ-UHFFFAOYSA-N 2 1 380.492 3.494 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H](C)[N@@H+]2CCc3ccccc3C2)CC1 ZINC000155599905 1423438233 /nfs/dbraw/zinc/43/82/33/1423438233.db2.gz PQQJIJZPVMTWLG-RTBURBONSA-N 2 1 392.547 3.170 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H](C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000155599905 1423438235 /nfs/dbraw/zinc/43/82/35/1423438235.db2.gz PQQJIJZPVMTWLG-RTBURBONSA-N 2 1 392.547 3.170 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCN1CCN(c2cccc(Cl)c2)CC1 ZINC000155700074 1423492994 /nfs/dbraw/zinc/49/29/94/1423492994.db2.gz FWZWWJUSJFZVJW-LQWHRVPQSA-N 2 1 378.992 3.170 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@H](C)[N@@H+]2CCC[C@H](C)C2)c1 ZINC000155943146 1423604088 /nfs/dbraw/zinc/60/40/88/1423604088.db2.gz BWSBKKBHOKGYGK-ULQDDVLXSA-N 2 1 377.529 3.131 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC000155943146 1423604092 /nfs/dbraw/zinc/60/40/92/1423604092.db2.gz BWSBKKBHOKGYGK-ULQDDVLXSA-N 2 1 377.529 3.131 20 0 GGADMP Cc1c(C(=O)N2CCC(CCC[NH+]3CCCC3)CC2)cnn1-c1cc[nH+]cc1 ZINC000155992147 1423624237 /nfs/dbraw/zinc/62/42/37/1423624237.db2.gz XSVCOULISREAFT-UHFFFAOYSA-N 2 1 381.524 3.304 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NCc2cnc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000156089629 1423666611 /nfs/dbraw/zinc/66/66/11/1423666611.db2.gz IKBYEJCUAJETOO-LJQANCHMSA-N 2 1 394.567 3.215 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(NCc2cnc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000156089629 1423666617 /nfs/dbraw/zinc/66/66/17/1423666617.db2.gz IKBYEJCUAJETOO-LJQANCHMSA-N 2 1 394.567 3.215 20 0 GGADMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cc1 ZINC000156228053 1423735410 /nfs/dbraw/zinc/73/54/10/1423735410.db2.gz ZEWYQHKGELXWDL-ROUUACIJSA-N 2 1 389.565 3.156 20 0 GGADMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)cc1 ZINC000156228053 1423735418 /nfs/dbraw/zinc/73/54/18/1423735418.db2.gz ZEWYQHKGELXWDL-ROUUACIJSA-N 2 1 389.565 3.156 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000156353995 1423794248 /nfs/dbraw/zinc/79/42/48/1423794248.db2.gz ALWNCDVVRNANMZ-JOCHJYFZSA-N 2 1 384.568 3.095 20 0 GGADMP Cc1cccc(S(=O)(=O)CCC[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000156473711 1423815259 /nfs/dbraw/zinc/81/52/59/1423815259.db2.gz DPYPQULWZPBNDJ-OALUTQOASA-N 2 1 378.582 3.401 20 0 GGADMP Cc1cccc(S(=O)(=O)CCC[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000156473711 1423815261 /nfs/dbraw/zinc/81/52/61/1423815261.db2.gz DPYPQULWZPBNDJ-OALUTQOASA-N 2 1 378.582 3.401 20 0 GGADMP C[C@H]1C[C@H](N(C)C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000156680528 1423847229 /nfs/dbraw/zinc/84/72/29/1423847229.db2.gz UPQVACTVCLWYEX-RCZSKKKRSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@H](N(C)C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000156680528 1423847234 /nfs/dbraw/zinc/84/72/34/1423847234.db2.gz UPQVACTVCLWYEX-RCZSKKKRSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@H](N(C)C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000156680528 1423847237 /nfs/dbraw/zinc/84/72/37/1423847237.db2.gz UPQVACTVCLWYEX-RCZSKKKRSA-N 2 1 384.568 3.165 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4cc(F)ccc43)c2)C1 ZINC000156887870 1423880835 /nfs/dbraw/zinc/88/08/35/1423880835.db2.gz ZTMLOSRVPVDAGI-DENIHFKCSA-N 2 1 381.495 3.300 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCc4ccccc4C3)c2)C1 ZINC000156903270 1423883052 /nfs/dbraw/zinc/88/30/52/1423883052.db2.gz HSCVGEZPDFUTKZ-GOTSBHOMSA-N 2 1 377.532 3.031 20 0 GGADMP C[C@H](Cc1ccc(F)cc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156926672 1423887190 /nfs/dbraw/zinc/88/71/90/1423887190.db2.gz LJCTWZRFVRGIRX-UTKZUKDTSA-N 2 1 383.511 3.244 20 0 GGADMP Cc1nc2c(s1)[C@@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c1)CCC2 ZINC000156942058 1423890165 /nfs/dbraw/zinc/89/01/65/1423890165.db2.gz DRMXFKNOFUGEIA-OALUTQOASA-N 2 1 398.576 3.316 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)c2ccc(N3CCOC3=O)cc2)[C@H](C)C1 ZINC000157122913 1423931316 /nfs/dbraw/zinc/93/13/16/1423931316.db2.gz QWHGJWSTAOJIQK-LVCYWYKZSA-N 2 1 389.540 3.431 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(CC[NH+](C)C)CC2CCCCC2)cn1 ZINC000157238142 1423963571 /nfs/dbraw/zinc/96/35/71/1423963571.db2.gz SAIGXFKSBMNWGC-UHFFFAOYSA-N 2 1 398.555 3.229 20 0 GGADMP Cc1ccc(S(=O)(=O)N2CCC([NH2+]CC[N@@H+](C)C3CCCCC3)CC2)cc1 ZINC000157423461 1424008610 /nfs/dbraw/zinc/00/86/10/1424008610.db2.gz CGJFXZFWLCMEGY-UHFFFAOYSA-N 2 1 393.597 3.002 20 0 GGADMP Cc1ccc(S(=O)(=O)N2CCC([NH2+]CC[N@H+](C)C3CCCCC3)CC2)cc1 ZINC000157423461 1424008615 /nfs/dbraw/zinc/00/86/15/1424008615.db2.gz CGJFXZFWLCMEGY-UHFFFAOYSA-N 2 1 393.597 3.002 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000157500066 1424024439 /nfs/dbraw/zinc/02/44/39/1424024439.db2.gz WNSXTAYRKDUNFF-SFHVURJKSA-N 2 1 383.540 3.313 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000157500221 1424024778 /nfs/dbraw/zinc/02/47/78/1424024778.db2.gz WNSXTAYRKDUNFF-GOSISDBHSA-N 2 1 383.540 3.313 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1 ZINC000157616900 1424050014 /nfs/dbraw/zinc/05/00/14/1424050014.db2.gz PYKKTUXPOAOIHP-INIZCTEOSA-N 2 1 391.947 3.254 20 0 GGADMP C[C@H]1CN(c2ccc(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)cn2)CCO1 ZINC000157712417 1424071199 /nfs/dbraw/zinc/07/11/99/1424071199.db2.gz NYHMPMSPXUJTAA-FQEVSTJZSA-N 2 1 394.563 3.103 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)ccc1S(C)(=O)=O ZINC000157871585 1424109061 /nfs/dbraw/zinc/10/90/61/1424109061.db2.gz LAKLXYOGQUKMBT-IRXDYDNUSA-N 2 1 382.570 3.404 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000157921729 1424120538 /nfs/dbraw/zinc/12/05/38/1424120538.db2.gz VEWHQOXJBODNCD-MOPGFXCFSA-N 2 1 393.597 3.389 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000157921876 1424120797 /nfs/dbraw/zinc/12/07/97/1424120797.db2.gz VEWHQOXJBODNCD-OALUTQOASA-N 2 1 393.597 3.389 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)ccc1S(C)(=O)=O ZINC000157927908 1424121531 /nfs/dbraw/zinc/12/15/31/1424121531.db2.gz OYOWWMMMMXAEBX-IRXDYDNUSA-N 2 1 382.570 3.261 20 0 GGADMP CCC(CC)[C@H](CNC(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)[NH+](C)C ZINC000158038570 1424144852 /nfs/dbraw/zinc/14/48/52/1424144852.db2.gz FFPGATMURORXNC-NRFANRHFSA-N 2 1 390.572 3.049 20 0 GGADMP CC(C)OCC[NH+]1CCC([NH2+]C2CCC3(CC2)c2ccccc2NC3=O)CC1 ZINC000158049589 1424148430 /nfs/dbraw/zinc/14/84/30/1424148430.db2.gz OMRQDNDYMBYGML-UHFFFAOYSA-N 2 1 385.552 3.298 20 0 GGADMP Cc1ccc(NC(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)c(OCC[NH+](C)C)c1 ZINC000158149798 1424180067 /nfs/dbraw/zinc/18/00/67/1424180067.db2.gz GVHUOGMVVRYFJZ-IBGZPJMESA-N 2 1 390.572 3.425 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(N(C)C(C)C)c1 ZINC000158194259 1424191522 /nfs/dbraw/zinc/19/15/22/1424191522.db2.gz CQZJTGAUTHKEME-NRFANRHFSA-N 2 1 389.588 3.411 20 0 GGADMP C(CCN1CCC[C@H]([NH+]2CCCC2)C1)CC[N@@H+]1CCC[C@H](N2CCCC2)C1 ZINC000158303762 1424221664 /nfs/dbraw/zinc/22/16/64/1424221664.db2.gz GVYHLHXQYUGJRA-GOTSBHOMSA-N 2 1 376.633 3.277 20 0 GGADMP C(CCN1CCC[C@H]([NH+]2CCCC2)C1)CC[N@H+]1CCC[C@H](N2CCCC2)C1 ZINC000158303762 1424221672 /nfs/dbraw/zinc/22/16/72/1424221672.db2.gz GVYHLHXQYUGJRA-GOTSBHOMSA-N 2 1 376.633 3.277 20 0 GGADMP Cc1[nH+]c(N2CCOCC2)ccc1N[C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000180047374 1429712378 /nfs/dbraw/zinc/71/23/78/1429712378.db2.gz ZXMCVMOZJUSYCH-QGZVFWFLSA-N 2 1 384.524 3.340 20 0 GGADMP O=C(NC1CC[NH+](C2CC2)CC1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000158508035 1424275180 /nfs/dbraw/zinc/27/51/80/1424275180.db2.gz XGBHAQHNJYBEEC-OFNKIYASSA-N 2 1 396.579 3.309 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)cc1F ZINC000158640476 1424308147 /nfs/dbraw/zinc/30/81/47/1424308147.db2.gz OMCNIZKXSDHRGJ-SFHVURJKSA-N 2 1 387.503 3.097 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)cc1F ZINC000158640476 1424308152 /nfs/dbraw/zinc/30/81/52/1424308152.db2.gz OMCNIZKXSDHRGJ-SFHVURJKSA-N 2 1 387.503 3.097 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)ccc1S(C)(=O)=O ZINC000158659179 1424312603 /nfs/dbraw/zinc/31/26/03/1424312603.db2.gz REAJYQRJCOLVIW-ZACQAIPSSA-N 2 1 382.570 3.117 20 0 GGADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3CN(Cc4ccccc4)CCO3)CC2)cc1 ZINC000158687820 1424320260 /nfs/dbraw/zinc/32/02/60/1424320260.db2.gz PRJFRFNUIZOWSQ-RUZDIDTESA-N 2 1 393.575 3.184 20 0 GGADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@H]3CN(Cc4ccccc4)CCO3)CC2)cc1 ZINC000158687939 1424320348 /nfs/dbraw/zinc/32/03/48/1424320348.db2.gz PRJFRFNUIZOWSQ-VWLOTQADSA-N 2 1 393.575 3.184 20 0 GGADMP CN(c1ccccc1)C1CC[NH+](CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)CC1 ZINC000158814928 1424349601 /nfs/dbraw/zinc/34/96/01/1424349601.db2.gz NTIXCLXJPRNTTD-HSZRJFAPSA-N 2 1 394.563 3.006 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C[NH+]1CCC(OCC2CCCC2)CC1)c1ccccc1 ZINC000158856732 1424358132 /nfs/dbraw/zinc/35/81/32/1424358132.db2.gz UFSOUXWRRFEEDD-JOCHJYFZSA-N 2 1 387.568 3.077 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CCN(Cc2ccc(S(=O)(=O)N(C)C)o2)CC1 ZINC000158859678 1424358737 /nfs/dbraw/zinc/35/87/37/1424358737.db2.gz SOOVVZQSDYSEDI-KRWDZBQOSA-N 2 1 397.585 3.006 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000158952865 1424380710 /nfs/dbraw/zinc/38/07/10/1424380710.db2.gz LDKQSGDSZNAVAM-GOTSBHOMSA-N 2 1 398.595 3.211 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000158952701 1424381093 /nfs/dbraw/zinc/38/10/93/1424381093.db2.gz LDKQSGDSZNAVAM-PKTZIBPZSA-N 2 1 398.595 3.211 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000158959422 1424381819 /nfs/dbraw/zinc/38/18/19/1424381819.db2.gz VGWWKFBBMBZIGL-LJQANCHMSA-N 2 1 392.613 3.237 20 0 GGADMP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C2CC[NH+](CCOC)CC2)cc1 ZINC000159034957 1424401055 /nfs/dbraw/zinc/40/10/55/1424401055.db2.gz MQIUVBUGEZSQQB-KRWDZBQOSA-N 2 1 376.545 3.322 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](C[C@@H](C)c3ccc(OC)cc3)CC2)CC1 ZINC000180073407 1429725035 /nfs/dbraw/zinc/72/50/35/1429725035.db2.gz CPVGLFPDVVAGPC-LJQANCHMSA-N 2 1 387.568 3.065 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](Cc2cccc(F)c2F)CC1 ZINC000159342558 1424490719 /nfs/dbraw/zinc/49/07/19/1424490719.db2.gz DJMJHLHRNPTHQH-UHFFFAOYSA-N 2 1 379.495 3.169 20 0 GGADMP CCc1nn(C)c(CC)c1C[NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000159821169 1424539596 /nfs/dbraw/zinc/53/95/96/1424539596.db2.gz YZBARDJHBPHKST-HDICACEKSA-N 2 1 384.568 3.444 20 0 GGADMP C[C@@H](C[C@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000160477293 1424606695 /nfs/dbraw/zinc/60/66/95/1424606695.db2.gz UIKZPJJKXFVSMI-RBUKOAKNSA-N 2 1 397.604 3.381 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1cccc(N2CCOC2=O)c1 ZINC000160568849 1424615598 /nfs/dbraw/zinc/61/55/98/1424615598.db2.gz FACYGRYKWVEJPJ-GOSISDBHSA-N 2 1 395.503 3.326 20 0 GGADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)c2cccc(-n3cnnn3)c2)CC1 ZINC000162129683 1424818424 /nfs/dbraw/zinc/81/84/24/1424818424.db2.gz DALDPEPCXSTAJD-SFHVURJKSA-N 2 1 376.508 3.286 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)CC2)nc(C)[nH+]1 ZINC000162253445 1424831494 /nfs/dbraw/zinc/83/14/94/1424831494.db2.gz UNMGOAOSGLALIL-SFHVURJKSA-N 3 1 397.567 3.353 20 0 GGADMP COc1cccc(C(=O)NCC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000162405782 1424847087 /nfs/dbraw/zinc/84/70/87/1424847087.db2.gz ONDURDUMKMALBF-INIZCTEOSA-N 2 1 378.476 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000162416405 1424848956 /nfs/dbraw/zinc/84/89/56/1424848956.db2.gz ZOUMNFDEGKJUEK-MOPGFXCFSA-N 2 1 376.545 3.084 20 0 GGADMP C[C@@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(OC(C)(C)C)CC1 ZINC000162508765 1424860029 /nfs/dbraw/zinc/86/00/29/1424860029.db2.gz XMBPFWYHQAHQMW-ICSRJNTNSA-N 2 1 387.568 3.045 20 0 GGADMP C[C@@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(OC(C)(C)C)CC1 ZINC000162508765 1424860032 /nfs/dbraw/zinc/86/00/32/1424860032.db2.gz XMBPFWYHQAHQMW-ICSRJNTNSA-N 2 1 387.568 3.045 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(OC(C)(C)C)CC1 ZINC000162508633 1424860115 /nfs/dbraw/zinc/86/01/15/1424860115.db2.gz XMBPFWYHQAHQMW-UYAOXDASSA-N 2 1 387.568 3.045 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(OC(C)(C)C)CC1 ZINC000162508633 1424860118 /nfs/dbraw/zinc/86/01/18/1424860118.db2.gz XMBPFWYHQAHQMW-UYAOXDASSA-N 2 1 387.568 3.045 20 0 GGADMP COc1cc(NC(=O)CC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c(OC)cc1Cl ZINC000162796449 1424891175 /nfs/dbraw/zinc/89/11/75/1424891175.db2.gz RRAGEPQVVZUHRG-PBHICJAKSA-N 2 1 395.931 3.102 20 0 GGADMP COc1cc(NC(=O)CC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c(OC)cc1Cl ZINC000162796449 1424891178 /nfs/dbraw/zinc/89/11/78/1424891178.db2.gz RRAGEPQVVZUHRG-PBHICJAKSA-N 2 1 395.931 3.102 20 0 GGADMP COc1cc(NC(=O)CC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c(OC)cc1Cl ZINC000162796449 1424891180 /nfs/dbraw/zinc/89/11/80/1424891180.db2.gz RRAGEPQVVZUHRG-PBHICJAKSA-N 2 1 395.931 3.102 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000162897693 1424901420 /nfs/dbraw/zinc/90/14/20/1424901420.db2.gz BHZGVROWCGIJNU-OAQYLSRUSA-N 2 1 386.584 3.318 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC[N@@H+]1C ZINC000163038747 1424928958 /nfs/dbraw/zinc/92/89/58/1424928958.db2.gz PFEGTEZZRZOAJY-GHTZIAJQSA-N 2 1 397.542 3.120 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC[N@H+]1C ZINC000163038747 1424928974 /nfs/dbraw/zinc/92/89/74/1424928974.db2.gz PFEGTEZZRZOAJY-GHTZIAJQSA-N 2 1 397.542 3.120 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]C[C@H]3CCN(CC(F)(F)F)C3)CC2)cc1 ZINC000163136485 1424948513 /nfs/dbraw/zinc/94/85/13/1424948513.db2.gz WJMUVGCZBHEHKA-QGZVFWFLSA-N 2 1 387.465 3.306 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc(-n2cnnn2)cc1 ZINC000163264332 1424969244 /nfs/dbraw/zinc/96/92/44/1424969244.db2.gz AELSFCJTZZADHU-LQWHRVPQSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc(-n2cnnn2)cc1 ZINC000163264332 1424969247 /nfs/dbraw/zinc/96/92/47/1424969247.db2.gz AELSFCJTZZADHU-LQWHRVPQSA-N 2 1 376.508 3.366 20 0 GGADMP COc1ccc(Cl)cc1CN1CC[NH+](CCCCn2cc[nH+]c2C)CC1 ZINC000163305430 1424976390 /nfs/dbraw/zinc/97/63/90/1424976390.db2.gz DIZLBWYXFDTNRC-UHFFFAOYSA-N 2 1 376.932 3.452 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H]3CCC[N@@H+](CC(C)C)C3)CC2)cs1 ZINC000163335296 1424981074 /nfs/dbraw/zinc/98/10/74/1424981074.db2.gz NLOTUXZWCAYUAD-SFHVURJKSA-N 2 1 392.613 3.148 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H]3CCC[N@H+](CC(C)C)C3)CC2)cs1 ZINC000163335296 1424981082 /nfs/dbraw/zinc/98/10/82/1424981082.db2.gz NLOTUXZWCAYUAD-SFHVURJKSA-N 2 1 392.613 3.148 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cccc(OCC(=O)N(C)C)c2)cc1 ZINC000163805753 1425046203 /nfs/dbraw/zinc/04/62/03/1425046203.db2.gz PVMURXLBMRBZEU-KRWDZBQOSA-N 2 1 392.503 3.499 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C(=O)NCc1ccccc1 ZINC000180160463 1429772501 /nfs/dbraw/zinc/77/25/01/1429772501.db2.gz QIGBSCNXMUICID-FDTGPBLFSA-N 2 1 377.532 3.192 20 0 GGADMP CC[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)[C@H]1CCOC1 ZINC000163968642 1425063372 /nfs/dbraw/zinc/06/33/72/1425063372.db2.gz ZMLYIQMNBNCOSJ-SIKLNZKXSA-N 2 1 376.541 3.081 20 0 GGADMP CC(C)[NH+]1CCC(NCc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)CC1 ZINC000163973112 1425064915 /nfs/dbraw/zinc/06/49/15/1425064915.db2.gz SOQRSXNEAQQQSO-UHFFFAOYSA-N 2 1 389.584 3.139 20 0 GGADMP CC(C)[NH+]1CCC([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)CC1 ZINC000163973112 1425064926 /nfs/dbraw/zinc/06/49/26/1425064926.db2.gz SOQRSXNEAQQQSO-UHFFFAOYSA-N 3 1 389.584 3.139 20 0 GGADMP CC(C)[NH+]1CCC([NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)CC1 ZINC000163973112 1425064936 /nfs/dbraw/zinc/06/49/36/1425064936.db2.gz SOQRSXNEAQQQSO-UHFFFAOYSA-N 3 1 389.584 3.139 20 0 GGADMP CC(C)N1CCC([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)CC1 ZINC000163973112 1425064947 /nfs/dbraw/zinc/06/49/47/1425064947.db2.gz SOQRSXNEAQQQSO-UHFFFAOYSA-N 2 1 389.584 3.139 20 0 GGADMP CC(C)N1CCC([NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)CC1 ZINC000163973112 1425064958 /nfs/dbraw/zinc/06/49/58/1425064958.db2.gz SOQRSXNEAQQQSO-UHFFFAOYSA-N 2 1 389.584 3.139 20 0 GGADMP Cn1ncc2c1CCC[C@H]2[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000163974840 1425065041 /nfs/dbraw/zinc/06/50/41/1425065041.db2.gz DIVHNYAYQGYVFC-JOCHJYFZSA-N 2 1 398.551 3.077 20 0 GGADMP O=C([C@@H]1Cc2ccccc2CN1)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000164019584 1425068419 /nfs/dbraw/zinc/06/84/19/1425068419.db2.gz XHSOSWCGORJGNE-NRFANRHFSA-N 2 1 383.923 3.089 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)C2([NH3+])Cc3ccccc3C2)cc1 ZINC000164585473 1425126305 /nfs/dbraw/zinc/12/63/05/1425126305.db2.gz VPBPGKLKJDVROS-GOSISDBHSA-N 2 1 377.532 3.174 20 0 GGADMP Cc1ccc([C@@H](C[NH2+]C2CC[NH+](C3CCCCC3)CC2)N2CCOCC2)o1 ZINC000164600136 1425127162 /nfs/dbraw/zinc/12/71/62/1425127162.db2.gz CRKKFQYEPOFANY-OAQYLSRUSA-N 2 1 375.557 3.348 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C[C@@H](c1ccc(Cl)cc1)N1CCOC(C)(C)C1 ZINC000165474883 1425180888 /nfs/dbraw/zinc/18/08/88/1425180888.db2.gz NEBLKXSPYNDEJH-UXPWSPDFSA-N 2 1 379.976 3.422 20 0 GGADMP CC[N@H+]1CC[C@H](NCc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)[C@H](C)C1 ZINC000165584156 1425186228 /nfs/dbraw/zinc/18/62/28/1425186228.db2.gz RFHVONVLHNGTCS-APWZRJJASA-N 2 1 398.517 3.277 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccn1C1CC[NH2+]CC1 ZINC000166205374 1425208237 /nfs/dbraw/zinc/20/82/37/1425208237.db2.gz FXEAYMGXHZRQJG-KRWDZBQOSA-N 2 1 386.565 3.116 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccn1C1CC[NH2+]CC1 ZINC000166205486 1425208286 /nfs/dbraw/zinc/20/82/86/1425208286.db2.gz FXEAYMGXHZRQJG-QGZVFWFLSA-N 2 1 386.565 3.116 20 0 GGADMP O=C(NCc1ccncc1)Nc1cccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000166603583 1425214664 /nfs/dbraw/zinc/21/46/64/1425214664.db2.gz QJKVYGMXUJVCJT-TZIWHRDSSA-N 2 1 379.508 3.120 20 0 GGADMP O=C(NCc1ccncc1)Nc1cccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000166603583 1425214670 /nfs/dbraw/zinc/21/46/70/1425214670.db2.gz QJKVYGMXUJVCJT-TZIWHRDSSA-N 2 1 379.508 3.120 20 0 GGADMP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000166701386 1425216460 /nfs/dbraw/zinc/21/64/60/1425216460.db2.gz MBNOYFHCUBBFNP-RTBURBONSA-N 2 1 396.501 3.174 20 0 GGADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(NC(=O)NCc3ccncc3)c2)[C@H](C)C1 ZINC000167341271 1425224581 /nfs/dbraw/zinc/22/45/81/1425224581.db2.gz GHGWYXOJGHEKEY-UTKZUKDTSA-N 2 1 381.524 3.223 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]Cc2cccc(NC(=O)NCc3ccncc3)c2)[C@H](C)C1 ZINC000167341271 1425224590 /nfs/dbraw/zinc/22/45/90/1425224590.db2.gz GHGWYXOJGHEKEY-UTKZUKDTSA-N 2 1 381.524 3.223 20 0 GGADMP C[C@@H](CC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)C1CC[NH2+]CC1 ZINC000168953804 1425240736 /nfs/dbraw/zinc/24/07/36/1425240736.db2.gz NGAUQFHOXTYNCW-KXBFYZLASA-N 2 1 397.485 3.422 20 0 GGADMP C[N@@H+]1CCC[C@@H]2CN(C(=O)Nc3ccccc3C[NH+]3CCSCC3)CC[C@@H]21 ZINC000169123007 1425243447 /nfs/dbraw/zinc/24/34/47/1425243447.db2.gz VLDPWHJQLWIKEY-QUCCMNQESA-N 2 1 388.581 3.183 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)Nc3ccccc3C[NH+]3CCSCC3)CC[C@@H]21 ZINC000169123007 1425243464 /nfs/dbraw/zinc/24/34/64/1425243464.db2.gz VLDPWHJQLWIKEY-QUCCMNQESA-N 2 1 388.581 3.183 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH2+]C2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000169137753 1425243950 /nfs/dbraw/zinc/24/39/50/1425243950.db2.gz PECFQZKHXSAMQY-NUJGCVRESA-N 2 1 383.458 3.204 20 0 GGADMP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)CCCC[NH+]2CCOCC2)C1 ZINC000170694400 1425304116 /nfs/dbraw/zinc/30/41/16/1425304116.db2.gz LBFFKKJOMHZGEF-HXUWFJFHSA-N 2 1 387.568 3.037 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)CCCC[NH+]2CCOCC2)C1 ZINC000170694400 1425304117 /nfs/dbraw/zinc/30/41/17/1425304117.db2.gz LBFFKKJOMHZGEF-HXUWFJFHSA-N 2 1 387.568 3.037 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)[C@H](c3ccccc3)[NH+](C)C)c(C)c2)CC1 ZINC000171015722 1425437795 /nfs/dbraw/zinc/43/77/95/1425437795.db2.gz YJBFWFIVBXBYJM-QFIPXVFZSA-N 2 1 380.536 3.378 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000171042932 1425452242 /nfs/dbraw/zinc/45/22/42/1425452242.db2.gz ITCSGBWVBHUUMD-UHFFFAOYSA-N 2 1 386.584 3.339 20 0 GGADMP Cc1nccn1C[C@H](C)CNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000171215748 1425544383 /nfs/dbraw/zinc/54/43/83/1425544383.db2.gz CRBRHCOJJBSXAG-HXUWFJFHSA-N 2 1 397.567 3.178 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000171215748 1425544387 /nfs/dbraw/zinc/54/43/87/1425544387.db2.gz CRBRHCOJJBSXAG-HXUWFJFHSA-N 2 1 397.567 3.178 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000171215748 1425544396 /nfs/dbraw/zinc/54/43/96/1425544396.db2.gz CRBRHCOJJBSXAG-HXUWFJFHSA-N 2 1 397.567 3.178 20 0 GGADMP CCOC(=O)c1sc2nc(C[NH+](C)C)nc(NCC[NH2+]C(C)(C)C)c2c1C ZINC000171216624 1425545268 /nfs/dbraw/zinc/54/52/68/1425545268.db2.gz OFCHXEZWEFMUPD-UHFFFAOYSA-N 2 1 393.557 3.038 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NCCCNc2ccc(C)c[nH+]2)[NH+]2CCCC2)o1 ZINC000171227703 1425550916 /nfs/dbraw/zinc/55/09/16/1425550916.db2.gz BIRQYDWPMULDEN-SFHVURJKSA-N 2 1 385.512 3.230 20 0 GGADMP Cc1cccc(NC(=O)[C@@H](C)[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000171304662 1425605561 /nfs/dbraw/zinc/60/55/61/1425605561.db2.gz PGSYYZILSXQECF-WSTZPKSXSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1cccc(NC(=O)[C@@H](C)[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000171304662 1425605565 /nfs/dbraw/zinc/60/55/65/1425605565.db2.gz PGSYYZILSXQECF-WSTZPKSXSA-N 2 1 387.568 3.452 20 0 GGADMP C[C@@H](C[NH+]1CCCCC1)NC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000171305536 1425605776 /nfs/dbraw/zinc/60/57/76/1425605776.db2.gz UTMGXPQMCLCOIX-FQEVSTJZSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cn4cc(Cl)ccc4n3)CC2)C[C@H](C)O1 ZINC000171304409 1425605892 /nfs/dbraw/zinc/60/58/92/1425605892.db2.gz ZQXJIOGDYNSHCI-IYBDPMFKSA-N 2 1 376.932 3.309 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cn4cc(Cl)ccc4n3)CC2)C[C@H](C)O1 ZINC000171304409 1425605899 /nfs/dbraw/zinc/60/58/99/1425605899.db2.gz ZQXJIOGDYNSHCI-IYBDPMFKSA-N 2 1 376.932 3.309 20 0 GGADMP C[C@H]1C[NH+](CC2CC[NH+](Cc3cn4cc(Cl)ccc4n3)CC2)C[C@H](C)O1 ZINC000171304414 1425606146 /nfs/dbraw/zinc/60/61/46/1425606146.db2.gz ZQXJIOGDYNSHCI-HOTGVXAUSA-N 2 1 376.932 3.309 20 0 GGADMP CC(C)N(C(=O)C[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000171306530 1425606911 /nfs/dbraw/zinc/60/69/11/1425606911.db2.gz LLHVPOHYQSWEMM-BGYRXZFFSA-N 2 1 387.568 3.249 20 0 GGADMP CC(C)N(C(=O)C[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000171306530 1425606915 /nfs/dbraw/zinc/60/69/15/1425606915.db2.gz LLHVPOHYQSWEMM-BGYRXZFFSA-N 2 1 387.568 3.249 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)NC[C@H]2CC[NH+](C3CC3)C2)CC1 ZINC000171309284 1425608788 /nfs/dbraw/zinc/60/87/88/1425608788.db2.gz OUAHEDXOKZYRNF-OAQYLSRUSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000171309284 1425608790 /nfs/dbraw/zinc/60/87/90/1425608790.db2.gz OUAHEDXOKZYRNF-OAQYLSRUSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+](Cc1ccccc1)CC1CCN(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CC1 ZINC000171309284 1425608795 /nfs/dbraw/zinc/60/87/95/1425608795.db2.gz OUAHEDXOKZYRNF-OAQYLSRUSA-N 2 1 384.568 3.024 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@H]2CC[N@H+](CCc3ccccc3)C2)[nH+]c1 ZINC000171474433 1425695739 /nfs/dbraw/zinc/69/57/39/1425695739.db2.gz XGEGWBBIOKOJLH-OAQYLSRUSA-N 2 1 395.551 3.056 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)[nH+]c1 ZINC000171474433 1425695747 /nfs/dbraw/zinc/69/57/47/1425695747.db2.gz XGEGWBBIOKOJLH-OAQYLSRUSA-N 2 1 395.551 3.056 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cccc(OCc4ccccc4)c3)C2)CC1 ZINC000171526726 1425717726 /nfs/dbraw/zinc/71/77/26/1425717726.db2.gz MNRSSHIOYGNUDN-HSZRJFAPSA-N 2 1 379.548 3.477 20 0 GGADMP CC(C)(C)[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000171564817 1425738666 /nfs/dbraw/zinc/73/86/66/1425738666.db2.gz IFEJTKUODVUTPN-FQEVSTJZSA-N 2 1 386.584 3.113 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[C@@H]1C[NH+]1CCCC1)c1ccccc1Cl ZINC000171588138 1425749166 /nfs/dbraw/zinc/74/91/66/1425749166.db2.gz DCHHKPSEJOECQJ-VQIMIIECSA-N 2 1 378.948 3.213 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)NC2CC[NH+](CC3CC3)CC2)C1 ZINC000172223610 1425953889 /nfs/dbraw/zinc/95/38/89/1425953889.db2.gz XPAKMQANBCBYSA-ICSRJNTNSA-N 2 1 376.589 3.157 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCn2cnc3ccccc3c2=O)CC1 ZINC000172246779 1425964366 /nfs/dbraw/zinc/96/43/66/1425964366.db2.gz CNKOGWHIHLIQSX-UHFFFAOYSA-N 2 1 390.531 3.241 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CCC[C@@H]2Cc2ccccc2Cl)CC1 ZINC000172246948 1425965007 /nfs/dbraw/zinc/96/50/07/1425965007.db2.gz RZYULYYJCUNDME-LJQANCHMSA-N 2 1 377.960 3.336 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@@H]2Cc2ccccc2Cl)CC1 ZINC000172246948 1425965011 /nfs/dbraw/zinc/96/50/11/1425965011.db2.gz RZYULYYJCUNDME-LJQANCHMSA-N 2 1 377.960 3.336 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000172258475 1425970863 /nfs/dbraw/zinc/97/08/63/1425970863.db2.gz ZXOSRQXNYBZZOL-GOSISDBHSA-N 2 1 383.540 3.134 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)CCCC[NH+]2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000172411814 1426030538 /nfs/dbraw/zinc/03/05/38/1426030538.db2.gz KNCVNKKELPKMCC-IFMALSPDSA-N 2 1 387.568 3.000 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)CCCC[NH+]2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000172411814 1426030545 /nfs/dbraw/zinc/03/05/45/1426030545.db2.gz KNCVNKKELPKMCC-IFMALSPDSA-N 2 1 387.568 3.000 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CCC[NH+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000172416047 1426033661 /nfs/dbraw/zinc/03/36/61/1426033661.db2.gz NDQDZRVVXJOPFM-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CCC[NH+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000172416047 1426033668 /nfs/dbraw/zinc/03/36/68/1426033668.db2.gz NDQDZRVVXJOPFM-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@@H+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000172416047 1426033678 /nfs/dbraw/zinc/03/36/78/1426033678.db2.gz NDQDZRVVXJOPFM-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@H+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000172416047 1426033685 /nfs/dbraw/zinc/03/36/85/1426033685.db2.gz NDQDZRVVXJOPFM-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP Cc1ccc(NC(=O)N2CCC[N@H+](C3CCCC3)CC2)c(OCC[NH+](C)C)c1 ZINC000172501221 1426061185 /nfs/dbraw/zinc/06/11/85/1426061185.db2.gz LYEBUDPXIBTWHA-UHFFFAOYSA-N 2 1 388.556 3.418 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172527743 1426071790 /nfs/dbraw/zinc/07/17/90/1426071790.db2.gz WQDGSZKCLXBUFG-UHFFFAOYSA-N 2 1 384.568 3.442 20 0 GGADMP CCCOc1ccccc1NC(=O)N(CC[NH+](C)C)C[C@@H]1CCC[N@H+]1CC ZINC000172655409 1426129565 /nfs/dbraw/zinc/12/95/65/1426129565.db2.gz CRNKCAZSFHHAHS-SFHVURJKSA-N 2 1 376.545 3.355 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000172655040 1426129604 /nfs/dbraw/zinc/12/96/04/1426129604.db2.gz WGBRITPOJCVMPH-INIZCTEOSA-N 2 1 384.471 3.168 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(C)c(OC(F)F)c1 ZINC000173187806 1426382758 /nfs/dbraw/zinc/38/27/58/1426382758.db2.gz ODNKMSGUMHYRMR-KRWDZBQOSA-N 2 1 398.498 3.476 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173304397 1426485294 /nfs/dbraw/zinc/48/52/94/1426485294.db2.gz JULLHRQBKFYWSU-KRWDZBQOSA-N 2 1 381.586 3.242 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173304397 1426485302 /nfs/dbraw/zinc/48/53/02/1426485302.db2.gz JULLHRQBKFYWSU-KRWDZBQOSA-N 2 1 381.586 3.242 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173324947 1426506053 /nfs/dbraw/zinc/50/60/53/1426506053.db2.gz HTKIWSCKUMGWLX-MSOLQXFVSA-N 2 1 381.586 3.242 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000173349478 1426527445 /nfs/dbraw/zinc/52/74/45/1426527445.db2.gz NUZOLTJLQHXJII-OALUTQOASA-N 2 1 376.545 3.180 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1 ZINC000173387649 1426565079 /nfs/dbraw/zinc/56/50/79/1426565079.db2.gz UXKNAXKCBCYONX-KRWDZBQOSA-N 2 1 389.565 3.239 20 0 GGADMP COc1cccc([C@H](CNC(=O)NCCCCn2cc[nH+]c2C)[NH+]2CCCC2)c1 ZINC000173426978 1426609095 /nfs/dbraw/zinc/60/90/95/1426609095.db2.gz LGHWYBQGXGSLNK-NRFANRHFSA-N 2 1 399.539 3.117 20 0 GGADMP O=C([C@@H]1CCCC[N@H+]1Cc1ccccc1)N1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173503344 1426672580 /nfs/dbraw/zinc/67/25/80/1426672580.db2.gz IHGTUJXCRJZXAL-QHCPKHFHSA-N 2 1 399.579 3.145 20 0 GGADMP CSc1ccc(OCC[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)cc1 ZINC000173596743 1426761515 /nfs/dbraw/zinc/76/15/15/1426761515.db2.gz XMWASQRDIMFLGU-OALUTQOASA-N 2 1 377.598 3.278 20 0 GGADMP C[N@@H+](CC(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cc1)C1CCC1 ZINC000173617625 1426798489 /nfs/dbraw/zinc/79/84/89/1426798489.db2.gz CKBHAXIMZHTCBE-UHFFFAOYSA-N 2 1 392.547 3.432 20 0 GGADMP C[C@H]1C[NH+](CC2CC[NH+](Cc3ccn(-c4ccc(F)cc4)n3)CC2)C[C@H](C)O1 ZINC000173623247 1426801116 /nfs/dbraw/zinc/80/11/16/1426801116.db2.gz PPJRAMWFYCLLNC-ROUUACIJSA-N 2 1 386.515 3.333 20 0 GGADMP COc1cc(NC(=O)CC[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c(OC)cc1Cl ZINC000173643913 1426807872 /nfs/dbraw/zinc/80/78/72/1426807872.db2.gz SCIADWARPCUUFF-HNNXBMFYSA-N 2 1 397.947 3.492 20 0 GGADMP COc1cc(NC(=O)CC[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)c(OC)cc1Cl ZINC000173643913 1426807873 /nfs/dbraw/zinc/80/78/73/1426807873.db2.gz SCIADWARPCUUFF-HNNXBMFYSA-N 2 1 397.947 3.492 20 0 GGADMP COc1cc(NC(=O)CC[NH+](C)CC[C@@H]2CCCC[N@H+]2C)c(OC)cc1Cl ZINC000173643913 1426807876 /nfs/dbraw/zinc/80/78/76/1426807876.db2.gz SCIADWARPCUUFF-HNNXBMFYSA-N 2 1 397.947 3.492 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(Cc2cccc(CN3CC[C@H](C[N@H+](C)CC)C3)c2)C1 ZINC000173885555 1426881055 /nfs/dbraw/zinc/88/10/55/1426881055.db2.gz SKSNMMVLKXFKHT-DNQXCXABSA-N 2 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@H]1CC[NH+](Cc2cccc(CN3CC[C@H](C[N@@H+](C)CC)C3)c2)C1 ZINC000173885555 1426881060 /nfs/dbraw/zinc/88/10/60/1426881060.db2.gz SKSNMMVLKXFKHT-DNQXCXABSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@H]1CC[NH+](Cc2cccc(CN3CC[C@H](C[N@H+](C)CC)C3)c2)C1 ZINC000173885555 1426881062 /nfs/dbraw/zinc/88/10/62/1426881062.db2.gz SKSNMMVLKXFKHT-DNQXCXABSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(CN3CC[C@H](C[NH+](C)CC)C3)c2)C1 ZINC000173885555 1426881066 /nfs/dbraw/zinc/88/10/66/1426881066.db2.gz SKSNMMVLKXFKHT-DNQXCXABSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(CN3CC[C@H](C[NH+](C)CC)C3)c2)C1 ZINC000173885555 1426881069 /nfs/dbraw/zinc/88/10/69/1426881069.db2.gz SKSNMMVLKXFKHT-DNQXCXABSA-N 3 1 386.628 3.234 20 0 GGADMP CC[N@@H+](C)C[C@H]1CC[NH+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000173895428 1426883710 /nfs/dbraw/zinc/88/37/10/1426883710.db2.gz HOJWOZCGAZUHSP-LJQANCHMSA-N 2 1 383.540 3.091 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000173895428 1426883712 /nfs/dbraw/zinc/88/37/12/1426883712.db2.gz HOJWOZCGAZUHSP-LJQANCHMSA-N 2 1 383.540 3.091 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000173895428 1426883714 /nfs/dbraw/zinc/88/37/14/1426883714.db2.gz HOJWOZCGAZUHSP-LJQANCHMSA-N 2 1 383.540 3.091 20 0 GGADMP COc1ccc([C@H](CNC(=O)NCCCCn2cc[nH+]c2C)[NH+]2CCCC2)cc1 ZINC000173900117 1426885140 /nfs/dbraw/zinc/88/51/40/1426885140.db2.gz UIBCYOLKOSKKRE-NRFANRHFSA-N 2 1 399.539 3.117 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)Nc2ccn(CC[NH+](C)C)n2)cc1 ZINC000173930706 1426897233 /nfs/dbraw/zinc/89/72/33/1426897233.db2.gz YXEOUVFVQPEOOM-SFHVURJKSA-N 2 1 398.555 3.141 20 0 GGADMP Clc1ccccc1-c1nnc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)o1 ZINC000173950343 1426905763 /nfs/dbraw/zinc/90/57/63/1426905763.db2.gz QPPIRUDEMRZPCC-UHFFFAOYSA-N 2 1 390.915 3.467 20 0 GGADMP Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1F ZINC000173950610 1426906354 /nfs/dbraw/zinc/90/63/54/1426906354.db2.gz KHLDIQDBNJIODU-QGZVFWFLSA-N 2 1 377.504 3.038 20 0 GGADMP CSc1cccc(NC(=O)[C@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000173957565 1426909141 /nfs/dbraw/zinc/90/91/41/1426909141.db2.gz DSZRVWHBKUQBHA-KRWDZBQOSA-N 2 1 391.581 3.312 20 0 GGADMP O=C1[C@@H]([NH+]2CCC(OCC[NH+]3CCCC3)CC2)CCN1c1ccc(Cl)cc1 ZINC000173958588 1426909725 /nfs/dbraw/zinc/90/97/25/1426909725.db2.gz FRZISGCTNYTQJL-FQEVSTJZSA-N 2 1 391.943 3.022 20 0 GGADMP O=C(C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)Nc1cccc(C(F)(F)F)c1 ZINC000173961182 1426911340 /nfs/dbraw/zinc/91/13/40/1426911340.db2.gz NLYABQZVZJXCMU-UHFFFAOYSA-N 2 1 399.457 3.221 20 0 GGADMP Clc1cc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc2c1OCCO2 ZINC000173961846 1426911681 /nfs/dbraw/zinc/91/16/81/1426911681.db2.gz YUGSKGAOEFDGKA-UHFFFAOYSA-N 2 1 380.916 3.188 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1cccc(F)c1 ZINC000173974396 1426920346 /nfs/dbraw/zinc/92/03/46/1426920346.db2.gz VHJCCDKOBVXWED-QGZVFWFLSA-N 2 1 385.483 3.337 20 0 GGADMP CN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174112336 1427007087 /nfs/dbraw/zinc/00/70/87/1427007087.db2.gz YKXCPFFCVVFDRJ-PMACEKPBSA-N 2 1 384.524 3.188 20 0 GGADMP CN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174112336 1427007094 /nfs/dbraw/zinc/00/70/94/1427007094.db2.gz YKXCPFFCVVFDRJ-PMACEKPBSA-N 2 1 384.524 3.188 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000174118895 1427009649 /nfs/dbraw/zinc/00/96/49/1427009649.db2.gz OOQRBWQYVAOAOI-IBGZPJMESA-N 2 1 390.547 3.163 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C(=O)NCC(F)(F)F ZINC000174154962 1427024146 /nfs/dbraw/zinc/02/41/46/1427024146.db2.gz OGYCOOFGCIQQQX-AWEZNQCLSA-N 2 1 383.414 3.068 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174220491 1427057102 /nfs/dbraw/zinc/05/71/02/1427057102.db2.gz QTYZTGRXTOFXLX-NQIIRXRSSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174220491 1427057108 /nfs/dbraw/zinc/05/71/08/1427057108.db2.gz QTYZTGRXTOFXLX-NQIIRXRSSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174220473 1427057319 /nfs/dbraw/zinc/05/73/19/1427057319.db2.gz QTYZTGRXTOFXLX-WIYYLYMNSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174220473 1427057322 /nfs/dbraw/zinc/05/73/22/1427057322.db2.gz QTYZTGRXTOFXLX-WIYYLYMNSA-N 2 1 383.540 3.134 20 0 GGADMP CSc1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174241348 1427065840 /nfs/dbraw/zinc/06/58/40/1427065840.db2.gz FJJDRJSCAQMNRD-QGZVFWFLSA-N 2 1 391.581 3.312 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)cc1F ZINC000174335297 1427106641 /nfs/dbraw/zinc/10/66/41/1427106641.db2.gz NUWSXEDZTFYRCG-MOPGFXCFSA-N 2 1 399.514 3.477 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1F ZINC000174335297 1427106650 /nfs/dbraw/zinc/10/66/50/1427106650.db2.gz NUWSXEDZTFYRCG-MOPGFXCFSA-N 2 1 399.514 3.477 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)C1 ZINC000174335549 1427107425 /nfs/dbraw/zinc/10/74/25/1427107425.db2.gz PRGWSZYTNZHMMS-SFHVURJKSA-N 2 1 387.503 3.193 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)C1 ZINC000174335549 1427107426 /nfs/dbraw/zinc/10/74/26/1427107426.db2.gz PRGWSZYTNZHMMS-SFHVURJKSA-N 2 1 387.503 3.193 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)cc1F ZINC000174335797 1427107680 /nfs/dbraw/zinc/10/76/80/1427107680.db2.gz LSGXMKHQPLULQD-GOSISDBHSA-N 2 1 387.503 3.336 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1F ZINC000174335797 1427107684 /nfs/dbraw/zinc/10/76/84/1427107684.db2.gz LSGXMKHQPLULQD-GOSISDBHSA-N 2 1 387.503 3.336 20 0 GGADMP C[N@@H+](CCC(=O)NC(=O)Nc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174400266 1427139584 /nfs/dbraw/zinc/13/95/84/1427139584.db2.gz HMUAEMVGGOZPFB-FQEVSTJZSA-N 2 1 394.519 3.179 20 0 GGADMP C[NH+](CCC(=O)NC(=O)Nc1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174400266 1427139591 /nfs/dbraw/zinc/13/95/91/1427139591.db2.gz HMUAEMVGGOZPFB-FQEVSTJZSA-N 2 1 394.519 3.179 20 0 GGADMP C[NH+](CCC(=O)NC(=O)Nc1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174400266 1427139597 /nfs/dbraw/zinc/13/95/97/1427139597.db2.gz HMUAEMVGGOZPFB-FQEVSTJZSA-N 2 1 394.519 3.179 20 0 GGADMP C[N@@H+](CCC(=O)NC(=O)Nc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174400282 1427139656 /nfs/dbraw/zinc/13/96/56/1427139656.db2.gz HMUAEMVGGOZPFB-HXUWFJFHSA-N 2 1 394.519 3.179 20 0 GGADMP C[NH+](CCC(=O)NC(=O)Nc1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174400282 1427139664 /nfs/dbraw/zinc/13/96/64/1427139664.db2.gz HMUAEMVGGOZPFB-HXUWFJFHSA-N 2 1 394.519 3.179 20 0 GGADMP C[NH+](CCC(=O)NC(=O)Nc1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174400282 1427139675 /nfs/dbraw/zinc/13/96/75/1427139675.db2.gz HMUAEMVGGOZPFB-HXUWFJFHSA-N 2 1 394.519 3.179 20 0 GGADMP C[N@@H+](C[C@H](O)COCc1ccccc1F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174403564 1427142038 /nfs/dbraw/zinc/14/20/38/1427142038.db2.gz QZJURPLUMUGOTI-UNMCSNQZSA-N 2 1 386.511 3.157 20 0 GGADMP C[NH+](C[C@H](O)COCc1ccccc1F)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174403564 1427142046 /nfs/dbraw/zinc/14/20/46/1427142046.db2.gz QZJURPLUMUGOTI-UNMCSNQZSA-N 2 1 386.511 3.157 20 0 GGADMP C[NH+](C[C@H](O)COCc1ccccc1F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174403564 1427142053 /nfs/dbraw/zinc/14/20/53/1427142053.db2.gz QZJURPLUMUGOTI-UNMCSNQZSA-N 2 1 386.511 3.157 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000174460140 1427165937 /nfs/dbraw/zinc/16/59/37/1427165937.db2.gz AONJKVFGYXACIR-RBUKOAKNSA-N 2 1 392.613 3.333 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000174460140 1427165951 /nfs/dbraw/zinc/16/59/51/1427165951.db2.gz AONJKVFGYXACIR-RBUKOAKNSA-N 2 1 392.613 3.333 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000174460140 1427165958 /nfs/dbraw/zinc/16/59/58/1427165958.db2.gz AONJKVFGYXACIR-RBUKOAKNSA-N 2 1 392.613 3.333 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000174525110 1427203398 /nfs/dbraw/zinc/20/33/98/1427203398.db2.gz WJJYFYGOTJDBTQ-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)[NH+]1CCC(C(=O)NCc2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000174602745 1427253884 /nfs/dbraw/zinc/25/38/84/1427253884.db2.gz KAIXRPYGDUPGNF-KDURUIRLSA-N 2 1 387.568 3.032 20 0 GGADMP O=C(NCC1([NH+]2CCCCC2)CCOCC1)[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000174713800 1427326114 /nfs/dbraw/zinc/32/61/14/1427326114.db2.gz RIIPNRBQOHFFTP-QFIPXVFZSA-N 2 1 399.579 3.192 20 0 GGADMP O=C(NCC1([NH+]2CCCCC2)CCOCC1)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000174713800 1427326116 /nfs/dbraw/zinc/32/61/16/1427326116.db2.gz RIIPNRBQOHFFTP-QFIPXVFZSA-N 2 1 399.579 3.192 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000174960124 1427467700 /nfs/dbraw/zinc/46/77/00/1427467700.db2.gz USFUKVLTOMXWEN-FQEVSTJZSA-N 2 1 397.567 3.481 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000174960124 1427467704 /nfs/dbraw/zinc/46/77/04/1427467704.db2.gz USFUKVLTOMXWEN-FQEVSTJZSA-N 2 1 397.567 3.481 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000174960124 1427467710 /nfs/dbraw/zinc/46/77/10/1427467710.db2.gz USFUKVLTOMXWEN-FQEVSTJZSA-N 2 1 397.567 3.481 20 0 GGADMP C[C@H](C(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000174971643 1427473580 /nfs/dbraw/zinc/47/35/80/1427473580.db2.gz OLFHBNBCILOFGL-IFMALSPDSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@H](C(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000174971643 1427473583 /nfs/dbraw/zinc/47/35/83/1427473583.db2.gz OLFHBNBCILOFGL-IFMALSPDSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@H](C(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000174971643 1427473586 /nfs/dbraw/zinc/47/35/86/1427473586.db2.gz OLFHBNBCILOFGL-IFMALSPDSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@H](C(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000174971643 1427473587 /nfs/dbraw/zinc/47/35/87/1427473587.db2.gz OLFHBNBCILOFGL-IFMALSPDSA-N 2 1 391.559 3.414 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4ccc(F)cc43)c2)C1 ZINC000175008924 1427494793 /nfs/dbraw/zinc/49/47/93/1427494793.db2.gz ZKXTZSVEYQXHEV-SIKLNZKXSA-N 2 1 381.495 3.300 20 0 GGADMP COCCC[N@H+](C)CCNC(=O)Nc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000175216242 1427608508 /nfs/dbraw/zinc/60/85/08/1427608508.db2.gz HUXJVQDVTNEDQP-UHFFFAOYSA-N 2 1 387.528 3.145 20 0 GGADMP COCCC[N@@H+](C)CCNC(=O)Nc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000175216242 1427608515 /nfs/dbraw/zinc/60/85/15/1427608515.db2.gz HUXJVQDVTNEDQP-UHFFFAOYSA-N 2 1 387.528 3.145 20 0 GGADMP CCOc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000175302563 1427662211 /nfs/dbraw/zinc/66/22/11/1427662211.db2.gz MCVARKWGCLVTDS-JOCHJYFZSA-N 2 1 396.535 3.079 20 0 GGADMP CC[N@@H+]1CCC[C@@H]1CNC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175364728 1427709399 /nfs/dbraw/zinc/70/93/99/1427709399.db2.gz KJEQGRZKUZAHPV-HXUWFJFHSA-N 2 1 384.524 3.195 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175364728 1427709401 /nfs/dbraw/zinc/70/94/01/1427709401.db2.gz KJEQGRZKUZAHPV-HXUWFJFHSA-N 2 1 384.524 3.195 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000175364728 1427709404 /nfs/dbraw/zinc/70/94/04/1427709404.db2.gz KJEQGRZKUZAHPV-HXUWFJFHSA-N 2 1 384.524 3.195 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000175364728 1427709406 /nfs/dbraw/zinc/70/94/06/1427709406.db2.gz KJEQGRZKUZAHPV-HXUWFJFHSA-N 2 1 384.524 3.195 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000175418359 1427744384 /nfs/dbraw/zinc/74/43/84/1427744384.db2.gz MJBJQHXUSFQLCI-XMSQKQJNSA-N 2 1 384.568 3.213 20 0 GGADMP CC(C)[C@H]1C[N@H+](C)CCN1C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175454794 1427763575 /nfs/dbraw/zinc/76/35/75/1427763575.db2.gz TYVVMJDWZFATTO-JOCHJYFZSA-N 2 1 398.551 3.393 20 0 GGADMP CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175454794 1427763584 /nfs/dbraw/zinc/76/35/84/1427763584.db2.gz TYVVMJDWZFATTO-JOCHJYFZSA-N 2 1 398.551 3.393 20 0 GGADMP CC(C)[C@H]1C[NH+](C)CCN1C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000175454794 1427763592 /nfs/dbraw/zinc/76/35/92/1427763592.db2.gz TYVVMJDWZFATTO-JOCHJYFZSA-N 2 1 398.551 3.393 20 0 GGADMP CC(C)[C@H]1C[NH+](C)CCN1C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000175454794 1427763596 /nfs/dbraw/zinc/76/35/96/1427763596.db2.gz TYVVMJDWZFATTO-JOCHJYFZSA-N 2 1 398.551 3.393 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+]1CCC(C)CC1 ZINC000175477293 1427776826 /nfs/dbraw/zinc/77/68/26/1427776826.db2.gz MSVQDOODICELCK-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+]1CCC[C@H](C)C1 ZINC000175482478 1427779072 /nfs/dbraw/zinc/77/90/72/1427779072.db2.gz CIFQIRLWZFFQGV-RBBKRZOGSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@@H+]1CCC[C@H](C)C1 ZINC000175482478 1427779089 /nfs/dbraw/zinc/77/90/89/1427779089.db2.gz CIFQIRLWZFFQGV-RBBKRZOGSA-N 2 1 386.584 3.272 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@H+]1CCC[C@H](C)C1 ZINC000175482478 1427779108 /nfs/dbraw/zinc/77/91/08/1427779108.db2.gz CIFQIRLWZFFQGV-RBBKRZOGSA-N 2 1 386.584 3.272 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCCC[NH+]3C[C@@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000175485120 1427780655 /nfs/dbraw/zinc/78/06/55/1427780655.db2.gz GDWULOYDCDFRQA-OALUTQOASA-N 2 1 387.572 3.026 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N(CC)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000175554072 1427813022 /nfs/dbraw/zinc/81/30/22/1427813022.db2.gz JCBVULBAAAQMKP-FGZHOGPDSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(CC)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000175554072 1427813027 /nfs/dbraw/zinc/81/30/27/1427813027.db2.gz JCBVULBAAAQMKP-FGZHOGPDSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N(CC)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000175554072 1427813029 /nfs/dbraw/zinc/81/30/29/1427813029.db2.gz JCBVULBAAAQMKP-FGZHOGPDSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N(CC)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000175554093 1427813215 /nfs/dbraw/zinc/81/32/15/1427813215.db2.gz JCBVULBAAAQMKP-FCHUYYIVSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N(CC)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000175554093 1427813216 /nfs/dbraw/zinc/81/32/16/1427813216.db2.gz JCBVULBAAAQMKP-FCHUYYIVSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N(CC)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000175554093 1427813220 /nfs/dbraw/zinc/81/32/20/1427813220.db2.gz JCBVULBAAAQMKP-FCHUYYIVSA-N 2 1 386.584 3.272 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)NC2CC[NH+](C3CCCC3)CC2)C1 ZINC000175614441 1427832642 /nfs/dbraw/zinc/83/26/42/1427832642.db2.gz RENSWVVDWNGNIR-KDURUIRLSA-N 2 1 378.605 3.451 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1 ZINC000175863476 1427939752 /nfs/dbraw/zinc/93/97/52/1427939752.db2.gz JZRRDFRVAPAUKZ-NRFANRHFSA-N 2 1 395.551 3.202 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000175863476 1427939759 /nfs/dbraw/zinc/93/97/59/1427939759.db2.gz JZRRDFRVAPAUKZ-NRFANRHFSA-N 2 1 395.551 3.202 20 0 GGADMP CCOCc1cccc(NC(=O)N(CC[NH+](C)C)C[C@@H]2CCC[N@H+]2CC)c1 ZINC000175932119 1427980765 /nfs/dbraw/zinc/98/07/65/1427980765.db2.gz GVVAULMMWOZKCN-FQEVSTJZSA-N 2 1 376.545 3.103 20 0 GGADMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCC(C)(C)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000175963846 1428001168 /nfs/dbraw/zinc/00/11/68/1428001168.db2.gz RMTARQQEYDTYPQ-ZIFCJYIRSA-N 2 1 375.561 3.122 20 0 GGADMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCC(C)(C)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000175963846 1428001175 /nfs/dbraw/zinc/00/11/75/1428001175.db2.gz RMTARQQEYDTYPQ-ZIFCJYIRSA-N 2 1 375.561 3.122 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)cc1 ZINC000176054226 1428053081 /nfs/dbraw/zinc/05/30/81/1428053081.db2.gz ZFGRPWRFRCJCFQ-OAQYLSRUSA-N 2 1 385.483 3.369 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)cc1 ZINC000176054226 1428053090 /nfs/dbraw/zinc/05/30/90/1428053090.db2.gz ZFGRPWRFRCJCFQ-OAQYLSRUSA-N 2 1 385.483 3.369 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(-c2ccccc2)on1 ZINC000176202763 1428164586 /nfs/dbraw/zinc/16/45/86/1428164586.db2.gz ZVSWHKMFTPIQKH-GOSISDBHSA-N 2 1 385.512 3.221 20 0 GGADMP C[NH+](C)CCOc1cccc(CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)c1 ZINC000176205369 1428166941 /nfs/dbraw/zinc/16/69/41/1428166941.db2.gz CIVGYZKRDIXLOK-JOCHJYFZSA-N 2 1 399.510 3.047 20 0 GGADMP C[NH+](C)CCOc1cccc(CNC(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)c1 ZINC000176205369 1428166952 /nfs/dbraw/zinc/16/69/52/1428166952.db2.gz CIVGYZKRDIXLOK-JOCHJYFZSA-N 2 1 399.510 3.047 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2C)cn1 ZINC000180176481 1429782179 /nfs/dbraw/zinc/78/21/79/1429782179.db2.gz OARXCHLZSTYINE-MAUKXSAKSA-N 2 1 385.512 3.311 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)cn1 ZINC000180176770 1429782418 /nfs/dbraw/zinc/78/24/18/1429782418.db2.gz WEWRNZPAHGWFPD-QZTJIDSGSA-N 2 1 385.512 3.359 20 0 GGADMP CC(C)OCC[NH+]1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)CC1 ZINC000180276549 1429822089 /nfs/dbraw/zinc/82/20/89/1429822089.db2.gz QZCWMTMRILKYMZ-IHWFROFDSA-N 2 1 395.588 3.396 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000180300984 1429829777 /nfs/dbraw/zinc/82/97/77/1429829777.db2.gz PBOFXCAOTYIFIU-JZXOWHBKSA-N 2 1 378.586 3.303 20 0 GGADMP C[C@@H](NC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000180301000 1429829838 /nfs/dbraw/zinc/82/98/38/1429829838.db2.gz PBOFXCAOTYIFIU-NUJGCVRESA-N 2 1 378.586 3.303 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000180301924 1429830002 /nfs/dbraw/zinc/83/00/02/1429830002.db2.gz ZOHDXCWBFUEBFA-NSHGMRRFSA-N 2 1 388.556 3.369 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180313206 1429833792 /nfs/dbraw/zinc/83/37/92/1429833792.db2.gz CQWCOOUQIHPWML-GOSISDBHSA-N 2 1 387.572 3.108 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N(C)CCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180396975 1429856528 /nfs/dbraw/zinc/85/65/28/1429856528.db2.gz QDWGSRDAHNSRTK-HXUWFJFHSA-N 2 1 387.572 3.061 20 0 GGADMP COc1ccc(C(=O)NCC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000180425237 1429865883 /nfs/dbraw/zinc/86/58/83/1429865883.db2.gz SNDQXBZSPLKWCF-MRXNPFEDSA-N 2 1 378.476 3.270 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NCc1ccc(-n2ccnc2)cc1 ZINC000180475411 1429878216 /nfs/dbraw/zinc/87/82/16/1429878216.db2.gz DUEMVDONNODZAG-GOSISDBHSA-N 2 1 377.492 3.192 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3cn(C)nc3C(C)(C)C)CC2)C[C@H](C)O1 ZINC000180633453 1429944847 /nfs/dbraw/zinc/94/48/47/1429944847.db2.gz CNBAEKGGFYSOPR-HDICACEKSA-N 2 1 376.589 3.429 20 0 GGADMP CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000180665348 1429963878 /nfs/dbraw/zinc/96/38/78/1429963878.db2.gz RVCZBPNWIQCOJW-FQEVSTJZSA-N 2 1 390.597 3.082 20 0 GGADMP C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180739737 1430010307 /nfs/dbraw/zinc/01/03/07/1430010307.db2.gz DMYZBEPMVCDGMV-INIZCTEOSA-N 2 1 394.947 3.077 20 0 GGADMP C[C@@H](NC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000181413989 1430292159 /nfs/dbraw/zinc/29/21/59/1430292159.db2.gz DTPOUCLTEWPRBV-YSZBQJHXSA-N 2 1 389.584 3.046 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(N2CCCC2=O)c1 ZINC000181415051 1430292504 /nfs/dbraw/zinc/29/25/04/1430292504.db2.gz HCAYCTBMQMIFRV-WTOYTKOKSA-N 2 1 385.552 3.232 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@@H]21 ZINC000181431357 1430297265 /nfs/dbraw/zinc/29/72/65/1430297265.db2.gz NMIIGCHMYOJYOV-RXVVDRJESA-N 2 1 383.536 3.259 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@@H]21 ZINC000181431357 1430297269 /nfs/dbraw/zinc/29/72/69/1430297269.db2.gz NMIIGCHMYOJYOV-RXVVDRJESA-N 2 1 383.536 3.259 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCCCCN3C(=O)c4ccccc4C3=O)CC[C@@H]21 ZINC000181431357 1430297275 /nfs/dbraw/zinc/29/72/75/1430297275.db2.gz NMIIGCHMYOJYOV-RXVVDRJESA-N 2 1 383.536 3.259 20 0 GGADMP COCCc1nc(C)c([C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)s1 ZINC000181431569 1430297293 /nfs/dbraw/zinc/29/72/93/1430297293.db2.gz FKNLBEVKBQYLTP-CQSZACIVSA-N 2 1 389.569 3.367 20 0 GGADMP COCCc1nc(C)c([C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)s1 ZINC000181431552 1430297396 /nfs/dbraw/zinc/29/73/96/1430297396.db2.gz FKNLBEVKBQYLTP-AWEZNQCLSA-N 2 1 389.569 3.367 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000181499507 1430310964 /nfs/dbraw/zinc/31/09/64/1430310964.db2.gz MSINVJGPHPPGCY-GOSISDBHSA-N 2 1 398.555 3.171 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)C1 ZINC000181518645 1430314219 /nfs/dbraw/zinc/31/42/19/1430314219.db2.gz XEGSORKTPHXEJH-RBUKOAKNSA-N 2 1 393.597 3.245 20 0 GGADMP C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000181576574 1430322550 /nfs/dbraw/zinc/32/25/50/1430322550.db2.gz LSMPXYZXVDKJLW-GPMSIDNRSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000181576574 1430322553 /nfs/dbraw/zinc/32/25/53/1430322553.db2.gz LSMPXYZXVDKJLW-GPMSIDNRSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@@H](NC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000181630915 1430330931 /nfs/dbraw/zinc/33/09/31/1430330931.db2.gz RIWIABCTJKDPQM-KJXAQDMKSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@@H](NC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000181630915 1430330934 /nfs/dbraw/zinc/33/09/34/1430330934.db2.gz RIWIABCTJKDPQM-KJXAQDMKSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@@H](NC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000181630915 1430330937 /nfs/dbraw/zinc/33/09/37/1430330937.db2.gz RIWIABCTJKDPQM-KJXAQDMKSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@@H](NC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181630915 1430330941 /nfs/dbraw/zinc/33/09/41/1430330941.db2.gz RIWIABCTJKDPQM-KJXAQDMKSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000181630931 1430330976 /nfs/dbraw/zinc/33/09/76/1430330976.db2.gz RIWIABCTJKDPQM-IEIRFRATSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000181630931 1430330977 /nfs/dbraw/zinc/33/09/77/1430330977.db2.gz RIWIABCTJKDPQM-IEIRFRATSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000181630931 1430330979 /nfs/dbraw/zinc/33/09/79/1430330979.db2.gz RIWIABCTJKDPQM-IEIRFRATSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181630931 1430330982 /nfs/dbraw/zinc/33/09/82/1430330982.db2.gz RIWIABCTJKDPQM-IEIRFRATSA-N 2 1 399.579 3.047 20 0 GGADMP C[C@H](CCNC(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCCCC1 ZINC000181703361 1430344132 /nfs/dbraw/zinc/34/41/32/1430344132.db2.gz ZKSNUTLYUIDPKM-IRLDBZIGSA-N 2 1 386.584 3.115 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCSCC1)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000181806826 1430364487 /nfs/dbraw/zinc/36/44/87/1430364487.db2.gz GYYTVNPQRWPQQE-SFHVURJKSA-N 2 1 388.581 3.185 20 0 GGADMP CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1 ZINC000181972131 1430390430 /nfs/dbraw/zinc/39/04/30/1430390430.db2.gz NKFVMYXNGFVPHG-SFHVURJKSA-N 2 1 380.536 3.243 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCC[C@H](Cc2nccn2C)C1)C1CC[NH+](C)CC1 ZINC000182089012 1430409645 /nfs/dbraw/zinc/40/96/45/1430409645.db2.gz UIVDXCACFURKDC-HXUWFJFHSA-N 2 1 395.595 3.405 20 0 GGADMP C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000182215837 1430431393 /nfs/dbraw/zinc/43/13/93/1430431393.db2.gz OGFJMDJXDLQUSU-SQNIBIBYSA-N 2 1 376.570 3.011 20 0 GGADMP CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)cc1 ZINC000182242899 1430435877 /nfs/dbraw/zinc/43/58/77/1430435877.db2.gz SKJFNDSGNOFIDQ-UZUQRXQVSA-N 2 1 381.520 3.453 20 0 GGADMP COCc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)ccc1OC ZINC000182261541 1430438952 /nfs/dbraw/zinc/43/89/52/1430438952.db2.gz SNPOHQJPDSFWNE-JTSKRJEESA-N 2 1 384.520 3.259 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(N2CCOC2=O)cc1 ZINC000182263254 1430439337 /nfs/dbraw/zinc/43/93/37/1430439337.db2.gz GPMUIOXNDBGDNF-VGSWGCGISA-N 2 1 395.503 3.061 20 0 GGADMP COCCOc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1 ZINC000182263190 1430439375 /nfs/dbraw/zinc/43/93/75/1430439375.db2.gz SEVAGGNIWKBGGE-AVRDEDQJSA-N 2 1 384.520 3.129 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(-n2ccnc2)cc1 ZINC000182268537 1430440069 /nfs/dbraw/zinc/44/00/69/1430440069.db2.gz QGLUALXMFYLDRM-MBSDFSHPSA-N 2 1 376.504 3.290 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cnn(Cc2ccccc2)c1 ZINC000182268406 1430440181 /nfs/dbraw/zinc/44/01/81/1430440181.db2.gz OSWNKEGKTJVTGP-DVECYGJZSA-N 2 1 390.531 3.349 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)CC1 ZINC000182302377 1430445380 /nfs/dbraw/zinc/44/53/80/1430445380.db2.gz SGUIEGBXNZQKMC-IFMALSPDSA-N 2 1 384.568 3.085 20 0 GGADMP C[C@H](NC(=O)NCCC[N@@H+](C)Cc1ccccc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182376125 1430455452 /nfs/dbraw/zinc/45/54/52/1430455452.db2.gz AYSAREHKFUXIAH-PZJWPPBQSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+](C)Cc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182376125 1430455453 /nfs/dbraw/zinc/45/54/53/1430455453.db2.gz AYSAREHKFUXIAH-PZJWPPBQSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+](C)Cc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182376125 1430455455 /nfs/dbraw/zinc/45/54/55/1430455455.db2.gz AYSAREHKFUXIAH-PZJWPPBQSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@H](NC(=O)NCCC[N@H+]1CCc2ccccc2C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182401782 1430460760 /nfs/dbraw/zinc/46/07/60/1430460760.db2.gz QDWXSJOPDGNYOC-PZJWPPBQSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+]1CCc2ccccc2C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182401782 1430460765 /nfs/dbraw/zinc/46/07/65/1430460765.db2.gz QDWXSJOPDGNYOC-PZJWPPBQSA-N 2 1 398.595 3.387 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+]1CCc2ccccc2C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182401782 1430460769 /nfs/dbraw/zinc/46/07/69/1430460769.db2.gz QDWXSJOPDGNYOC-PZJWPPBQSA-N 2 1 398.595 3.387 20 0 GGADMP C[NH+](C)[C@H](C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)cc1)c1ccccc1 ZINC000182434856 1430467421 /nfs/dbraw/zinc/46/74/21/1430467421.db2.gz YHKCLDXOYWTTFY-QFIPXVFZSA-N 2 1 380.536 3.458 20 0 GGADMP C[NH+](C)[C@@H](C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)cc1)c1ccccc1 ZINC000182434835 1430467460 /nfs/dbraw/zinc/46/74/60/1430467460.db2.gz YHKCLDXOYWTTFY-JOCHJYFZSA-N 2 1 380.536 3.458 20 0 GGADMP CC[C@@H]([NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)c1c(C)noc1C ZINC000182509474 1430480506 /nfs/dbraw/zinc/48/05/06/1430480506.db2.gz VHHNJAPEGAOXPC-OAQYLSRUSA-N 2 1 398.551 3.421 20 0 GGADMP C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000182531295 1430484495 /nfs/dbraw/zinc/48/44/95/1430484495.db2.gz KEVIEGDNYSIAGQ-QUCCMNQESA-N 2 1 390.597 3.086 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cn1 ZINC000182548557 1430488812 /nfs/dbraw/zinc/48/88/12/1430488812.db2.gz XYZXATPSLISNIG-APWZRJJASA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cn1 ZINC000182548557 1430488818 /nfs/dbraw/zinc/48/88/18/1430488818.db2.gz XYZXATPSLISNIG-APWZRJJASA-N 2 1 396.539 3.028 20 0 GGADMP C[C@H](NC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182555900 1430490844 /nfs/dbraw/zinc/49/08/44/1430490844.db2.gz VFWBKDQIBHXUGR-CEXWTWQISA-N 2 1 378.605 3.449 20 0 GGADMP C[C@H](NC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182555900 1430490851 /nfs/dbraw/zinc/49/08/51/1430490851.db2.gz VFWBKDQIBHXUGR-CEXWTWQISA-N 2 1 378.605 3.449 20 0 GGADMP C[C@H](NC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182555900 1430490856 /nfs/dbraw/zinc/49/08/56/1430490856.db2.gz VFWBKDQIBHXUGR-CEXWTWQISA-N 2 1 378.605 3.449 20 0 GGADMP C[C@H](NC(=O)NCC[N@@H+]1CCc2sccc2C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182555024 1430491052 /nfs/dbraw/zinc/49/10/52/1430491052.db2.gz AMGGUULHLBAFRA-DLBZAZTESA-N 2 1 390.597 3.058 20 0 GGADMP C[C@H](NC(=O)NCC[N@H+]1CCc2sccc2C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182555024 1430491056 /nfs/dbraw/zinc/49/10/56/1430491056.db2.gz AMGGUULHLBAFRA-DLBZAZTESA-N 2 1 390.597 3.058 20 0 GGADMP C[C@H](NC(=O)NCC[NH+]1CCc2sccc2C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182555024 1430491060 /nfs/dbraw/zinc/49/10/60/1430491060.db2.gz AMGGUULHLBAFRA-DLBZAZTESA-N 2 1 390.597 3.058 20 0 GGADMP C[C@H](NC(=O)NCC[NH+]1CCc2sccc2C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182555024 1430491063 /nfs/dbraw/zinc/49/10/63/1430491063.db2.gz AMGGUULHLBAFRA-DLBZAZTESA-N 2 1 390.597 3.058 20 0 GGADMP C[C@H](NC(=O)NCC[N@@H+]1CCc2sccc2C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182555065 1430491107 /nfs/dbraw/zinc/49/11/07/1430491107.db2.gz AMGGUULHLBAFRA-IRXDYDNUSA-N 2 1 390.597 3.058 20 0 GGADMP C[C@H](NC(=O)NCC[N@H+]1CCc2sccc2C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182555065 1430491113 /nfs/dbraw/zinc/49/11/13/1430491113.db2.gz AMGGUULHLBAFRA-IRXDYDNUSA-N 2 1 390.597 3.058 20 0 GGADMP C[C@H](NC(=O)NCC[NH+]1CCc2sccc2C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182555065 1430491117 /nfs/dbraw/zinc/49/11/17/1430491117.db2.gz AMGGUULHLBAFRA-IRXDYDNUSA-N 2 1 390.597 3.058 20 0 GGADMP C[C@H](NC(=O)NCC[NH+]1CCc2sccc2C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182555065 1430491121 /nfs/dbraw/zinc/49/11/21/1430491121.db2.gz AMGGUULHLBAFRA-IRXDYDNUSA-N 2 1 390.597 3.058 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(-c2ncco2)cc1 ZINC000182578151 1430496425 /nfs/dbraw/zinc/49/64/25/1430496425.db2.gz OUQPBGSYWPQDHL-LJQANCHMSA-N 2 1 385.512 3.221 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1Nc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000182632580 1430506290 /nfs/dbraw/zinc/50/62/90/1430506290.db2.gz RNEGHJQYKFLIAE-XXBNENTESA-N 2 1 379.552 3.156 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](Cc2c(F)cccc2F)CC1 ZINC000182653812 1430510787 /nfs/dbraw/zinc/51/07/87/1430510787.db2.gz WZICHXREYXGWOJ-UHFFFAOYSA-N 2 1 379.495 3.169 20 0 GGADMP C[C@@H](CCNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCCCC1 ZINC000182712792 1430524615 /nfs/dbraw/zinc/52/46/15/1430524615.db2.gz YSCGEGDFXBWAHU-UNMCSNQZSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1nccn1C ZINC000182796648 1430541842 /nfs/dbraw/zinc/54/18/42/1430541842.db2.gz NTPFOXALBYOSKH-NRFANRHFSA-N 2 1 386.540 3.151 20 0 GGADMP CC[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1nccn1C ZINC000182796648 1430541848 /nfs/dbraw/zinc/54/18/48/1430541848.db2.gz NTPFOXALBYOSKH-NRFANRHFSA-N 2 1 386.540 3.151 20 0 GGADMP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCCC[C@@H]3S(C)(=O)=O)c2)CC1 ZINC000182841067 1430551348 /nfs/dbraw/zinc/55/13/48/1430551348.db2.gz MBWFIKPUKMCEJN-RTWAWAEBSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182856921 1430554611 /nfs/dbraw/zinc/55/46/11/1430554611.db2.gz TVPOXAKYTNPZJL-OALUTQOASA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182862674 1430555964 /nfs/dbraw/zinc/55/59/64/1430555964.db2.gz GVTVUHWCONFDNA-IRFCIJBXSA-N 2 1 376.589 3.299 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)o1 ZINC000182865962 1430556713 /nfs/dbraw/zinc/55/67/13/1430556713.db2.gz SVFAHKCXOPJFRL-RBUKOAKNSA-N 2 1 390.572 3.314 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)o1 ZINC000182865979 1430556766 /nfs/dbraw/zinc/55/67/66/1430556766.db2.gz SVFAHKCXOPJFRL-RTBURBONSA-N 2 1 390.572 3.314 20 0 GGADMP CS(=O)(=O)[C@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000182884793 1430561914 /nfs/dbraw/zinc/56/19/14/1430561914.db2.gz ROIHWAOJMNLHLO-UXHICEINSA-N 2 1 399.000 3.497 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182924572 1430573135 /nfs/dbraw/zinc/57/31/35/1430573135.db2.gz WRPRBIOWIXRIKC-PZJWPPBQSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182924572 1430573137 /nfs/dbraw/zinc/57/31/37/1430573137.db2.gz WRPRBIOWIXRIKC-PZJWPPBQSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H](NC(=O)N1CCC(CCC[NH+](C)C)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182939322 1430576407 /nfs/dbraw/zinc/57/64/07/1430576407.db2.gz PLBVHVNOSRMCPV-UYAOXDASSA-N 2 1 378.605 3.403 20 0 GGADMP C[C@H](NC(=O)N1CCC(CCC[NH+](C)C)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182939301 1430576496 /nfs/dbraw/zinc/57/64/96/1430576496.db2.gz PLBVHVNOSRMCPV-AZUAARDMSA-N 2 1 378.605 3.403 20 0 GGADMP c1ccc(C[N@@H+]2C[C@H]3CCC[C@H]([NH2+]CCc4nnc5n4CCCCC5)[C@@H]3C2)cc1 ZINC000183127405 1430622410 /nfs/dbraw/zinc/62/24/10/1430622410.db2.gz JYJQVRSHHWSGPY-VSKRKVRLSA-N 2 1 393.579 3.437 20 0 GGADMP COc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000183184508 1430642256 /nfs/dbraw/zinc/64/22/56/1430642256.db2.gz OYNNFVDVHWSWKE-XYJFISCASA-N 2 1 394.581 3.402 20 0 GGADMP COc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1S(C)(=O)=O ZINC000183184508 1430642261 /nfs/dbraw/zinc/64/22/61/1430642261.db2.gz OYNNFVDVHWSWKE-XYJFISCASA-N 2 1 394.581 3.402 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC[C@H]3C[NH+](C)CC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC000183224305 1430652219 /nfs/dbraw/zinc/65/22/19/1430652219.db2.gz MPCRDZLYZVQIAG-UVUJQTEASA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000183224305 1430652227 /nfs/dbraw/zinc/65/22/27/1430652227.db2.gz MPCRDZLYZVQIAG-UVUJQTEASA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000183224305 1430652235 /nfs/dbraw/zinc/65/22/35/1430652235.db2.gz MPCRDZLYZVQIAG-UVUJQTEASA-N 2 1 384.568 3.165 20 0 GGADMP C[NH+]1CCC(NC(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CC1 ZINC000183225547 1430652878 /nfs/dbraw/zinc/65/28/78/1430652878.db2.gz YDCKQAZHDSENMD-UHFFFAOYSA-N 2 1 399.366 3.351 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCC[C@@H](C2(C)OCCO2)C1)C1CC[NH+](C)CC1 ZINC000183237481 1430656338 /nfs/dbraw/zinc/65/63/38/1430656338.db2.gz VZKGOFVOUXZBKO-HXUWFJFHSA-N 2 1 387.568 3.192 20 0 GGADMP Cn1ccnc1[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)C1CC1 ZINC000183268169 1430665275 /nfs/dbraw/zinc/66/52/75/1430665275.db2.gz JRYIXXXKIJYXNH-QFIPXVFZSA-N 2 1 398.551 3.151 20 0 GGADMP Cn1ccnc1[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)C1CC1 ZINC000183268169 1430665281 /nfs/dbraw/zinc/66/52/81/1430665281.db2.gz JRYIXXXKIJYXNH-QFIPXVFZSA-N 2 1 398.551 3.151 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000183453753 1430715381 /nfs/dbraw/zinc/71/53/81/1430715381.db2.gz GSHQXDUCHFPTKS-QFIPXVFZSA-N 2 1 381.520 3.193 20 0 GGADMP COC(=O)c1cccc(NC(=O)C[C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000183623375 1430757046 /nfs/dbraw/zinc/75/70/46/1430757046.db2.gz VQOWABWEHKAOTM-ZWKOTPCHSA-N 2 1 389.540 3.148 20 0 GGADMP CC[N@H+](C)[C@H](C(=O)Nc1cccc(N2CC[NH+](CC)CC2)c1)c1ccccc1 ZINC000184261375 1430863932 /nfs/dbraw/zinc/86/39/32/1430863932.db2.gz WZVIAEIJRSQRNU-QFIPXVFZSA-N 2 1 380.536 3.460 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)Nc1cccc(N2CC[NH+](CC)CC2)c1)c1ccccc1 ZINC000184261375 1430863933 /nfs/dbraw/zinc/86/39/33/1430863933.db2.gz WZVIAEIJRSQRNU-QFIPXVFZSA-N 2 1 380.536 3.460 20 0 GGADMP COc1ccccc1S(=O)(=O)CCC[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000184405317 1430883896 /nfs/dbraw/zinc/88/38/96/1430883896.db2.gz PHDBSGMEJXMNQV-QZTJIDSGSA-N 2 1 394.581 3.102 20 0 GGADMP COc1ccccc1S(=O)(=O)CCC[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000184405317 1430883897 /nfs/dbraw/zinc/88/38/97/1430883897.db2.gz PHDBSGMEJXMNQV-QZTJIDSGSA-N 2 1 394.581 3.102 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1-n1nccc1C ZINC000184586754 1430910307 /nfs/dbraw/zinc/91/03/07/1430910307.db2.gz KQYQZZMREVLCBO-LJQANCHMSA-N 2 1 398.555 3.061 20 0 GGADMP CCN(C(=O)NC1CC[NH+](CC(C)C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000184599729 1430915071 /nfs/dbraw/zinc/91/50/71/1430915071.db2.gz BJQIMWHODSDLGJ-JOCHJYFZSA-N 2 1 386.584 3.413 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)[C@H](C)C1 ZINC000184670262 1430936783 /nfs/dbraw/zinc/93/67/83/1430936783.db2.gz PLONXNJIZJWFJR-KYJSFNMBSA-N 2 1 383.458 3.126 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)N1CCc2ccccc2C1 ZINC000184745872 1430963105 /nfs/dbraw/zinc/96/31/05/1430963105.db2.gz OFMGWLICYLINIZ-WOJBJXKFSA-N 2 1 391.559 3.318 20 0 GGADMP Cc1ccccc1CNC(=O)C[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000184744829 1430963384 /nfs/dbraw/zinc/96/33/84/1430963384.db2.gz PCPBLRIXEDFCGW-PMACEKPBSA-N 2 1 379.548 3.357 20 0 GGADMP COc1cccc(CNC(=O)C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000184747120 1430963968 /nfs/dbraw/zinc/96/39/68/1430963968.db2.gz JMELCSHWYJKMND-RTBURBONSA-N 2 1 395.547 3.058 20 0 GGADMP Cc1csc2nc(C[NH2+]C3[C@H](C)C[NH+](Cc4ccccc4)C[C@H]3C)cc(=O)n12 ZINC000184753251 1430966692 /nfs/dbraw/zinc/96/66/92/1430966692.db2.gz VYQRVXYXUNMJPK-HZPDHXFCSA-N 2 1 396.560 3.311 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)NCc1ccccc1F ZINC000184755188 1430967345 /nfs/dbraw/zinc/96/73/45/1430967345.db2.gz XJDKBVIHFOZHGG-QZTJIDSGSA-N 2 1 383.511 3.188 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1CSC ZINC000184813397 1430985369 /nfs/dbraw/zinc/98/53/69/1430985369.db2.gz CHVTXGBBROPOCJ-SFHVURJKSA-N 2 1 378.586 3.429 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1CSC ZINC000184813376 1430985675 /nfs/dbraw/zinc/98/56/75/1430985675.db2.gz CHVTXGBBROPOCJ-GOSISDBHSA-N 2 1 378.586 3.429 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2cccc(N3CC[NH+](CC)CC3)c2)C1 ZINC000184901425 1431016910 /nfs/dbraw/zinc/01/69/10/1431016910.db2.gz ARBKMRRWHHTGQO-LJQANCHMSA-N 2 1 387.572 3.024 20 0 GGADMP CC[NH+]1CCN(c2cccc(NC(=O)N3CCC[N@H+](C4CCCC4)CC3)c2)CC1 ZINC000184915086 1431020382 /nfs/dbraw/zinc/02/03/82/1431020382.db2.gz HDTIETZQTACJBA-UHFFFAOYSA-N 2 1 399.583 3.311 20 0 GGADMP CC[NH+]1CCN(c2cccc(NC(=O)N[C@H]3CC[N@@H+](CC4CCCC4)C3)c2)CC1 ZINC000184921270 1431022029 /nfs/dbraw/zinc/02/20/29/1431022029.db2.gz XFMUKDRCZJLAOF-NRFANRHFSA-N 2 1 399.583 3.215 20 0 GGADMP COc1cccc([C@H]2CCC[N@@H+]2CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000184929837 1431024009 /nfs/dbraw/zinc/02/40/09/1431024009.db2.gz BHMPWTGJJBDBMF-YADHBBJMSA-N 2 1 381.520 3.251 20 0 GGADMP COc1cccc([C@H]2CCC[N@H+]2CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000184929837 1431024014 /nfs/dbraw/zinc/02/40/14/1431024014.db2.gz BHMPWTGJJBDBMF-YADHBBJMSA-N 2 1 381.520 3.251 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C[N@H+](Cc1cccc(O)c1)CC1CC1)c1ccccc1 ZINC000184970619 1431033194 /nfs/dbraw/zinc/03/31/94/1431033194.db2.gz OMUBMZODHXJYGT-JOCHJYFZSA-N 2 1 381.520 3.023 20 0 GGADMP Cc1cccc(NC2CC[NH+](CC(=O)NC[C@H](c3ccccc3)[NH+](C)C)CC2)c1 ZINC000184987093 1431036831 /nfs/dbraw/zinc/03/68/31/1431036831.db2.gz NFVVSKUKQHPKDI-HSZRJFAPSA-N 2 1 394.563 3.290 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N(C)CC[N@@H+](C)C2CC2)c2cccs2)CC1 ZINC000185063239 1431052334 /nfs/dbraw/zinc/05/23/34/1431052334.db2.gz XYVIVMCENYJNBX-GOSISDBHSA-N 2 1 378.586 3.257 20 0 GGADMP CN(C)c1cc[nH+]cc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000185209899 1431085637 /nfs/dbraw/zinc/08/56/37/1431085637.db2.gz FBWYMPIYWFFCPH-UHFFFAOYSA-N 3 1 382.552 3.309 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000185309781 1431109073 /nfs/dbraw/zinc/10/90/73/1431109073.db2.gz AGOVUPLAEOIOGX-LAUBAEHRSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000185309781 1431109078 /nfs/dbraw/zinc/10/90/78/1431109078.db2.gz AGOVUPLAEOIOGX-LAUBAEHRSA-N 2 1 383.540 3.037 20 0 GGADMP O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1Cl ZINC000185322198 1431113640 /nfs/dbraw/zinc/11/36/40/1431113640.db2.gz YWCWNPYUSFMYID-QGZVFWFLSA-N 2 1 375.856 3.105 20 0 GGADMP C[N@@H+](CCOc1cccc(C[NH2+]Cc2cc(O)cc(F)c2)c1)C1CCOCC1 ZINC000185513165 1431162145 /nfs/dbraw/zinc/16/21/45/1431162145.db2.gz UZNUJTAFDCKEHV-UHFFFAOYSA-N 2 1 388.483 3.311 20 0 GGADMP OC1(c2ccccc2)CC[NH+](CCC[NH+]2CCC(O)(c3ccccc3)CC2)CC1 ZINC000185519194 1431163204 /nfs/dbraw/zinc/16/32/04/1431163204.db2.gz YYVYBFMYPRLSIW-UHFFFAOYSA-N 2 1 394.559 3.344 20 0 GGADMP C[NH+](C)CC1(CNC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CCCC1 ZINC000185564003 1431171211 /nfs/dbraw/zinc/17/12/11/1431171211.db2.gz LOISEIISDDNCQF-GOSISDBHSA-N 2 1 392.613 3.381 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)[NH+](C)C ZINC000185661639 1431199194 /nfs/dbraw/zinc/19/91/94/1431199194.db2.gz IIZUCSINHWSMHC-KRWDZBQOSA-N 2 1 386.462 3.044 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185685978 1431205905 /nfs/dbraw/zinc/20/59/05/1431205905.db2.gz ZVWKEIDVTDQFRP-MOPGFXCFSA-N 2 1 384.568 3.468 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185685978 1431205913 /nfs/dbraw/zinc/20/59/13/1431205913.db2.gz ZVWKEIDVTDQFRP-MOPGFXCFSA-N 2 1 384.568 3.468 20 0 GGADMP COc1ccc2c(c1)CCCN2C(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185689426 1431206422 /nfs/dbraw/zinc/20/64/22/1431206422.db2.gz VNCZXYPTDNETJF-PKOBYXMFSA-N 2 1 385.552 3.217 20 0 GGADMP COc1ccc2c(c1)CCCN2C(=O)C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185689426 1431206423 /nfs/dbraw/zinc/20/64/23/1431206423.db2.gz VNCZXYPTDNETJF-PKOBYXMFSA-N 2 1 385.552 3.217 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCCOC1CCCCC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185695347 1431208140 /nfs/dbraw/zinc/20/81/40/1431208140.db2.gz UYAYURCVIZQZCA-OALUTQOASA-N 2 1 379.589 3.085 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCCOC1CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185695347 1431208141 /nfs/dbraw/zinc/20/81/41/1431208141.db2.gz UYAYURCVIZQZCA-OALUTQOASA-N 2 1 379.589 3.085 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCCOC1CCCCC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185695333 1431208260 /nfs/dbraw/zinc/20/82/60/1431208260.db2.gz UYAYURCVIZQZCA-RTBURBONSA-N 2 1 379.589 3.085 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCCOC1CCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185695333 1431208265 /nfs/dbraw/zinc/20/82/65/1431208265.db2.gz UYAYURCVIZQZCA-RTBURBONSA-N 2 1 379.589 3.085 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185696063 1431208717 /nfs/dbraw/zinc/20/87/17/1431208717.db2.gz MXMZSVXMFFCYGU-HOCLYGCPSA-N 2 1 386.508 3.426 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185696063 1431208721 /nfs/dbraw/zinc/20/87/21/1431208721.db2.gz MXMZSVXMFFCYGU-HOCLYGCPSA-N 2 1 386.508 3.426 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185696029 1431208863 /nfs/dbraw/zinc/20/88/63/1431208863.db2.gz MXMZSVXMFFCYGU-GOEBONIOSA-N 2 1 386.508 3.426 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185696029 1431208868 /nfs/dbraw/zinc/20/88/68/1431208868.db2.gz MXMZSVXMFFCYGU-GOEBONIOSA-N 2 1 386.508 3.426 20 0 GGADMP Cc1cccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1C ZINC000185698166 1431209286 /nfs/dbraw/zinc/20/92/86/1431209286.db2.gz ZHMJLOIBXNVLGS-ROUUACIJSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1cccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1C ZINC000185698166 1431209296 /nfs/dbraw/zinc/20/92/96/1431209296.db2.gz ZHMJLOIBXNVLGS-ROUUACIJSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1cccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1C ZINC000185698145 1431209411 /nfs/dbraw/zinc/20/94/11/1431209411.db2.gz ZHMJLOIBXNVLGS-QZTJIDSGSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1cccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1C ZINC000185698145 1431209413 /nfs/dbraw/zinc/20/94/13/1431209413.db2.gz ZHMJLOIBXNVLGS-QZTJIDSGSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1cccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1C ZINC000185698183 1431209604 /nfs/dbraw/zinc/20/96/04/1431209604.db2.gz ZHMJLOIBXNVLGS-MSOLQXFVSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1cccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1C ZINC000185698183 1431209607 /nfs/dbraw/zinc/20/96/07/1431209607.db2.gz ZHMJLOIBXNVLGS-MSOLQXFVSA-N 2 1 386.540 3.194 20 0 GGADMP CCOc1ccc(OC[C@H](O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185717535 1431214569 /nfs/dbraw/zinc/21/45/69/1431214569.db2.gz LNUBQHIOKIPYPD-NLWGTHIKSA-N 2 1 376.541 3.068 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)C(=O)NCCc1ccc(F)cc1 ZINC000185720242 1431214940 /nfs/dbraw/zinc/21/49/40/1431214940.db2.gz BSPMAYAFMBHEDY-LNLFQRSKSA-N 2 1 375.532 3.116 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C(=O)NCCc1ccc(F)cc1 ZINC000185720242 1431214942 /nfs/dbraw/zinc/21/49/42/1431214942.db2.gz BSPMAYAFMBHEDY-LNLFQRSKSA-N 2 1 375.532 3.116 20 0 GGADMP C[C@@H]([NH2+]CCCOc1ccc(S(C)(=O)=O)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185724038 1431215875 /nfs/dbraw/zinc/21/58/75/1431215875.db2.gz CBFYSAHZDCWYIS-MSOLQXFVSA-N 2 1 394.581 3.102 20 0 GGADMP C[C@H]([NH2+]CCCOc1ccc(S(C)(=O)=O)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185724021 1431215891 /nfs/dbraw/zinc/21/58/91/1431215891.db2.gz CBFYSAHZDCWYIS-ROUUACIJSA-N 2 1 394.581 3.102 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000185741939 1431220393 /nfs/dbraw/zinc/22/03/93/1431220393.db2.gz MIINHHASKUSBMM-IKGGRYGDSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1OC ZINC000185741939 1431220396 /nfs/dbraw/zinc/22/03/96/1431220396.db2.gz MIINHHASKUSBMM-IKGGRYGDSA-N 2 1 389.540 3.273 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185740957 1431220417 /nfs/dbraw/zinc/22/04/17/1431220417.db2.gz UHOCLLFACFPBLO-HUUCEWRRSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185740957 1431220420 /nfs/dbraw/zinc/22/04/20/1431220420.db2.gz UHOCLLFACFPBLO-HUUCEWRRSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000185748029 1431222708 /nfs/dbraw/zinc/22/27/08/1431222708.db2.gz GQCLEYNUFOQIKX-LXGFNABISA-N 2 1 385.552 3.258 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000185748029 1431222710 /nfs/dbraw/zinc/22/27/10/1431222710.db2.gz GQCLEYNUFOQIKX-LXGFNABISA-N 2 1 385.552 3.258 20 0 GGADMP Cc1cccc(OCCCNC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185750517 1431223898 /nfs/dbraw/zinc/22/38/98/1431223898.db2.gz RHUWLWCFOPFLQY-UXHICEINSA-N 2 1 387.568 3.123 20 0 GGADMP Cc1cccc(OCCCNC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185750517 1431223910 /nfs/dbraw/zinc/22/39/10/1431223910.db2.gz RHUWLWCFOPFLQY-UXHICEINSA-N 2 1 387.568 3.123 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccccc1OC(F)F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185757188 1431226568 /nfs/dbraw/zinc/22/65/68/1431226568.db2.gz GFUQHYLMKJWAHJ-CABCVRRESA-N 2 1 381.467 3.469 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccccc1OC(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185757188 1431226575 /nfs/dbraw/zinc/22/65/75/1431226575.db2.gz GFUQHYLMKJWAHJ-CABCVRRESA-N 2 1 381.467 3.469 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+][C@@H](C)CCN3CC[NH+](C)CC3)cs2)cc1 ZINC000185865840 1431255878 /nfs/dbraw/zinc/25/58/78/1431255878.db2.gz CMASOLBGPZYFKG-SFHVURJKSA-N 2 1 388.581 3.146 20 0 GGADMP C[C@H](C[NH+]1CCCCCC1)NC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186108566 1431331813 /nfs/dbraw/zinc/33/18/13/1431331813.db2.gz JPNAFTKIUYNLGJ-IFMALSPDSA-N 2 1 386.584 3.414 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@H](C)C[NH+]3CCCCCC3)CC2)cs1 ZINC000186316845 1431380468 /nfs/dbraw/zinc/38/04/68/1431380468.db2.gz NFXRFJFGAYETCB-MRXNPFEDSA-N 2 1 378.586 3.044 20 0 GGADMP CC1(C)OCc2cc(C[NH2+]Cc3ccccc3C[NH+]3CCOCC3)ccc2O1 ZINC000186359805 1431391724 /nfs/dbraw/zinc/39/17/24/1431391724.db2.gz SGIYWKJQUOLWND-UHFFFAOYSA-N 2 1 382.504 3.454 20 0 GGADMP Cc1cnn([C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1NC(=O)c1ccc(C[NH3+])cc1 ZINC000186472180 1431429222 /nfs/dbraw/zinc/42/92/22/1431429222.db2.gz XAKIAQYHIZKJIH-OAQYLSRUSA-N 2 1 389.503 3.350 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(F)c(OC)cc1C ZINC000186812892 1431524720 /nfs/dbraw/zinc/52/47/20/1431524720.db2.gz ZNPYJQUZIXZBCV-MRXNPFEDSA-N 2 1 380.508 3.023 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)C1CCS(=O)(=O)CC1 ZINC000187010072 1431588889 /nfs/dbraw/zinc/58/88/89/1431588889.db2.gz VGESIBAHMISDCQ-ROUUACIJSA-N 2 1 378.582 3.221 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2c(C)cccc2C)[C@H](C)C1 ZINC000187014234 1431590464 /nfs/dbraw/zinc/59/04/64/1431590464.db2.gz HFOZFFUSFLZDPF-HSALFYBXSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2c(C)cccc2C)[C@H](C)C1 ZINC000187014234 1431590466 /nfs/dbraw/zinc/59/04/66/1431590466.db2.gz HFOZFFUSFLZDPF-HSALFYBXSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000187015331 1431590778 /nfs/dbraw/zinc/59/07/78/1431590778.db2.gz FOCWKZKJJRUUIF-WKRCXCSHSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000187015331 1431590783 /nfs/dbraw/zinc/59/07/83/1431590783.db2.gz FOCWKZKJJRUUIF-WKRCXCSHSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N2CCCc3ccccc32)[C@H](C)C1 ZINC000187022001 1431592204 /nfs/dbraw/zinc/59/22/04/1431592204.db2.gz NLFDYSMPYNDBCQ-DYXWJJEUSA-N 2 1 387.568 3.081 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N2CCCc3ccccc32)[C@H](C)C1 ZINC000187022001 1431592214 /nfs/dbraw/zinc/59/22/14/1431592214.db2.gz NLFDYSMPYNDBCQ-DYXWJJEUSA-N 2 1 387.568 3.081 20 0 GGADMP Cc1cc(Br)cc([C@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)c1O ZINC000187164528 1431635351 /nfs/dbraw/zinc/63/53/51/1431635351.db2.gz COVBMFSLZXWQIJ-HNNXBMFYSA-N 2 1 398.389 3.387 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)[C@@H](c1ccccc1)[NH+](C)C ZINC000187176745 1431638198 /nfs/dbraw/zinc/63/81/98/1431638198.db2.gz BEKPNZMCXGPNMS-KWOQKUFVSA-N 2 1 395.547 3.085 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@@H](c1ccccc1)[NH+](C)C ZINC000187176745 1431638206 /nfs/dbraw/zinc/63/82/06/1431638206.db2.gz BEKPNZMCXGPNMS-KWOQKUFVSA-N 2 1 395.547 3.085 20 0 GGADMP Cc1cc(Br)cc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)c1O ZINC000187190701 1431641768 /nfs/dbraw/zinc/64/17/68/1431641768.db2.gz OTJCATBRLTZXAE-GOEBONIOSA-N 2 1 385.346 3.351 20 0 GGADMP C[N@@H+](Cc1ccccc1NC(=O)NCC[NH+]1CCCOCC1)C1CCCCC1 ZINC000187456376 1431735800 /nfs/dbraw/zinc/73/58/00/1431735800.db2.gz WWIUJKCBXKRTAU-UHFFFAOYSA-N 2 1 388.556 3.295 20 0 GGADMP C[NH+](Cc1ccccc1NC(=O)NCC[N@@H+]1CCCOCC1)C1CCCCC1 ZINC000187456376 1431735803 /nfs/dbraw/zinc/73/58/03/1431735803.db2.gz WWIUJKCBXKRTAU-UHFFFAOYSA-N 2 1 388.556 3.295 20 0 GGADMP C[NH+](Cc1ccccc1NC(=O)NCC[N@H+]1CCCOCC1)C1CCCCC1 ZINC000187456376 1431735807 /nfs/dbraw/zinc/73/58/07/1431735807.db2.gz WWIUJKCBXKRTAU-UHFFFAOYSA-N 2 1 388.556 3.295 20 0 GGADMP CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000187478151 1431743977 /nfs/dbraw/zinc/74/39/77/1431743977.db2.gz DKSDJZYKJQPODZ-FGZHOGPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC1(C)OCc2cc(C[NH2+]Cc3ccccc3C[N@H+]3CC[C@@H](O)C3)ccc2O1 ZINC000187512330 1431753069 /nfs/dbraw/zinc/75/30/69/1431753069.db2.gz INOPBFHKMCOWEN-OAQYLSRUSA-N 2 1 382.504 3.188 20 0 GGADMP C[C@@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)C1CCS(=O)(=O)CC1 ZINC000187521424 1431755242 /nfs/dbraw/zinc/75/52/42/1431755242.db2.gz UUNXZWMRHWABCX-QGZVFWFLSA-N 2 1 393.597 3.090 20 0 GGADMP C[C@H](Cc1ccccc1F)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000187801926 1431814254 /nfs/dbraw/zinc/81/42/54/1431814254.db2.gz UCLROAOWBOGSLF-GOSISDBHSA-N 2 1 399.510 3.207 20 0 GGADMP C[C@H](C[N@@H+]1CCC[C@H](C)C1)[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000187826790 1431817129 /nfs/dbraw/zinc/81/71/29/1431817129.db2.gz INFBWLKACDACCB-FKAKGIQBSA-N 2 1 383.536 3.304 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000187826790 1431817130 /nfs/dbraw/zinc/81/71/30/1431817130.db2.gz INFBWLKACDACCB-FKAKGIQBSA-N 2 1 383.536 3.304 20 0 GGADMP Cc1nccnc1[C@H](C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000187943769 1431829971 /nfs/dbraw/zinc/82/99/71/1431829971.db2.gz VAZGUBYZGRCHGA-SFHVURJKSA-N 2 1 384.524 3.125 20 0 GGADMP Cc1nccnc1[C@H](C)[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000187943769 1431829972 /nfs/dbraw/zinc/82/99/72/1431829972.db2.gz VAZGUBYZGRCHGA-SFHVURJKSA-N 2 1 384.524 3.125 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1)c1ccco1 ZINC000188172436 1431856529 /nfs/dbraw/zinc/85/65/29/1431856529.db2.gz SPRPBSGTWAMDAC-VQTJNVASSA-N 2 1 384.524 3.092 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1)c1ccco1 ZINC000188172436 1431856531 /nfs/dbraw/zinc/85/65/31/1431856531.db2.gz SPRPBSGTWAMDAC-VQTJNVASSA-N 2 1 384.524 3.092 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1)c1ccco1 ZINC000188172410 1431856553 /nfs/dbraw/zinc/85/65/53/1431856553.db2.gz SPRPBSGTWAMDAC-PMACEKPBSA-N 2 1 384.524 3.092 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1)c1ccco1 ZINC000188172410 1431856555 /nfs/dbraw/zinc/85/65/55/1431856555.db2.gz SPRPBSGTWAMDAC-PMACEKPBSA-N 2 1 384.524 3.092 20 0 GGADMP C[C@@]1(Cc2ccccc2)CCN(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)C1=O ZINC000188692290 1431935324 /nfs/dbraw/zinc/93/53/24/1431935324.db2.gz IOVUKZMHGKZCDP-DEOSSOPVSA-N 2 1 399.579 3.002 20 0 GGADMP C[C@H]1C[NH+](CC2CC[NH+](Cc3ccn(-c4ccccc4F)n3)CC2)C[C@H](C)O1 ZINC000188932367 1432011425 /nfs/dbraw/zinc/01/14/25/1432011425.db2.gz BESUCCCEKAEXOD-ROUUACIJSA-N 2 1 386.515 3.333 20 0 GGADMP CC(C)[C@@H](C[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1)[NH+]1CCCC1 ZINC000189030778 1432030257 /nfs/dbraw/zinc/03/02/57/1432030257.db2.gz ZTYJNVWZQBRNSI-WIXQSORDSA-N 2 1 383.536 3.304 20 0 GGADMP C[NH+](C)CCOc1ccccc1C[NH2+]Cc1cnn(Cc2ccc(F)cc2)c1 ZINC000189098866 1432045005 /nfs/dbraw/zinc/04/50/05/1432045005.db2.gz SOSBKUJKSVNILR-UHFFFAOYSA-N 2 1 382.483 3.301 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000189144783 1432051931 /nfs/dbraw/zinc/05/19/31/1432051931.db2.gz BRCOHZRLPQEZFX-FAEJEUNOSA-N 2 1 380.492 3.025 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3cnn(Cc4ccc(F)cc4)c3)CC2)nc(C)[nH+]1 ZINC000189274250 1432076119 /nfs/dbraw/zinc/07/61/19/1432076119.db2.gz YKEPQCIQHZMVPD-UHFFFAOYSA-N 2 1 394.498 3.236 20 0 GGADMP CN(CC1([NH+](C)C)CCC1)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000189754088 1432224289 /nfs/dbraw/zinc/22/42/89/1432224289.db2.gz UVTARNAVAMBGKA-QGZVFWFLSA-N 2 1 378.586 3.086 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)N(C)Cc1ccccc1 ZINC000189950574 1432286957 /nfs/dbraw/zinc/28/69/57/1432286957.db2.gz GXFJJDMHEYKUBX-WOJBJXKFSA-N 2 1 379.548 3.391 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(=O)oc3c(C)c(O)ccc23)[C@H](C)C1 ZINC000190000892 1432302319 /nfs/dbraw/zinc/30/23/19/1432302319.db2.gz QDFIXMVYLIXWKW-DNVCBOLYSA-N 2 1 388.508 3.034 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(=O)oc3c(C)c(O)ccc23)[C@H](C)C1 ZINC000190000892 1432302325 /nfs/dbraw/zinc/30/23/25/1432302325.db2.gz QDFIXMVYLIXWKW-DNVCBOLYSA-N 2 1 388.508 3.034 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000190004865 1432302839 /nfs/dbraw/zinc/30/28/39/1432302839.db2.gz UNJXKVAVGONJTE-UWVAXJGDSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000190004865 1432302842 /nfs/dbraw/zinc/30/28/42/1432302842.db2.gz UNJXKVAVGONJTE-UWVAXJGDSA-N 2 1 395.975 3.244 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)NC[C@H](C)[N@@H+]1CCc2sccc2C1 ZINC000190129775 1432324894 /nfs/dbraw/zinc/32/48/94/1432324894.db2.gz WPKPTPAYBYYAOO-KRWDZBQOSA-N 2 1 378.586 3.012 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)NC[C@H](C)[N@H+]1CCc2sccc2C1 ZINC000190129775 1432324896 /nfs/dbraw/zinc/32/48/96/1432324896.db2.gz WPKPTPAYBYYAOO-KRWDZBQOSA-N 2 1 378.586 3.012 20 0 GGADMP C[NH+](C)Cc1cccc(NC(=O)NC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1 ZINC000190420077 1432378285 /nfs/dbraw/zinc/37/82/85/1432378285.db2.gz LKVCRBJDRXSLEF-JOCHJYFZSA-N 2 1 396.535 3.161 20 0 GGADMP CC(C)N(C)c1ccc(C[NH2+]Cc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)cn1 ZINC000190869127 1432514610 /nfs/dbraw/zinc/51/46/10/1432514610.db2.gz RIHFJVRRNUGCEJ-LJQANCHMSA-N 2 1 382.552 3.437 20 0 GGADMP CC(C)N(C)c1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)cn1 ZINC000190869127 1432514615 /nfs/dbraw/zinc/51/46/15/1432514615.db2.gz RIHFJVRRNUGCEJ-LJQANCHMSA-N 2 1 382.552 3.437 20 0 GGADMP CCOC(=O)C1CCC(O)(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)CC1 ZINC000190892187 1432521462 /nfs/dbraw/zinc/52/14/62/1432521462.db2.gz MJLODTVIBUGZMX-YDPTZXBUSA-N 2 1 380.573 3.057 20 0 GGADMP CCOC(=O)C1CCC(O)(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)CC1 ZINC000190892187 1432521466 /nfs/dbraw/zinc/52/14/66/1432521466.db2.gz MJLODTVIBUGZMX-YDPTZXBUSA-N 2 1 380.573 3.057 20 0 GGADMP CCOC(=O)C1CCC(O)(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)CC1 ZINC000190892187 1432521472 /nfs/dbraw/zinc/52/14/72/1432521472.db2.gz MJLODTVIBUGZMX-YDPTZXBUSA-N 2 1 380.573 3.057 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NC[C@@H]1C[NH+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000190981112 1432542728 /nfs/dbraw/zinc/54/27/28/1432542728.db2.gz LMMXCNJJAMRMSU-PKTZIBPZSA-N 2 1 395.547 3.087 20 0 GGADMP CC[NH+](C)[C@H](C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000190981112 1432542732 /nfs/dbraw/zinc/54/27/32/1432542732.db2.gz LMMXCNJJAMRMSU-PKTZIBPZSA-N 2 1 395.547 3.087 20 0 GGADMP CC[NH+](C)[C@H](C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1ccccc1 ZINC000190981112 1432542735 /nfs/dbraw/zinc/54/27/35/1432542735.db2.gz LMMXCNJJAMRMSU-PKTZIBPZSA-N 2 1 395.547 3.087 20 0 GGADMP CCCN(CCC[NH+](C)C)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000191338668 1432636573 /nfs/dbraw/zinc/63/65/73/1432636573.db2.gz VBIWGYPXMCTSKA-UHFFFAOYSA-N 2 1 378.586 3.431 20 0 GGADMP COc1ccc([C@@H]2CCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)cc1OC ZINC000191391555 1432649749 /nfs/dbraw/zinc/64/97/49/1432649749.db2.gz IDWRGRURFWUEKW-FQEVSTJZSA-N 2 1 375.557 3.257 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000191473717 1432668135 /nfs/dbraw/zinc/66/81/35/1432668135.db2.gz DNIYHHMDBNPRMF-UHFFFAOYSA-N 3 1 386.628 3.247 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)Nc1ccc(OC)c(OC)c1 ZINC000191490814 1432671193 /nfs/dbraw/zinc/67/11/93/1432671193.db2.gz QINKSHWREMHBQA-MRXNPFEDSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc(OC)c(OC)c1 ZINC000191490814 1432671200 /nfs/dbraw/zinc/67/12/00/1432671200.db2.gz QINKSHWREMHBQA-MRXNPFEDSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000191509009 1432675924 /nfs/dbraw/zinc/67/59/24/1432675924.db2.gz XNJANLIABBWWDS-PKOBYXMFSA-N 2 1 384.524 3.186 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000191509009 1432675931 /nfs/dbraw/zinc/67/59/31/1432675931.db2.gz XNJANLIABBWWDS-PKOBYXMFSA-N 2 1 384.524 3.186 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CCN(c3ccc(F)cc3Cl)CC2)CC1 ZINC000191597876 1432689353 /nfs/dbraw/zinc/68/93/53/1432689353.db2.gz BJVDTNLSQUDNQD-UHFFFAOYSA-N 2 1 382.955 3.017 20 0 GGADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC1 ZINC000191646063 1432699673 /nfs/dbraw/zinc/69/96/73/1432699673.db2.gz JPUHLRSKNMVKDF-LJQANCHMSA-N 2 1 379.495 3.308 20 0 GGADMP CCOC(=O)c1oc2c(c1C)[C@H]([NH2+]CCCCN1CC[NH+](CC)CC1)CCC2 ZINC000192666068 1432873083 /nfs/dbraw/zinc/87/30/83/1432873083.db2.gz TVFBOVPBGOOVBM-GOSISDBHSA-N 2 1 391.556 3.149 20 0 GGADMP CCOC(=O)c1oc2c(c1C)[C@@H]([NH2+]CCCCN1CC[NH+](CC)CC1)CCC2 ZINC000192666088 1432873105 /nfs/dbraw/zinc/87/31/05/1432873105.db2.gz TVFBOVPBGOOVBM-SFHVURJKSA-N 2 1 391.556 3.149 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000192719740 1432879441 /nfs/dbraw/zinc/87/94/41/1432879441.db2.gz UZGTWIGIVAOEEA-UHFFFAOYSA-N 2 1 392.547 3.140 20 0 GGADMP COc1cccc(C[N@@H+](CCCN2CC[NH+](C(C)C)CC2)C[C@H]2CCCO2)c1 ZINC000192725588 1432880416 /nfs/dbraw/zinc/88/04/16/1432880416.db2.gz JJWJVILFSRHVBS-HSZRJFAPSA-N 2 1 389.584 3.092 20 0 GGADMP COc1cc(C[N@@H+](C)CCCN2CC[NH+](C(C)C)CC2)c(SC)cc1OC ZINC000192745504 1432883908 /nfs/dbraw/zinc/88/39/08/1432883908.db2.gz ZUQGTGDMMWWEPV-UHFFFAOYSA-N 2 1 395.613 3.274 20 0 GGADMP O=C(Nc1ccnn1[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CC[NH+](C2CC2)CC1 ZINC000192763074 1432886456 /nfs/dbraw/zinc/88/64/56/1432886456.db2.gz UHKNUBMGDPMUDF-OAQYLSRUSA-N 2 1 393.535 3.143 20 0 GGADMP CCC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)CC(=O)Nc1ccc(Cl)cc1 ZINC000192768620 1432887709 /nfs/dbraw/zinc/88/77/09/1432887709.db2.gz ATNPRFPEYMZCBB-UHFFFAOYSA-N 2 1 394.991 3.407 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](CC(=O)Nc2ccc(F)cc2)C(C)(C)C)CC1 ZINC000192773393 1432888437 /nfs/dbraw/zinc/88/84/37/1432888437.db2.gz SBKHAHLZZDJARS-UHFFFAOYSA-N 2 1 392.563 3.281 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)NC(=O)OC(C)(C)C ZINC000192953463 1432912280 /nfs/dbraw/zinc/91/22/80/1432912280.db2.gz NFKJFAKMYXDRQJ-INIZCTEOSA-N 2 1 379.520 3.335 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000193005598 1432920719 /nfs/dbraw/zinc/92/07/19/1432920719.db2.gz WPMSPTMESMJMAB-FQEVSTJZSA-N 2 1 399.501 3.495 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000193005598 1432920724 /nfs/dbraw/zinc/92/07/24/1432920724.db2.gz WPMSPTMESMJMAB-FQEVSTJZSA-N 2 1 399.501 3.495 20 0 GGADMP CCC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](CC)C3CC3)c(OCC)c2)CC1 ZINC000193168377 1432949430 /nfs/dbraw/zinc/94/94/30/1432949430.db2.gz YXFFUNFRLZVCKD-UHFFFAOYSA-N 2 1 388.556 3.040 20 0 GGADMP C[C@H](CNC(=O)NCc1ccc(C[NH+](C)C)cc1)[N@@H+]1CCc2sccc2C1 ZINC000193187864 1432954056 /nfs/dbraw/zinc/95/40/56/1432954056.db2.gz FDNMAQJOABPOOV-MRXNPFEDSA-N 2 1 386.565 3.056 20 0 GGADMP C[C@H](CNC(=O)NCc1ccc(C[NH+](C)C)cc1)[N@H+]1CCc2sccc2C1 ZINC000193187864 1432954061 /nfs/dbraw/zinc/95/40/61/1432954061.db2.gz FDNMAQJOABPOOV-MRXNPFEDSA-N 2 1 386.565 3.056 20 0 GGADMP FC(F)(F)c1cccc(N2CC[NH+](CCCC[NH2+]Cc3csnn3)CC2)c1 ZINC000193380940 1432988307 /nfs/dbraw/zinc/98/83/07/1432988307.db2.gz SYEMEPCFPBTWNO-UHFFFAOYSA-N 2 1 399.486 3.249 20 0 GGADMP CC(C)(C)[NH+]1CCC(NC(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000193836201 1433069693 /nfs/dbraw/zinc/06/96/93/1433069693.db2.gz UJKXLCRXSDTIJV-UHFFFAOYSA-N 2 1 386.584 3.385 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]CCSCc3ccccc3)c2)C1 ZINC000193907605 1433082515 /nfs/dbraw/zinc/08/25/15/1433082515.db2.gz RJRJFMOBQKQWDC-QFIPXVFZSA-N 2 1 397.588 3.407 20 0 GGADMP CC[N@H+](CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)Cc1ccc(OC)cc1 ZINC000193910445 1433082830 /nfs/dbraw/zinc/08/28/30/1433082830.db2.gz VWTDQPVBINYVNG-UHFFFAOYSA-N 2 1 395.547 3.429 20 0 GGADMP CC[N@@H+](CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)Cc1ccc(OC)cc1 ZINC000193910445 1433082835 /nfs/dbraw/zinc/08/28/35/1433082835.db2.gz VWTDQPVBINYVNG-UHFFFAOYSA-N 2 1 395.547 3.429 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000193927780 1433086572 /nfs/dbraw/zinc/08/65/72/1433086572.db2.gz RHMOGFHCWDSOBB-OALUTQOASA-N 2 1 386.565 3.172 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000193929687 1433086781 /nfs/dbraw/zinc/08/67/81/1433086781.db2.gz ZVJWHHCVGOHNSD-KNQAVFIVSA-N 2 1 398.526 3.250 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000194020648 1433102163 /nfs/dbraw/zinc/10/21/63/1433102163.db2.gz LDBFMVQHRPPRIH-UNMCSNQZSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCCNC(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000194020648 1433102166 /nfs/dbraw/zinc/10/21/66/1433102166.db2.gz LDBFMVQHRPPRIH-UNMCSNQZSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCCNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194020648 1433102167 /nfs/dbraw/zinc/10/21/67/1433102167.db2.gz LDBFMVQHRPPRIH-UNMCSNQZSA-N 2 1 386.584 3.462 20 0 GGADMP O=C(NC1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000194051258 1433107624 /nfs/dbraw/zinc/10/76/24/1433107624.db2.gz DHSPDFRJOVLUIP-DEOSSOPVSA-N 2 1 391.559 3.474 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000194106590 1433118567 /nfs/dbraw/zinc/11/85/67/1433118567.db2.gz FHOQJCHTURJERF-NHCUHLMSSA-N 2 1 398.551 3.484 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CC[NH+](C2CCCC2)CC1 ZINC000194226065 1433143208 /nfs/dbraw/zinc/14/32/08/1433143208.db2.gz ZCWUGRUXZGXUPL-HXUWFJFHSA-N 2 1 384.568 3.215 20 0 GGADMP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000194413570 1433174131 /nfs/dbraw/zinc/17/41/31/1433174131.db2.gz OJGAMHVXZUGARE-OAQYLSRUSA-N 2 1 376.504 3.323 20 0 GGADMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000194413570 1433174133 /nfs/dbraw/zinc/17/41/33/1433174133.db2.gz OJGAMHVXZUGARE-OAQYLSRUSA-N 2 1 376.504 3.323 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000194414497 1433174501 /nfs/dbraw/zinc/17/45/01/1433174501.db2.gz OKDKZKJFRLAZDV-VXKWHMMOSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000194449018 1433179864 /nfs/dbraw/zinc/17/98/64/1433179864.db2.gz IINXCDVZRAPBAX-FCHUYYIVSA-N 2 1 384.568 3.168 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NC3CC[NH+](CC4CCCC4)CC3)CC2)[nH+]c1 ZINC000194523018 1433191633 /nfs/dbraw/zinc/19/16/33/1433191633.db2.gz PWSVFEPAJMCQBX-UHFFFAOYSA-N 2 1 384.568 3.377 20 0 GGADMP Cc1cccn2cc(COc3ccc(C[NH+]4C[C@H]5C[N@H+](C)C[C@H]5C4)cc3)nc12 ZINC000194535989 1433193928 /nfs/dbraw/zinc/19/39/28/1433193928.db2.gz GGLFUDGAJXYQSK-BGYRXZFFSA-N 2 1 376.504 3.215 20 0 GGADMP Cc1cccn2cc(COc3ccc(C[NH+]4C[C@H]5C[N@@H+](C)C[C@H]5C4)cc3)nc12 ZINC000194535989 1433193931 /nfs/dbraw/zinc/19/39/31/1433193931.db2.gz GGLFUDGAJXYQSK-BGYRXZFFSA-N 2 1 376.504 3.215 20 0 GGADMP Cc1cccn2cc(COc3ccc(C[N@@H+]4C[C@H]5C[NH+](C)C[C@H]5C4)cc3)nc12 ZINC000194535989 1433193934 /nfs/dbraw/zinc/19/39/34/1433193934.db2.gz GGLFUDGAJXYQSK-BGYRXZFFSA-N 2 1 376.504 3.215 20 0 GGADMP Cc1cccn2cc(COc3ccc(C[N@H+]4C[C@H]5C[NH+](C)C[C@H]5C4)cc3)nc12 ZINC000194535989 1433193937 /nfs/dbraw/zinc/19/39/37/1433193937.db2.gz GGLFUDGAJXYQSK-BGYRXZFFSA-N 2 1 376.504 3.215 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCSCC1)NC1CC[NH+](CC2CC2)CC1 ZINC000194647079 1433210707 /nfs/dbraw/zinc/21/07/07/1433210707.db2.gz ADUTXWQMIYHWOJ-UHFFFAOYSA-N 2 1 388.581 3.231 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)C1CC[NH+](C2CC2)CC1 ZINC000194808999 1433237577 /nfs/dbraw/zinc/23/75/77/1433237577.db2.gz YUCPKZJIVOCOOG-OAQYLSRUSA-N 2 1 385.552 3.080 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)CC1 ZINC000194958054 1433272332 /nfs/dbraw/zinc/27/23/32/1433272332.db2.gz UADBDYWPJXCUNJ-INIZCTEOSA-N 2 1 378.586 3.058 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)CC1 ZINC000194958054 1433272333 /nfs/dbraw/zinc/27/23/33/1433272333.db2.gz UADBDYWPJXCUNJ-INIZCTEOSA-N 2 1 378.586 3.058 20 0 GGADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000195136950 1433297726 /nfs/dbraw/zinc/29/77/26/1433297726.db2.gz SAKUSQFROFNARG-HKUYNNGSSA-N 2 1 387.549 3.231 20 0 GGADMP C[N@H+](CC(=O)N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)Cc1ccccc1 ZINC000195295370 1433316117 /nfs/dbraw/zinc/31/61/17/1433316117.db2.gz XRHKBDATAMVAQN-OAQYLSRUSA-N 2 1 393.531 3.223 20 0 GGADMP C[N@@H+](CC(=O)N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)Cc1ccccc1 ZINC000195295370 1433316119 /nfs/dbraw/zinc/31/61/19/1433316119.db2.gz XRHKBDATAMVAQN-OAQYLSRUSA-N 2 1 393.531 3.223 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(OC2CCCC2)CC1 ZINC000195325498 1433319427 /nfs/dbraw/zinc/31/94/27/1433319427.db2.gz XIXROCWJGYVEPH-TZIWHRDSSA-N 2 1 399.579 3.189 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(OC2CCCC2)CC1 ZINC000195325498 1433319429 /nfs/dbraw/zinc/31/94/29/1433319429.db2.gz XIXROCWJGYVEPH-TZIWHRDSSA-N 2 1 399.579 3.189 20 0 GGADMP O=C(C[NH+]1CCC(OC2CCCC2)CC1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000195328063 1433319780 /nfs/dbraw/zinc/31/97/80/1433319780.db2.gz VHGYPYXRDFULJT-UHFFFAOYSA-N 2 1 399.579 3.322 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@H](c2nccs2)C1 ZINC000195342342 1433320853 /nfs/dbraw/zinc/32/08/53/1433320853.db2.gz UBYZFMMKLYUOFJ-YZGWKJHDSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000195342342 1433320856 /nfs/dbraw/zinc/32/08/56/1433320856.db2.gz UBYZFMMKLYUOFJ-YZGWKJHDSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC[C@H](c2nccs2)C1 ZINC000195342342 1433320859 /nfs/dbraw/zinc/32/08/59/1433320859.db2.gz UBYZFMMKLYUOFJ-YZGWKJHDSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@H](c2nccs2)C1 ZINC000195342342 1433320862 /nfs/dbraw/zinc/32/08/62/1433320862.db2.gz UBYZFMMKLYUOFJ-YZGWKJHDSA-N 2 1 398.576 3.102 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)[nH+]c1 ZINC000195380834 1433324114 /nfs/dbraw/zinc/32/41/14/1433324114.db2.gz MDNBGSJBUKEOQX-UHFFFAOYSA-N 2 1 387.503 3.105 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000228923479 1433371334 /nfs/dbraw/zinc/37/13/34/1433371334.db2.gz OBVDZTFTIBZNRM-UFYCRDLUSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1c(C(=O)Nc2cccc3c2C[N@@H+](CCC(C)C)C3)nnn1C1CC[NH2+]CC1 ZINC000236721823 1433376958 /nfs/dbraw/zinc/37/69/58/1433376958.db2.gz HHMUZZYEBBDUAL-UHFFFAOYSA-N 2 1 396.539 3.125 20 0 GGADMP C[NH2+]C[C@H](C)C(=O)Nc1ccccc1C[N@@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000237069319 1433387890 /nfs/dbraw/zinc/38/78/90/1433387890.db2.gz ZFEUFIJBHMPCRJ-INIZCTEOSA-N 2 1 397.519 3.056 20 0 GGADMP C[NH2+]C[C@H](C)C(=O)Nc1ccccc1C[N@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000237069319 1433387892 /nfs/dbraw/zinc/38/78/92/1433387892.db2.gz ZFEUFIJBHMPCRJ-INIZCTEOSA-N 2 1 397.519 3.056 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]CCCN2CC[N@H+](C)C[C@@H]2c2ccccc2)o1 ZINC000237082083 1433388460 /nfs/dbraw/zinc/38/84/60/1433388460.db2.gz SBWBZNPXMDLQMQ-OAQYLSRUSA-N 2 1 393.535 3.447 20 0 GGADMP C[N@@H+](CCOc1cccc(C[NH2+]Cc2cnc3ccccn23)c1)C1CCOCC1 ZINC000237205660 1433392649 /nfs/dbraw/zinc/39/26/49/1433392649.db2.gz ULHXXMMHKAHJPZ-UHFFFAOYSA-N 2 1 394.519 3.114 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)C1(c2ccccc2)CC[NH2+]CC1 ZINC000237241398 1433394011 /nfs/dbraw/zinc/39/40/11/1433394011.db2.gz UZWVDVFENKPMIP-JOCHJYFZSA-N 2 1 391.559 3.288 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(OC)c1 ZINC000237294258 1433396168 /nfs/dbraw/zinc/39/61/68/1433396168.db2.gz UOSSQZQFSRQJSR-FGTMMUONSA-N 2 1 391.556 3.379 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)[C@@H]1Cc2ccccc2C[NH2+]1 ZINC000237520578 1433407775 /nfs/dbraw/zinc/40/77/75/1433407775.db2.gz JZTDUWNJRGMRDJ-MBSDFSHPSA-N 2 1 377.532 3.392 20 0 GGADMP C[C@@]1(C(=O)N2CCC[N@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CCCC[NH2+]1 ZINC000237546482 1433408792 /nfs/dbraw/zinc/40/87/92/1433408792.db2.gz VLYPUYQYTMUOFB-IBGZPJMESA-N 2 1 383.458 3.272 20 0 GGADMP C[C@@]1(C(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CCCC[NH2+]1 ZINC000237546482 1433408793 /nfs/dbraw/zinc/40/87/93/1433408793.db2.gz VLYPUYQYTMUOFB-IBGZPJMESA-N 2 1 383.458 3.272 20 0 GGADMP C[C@H](CC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)C1CC[NH2+]CC1 ZINC000237554471 1433409234 /nfs/dbraw/zinc/40/92/34/1433409234.db2.gz ANYLXYNMKKAPIW-QGZVFWFLSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@H](CC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)C1CC[NH2+]CC1 ZINC000237554471 1433409235 /nfs/dbraw/zinc/40/92/35/1433409235.db2.gz ANYLXYNMKKAPIW-QGZVFWFLSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)[C@@H]([NH3+])c1ccccc1 ZINC000237619004 1433413273 /nfs/dbraw/zinc/41/32/73/1433413273.db2.gz HSAJRAGZEWCNQW-ISJRUSPKSA-N 2 1 395.547 3.248 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1)[C@@H]([NH3+])c1ccccc1 ZINC000237619004 1433413277 /nfs/dbraw/zinc/41/32/77/1433413277.db2.gz HSAJRAGZEWCNQW-ISJRUSPKSA-N 2 1 395.547 3.248 20 0 GGADMP Cc1nn(Cc2ccccc2)c(Cl)c1C[NH2+]CCCC[N@H+]1CCC[C@H]1CO ZINC000237654886 1433414929 /nfs/dbraw/zinc/41/49/29/1433414929.db2.gz CHHPKWBZMWAKFI-IBGZPJMESA-N 2 1 390.959 3.220 20 0 GGADMP Cc1nn(Cc2ccccc2)c(Cl)c1C[NH2+]CCCC[N@H+]1CCC[C@@H]1CO ZINC000237654845 1433415020 /nfs/dbraw/zinc/41/50/20/1433415020.db2.gz CHHPKWBZMWAKFI-LJQANCHMSA-N 2 1 390.959 3.220 20 0 GGADMP O=C(CC1C[C@H]2CC[C@@H](C1)[NH2+]2)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000237687177 1433417047 /nfs/dbraw/zinc/41/70/47/1433417047.db2.gz NGMCQPZIPRWYIH-CTXDPNEZSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC1C[C@H]2CC[C@@H](C1)[NH2+]2)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000237687177 1433417052 /nfs/dbraw/zinc/41/70/52/1433417052.db2.gz NGMCQPZIPRWYIH-CTXDPNEZSA-N 2 1 375.944 3.295 20 0 GGADMP Cc1ccc(NC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000237701162 1433417739 /nfs/dbraw/zinc/41/77/39/1433417739.db2.gz CJWRCVDNFISCDT-LMNJBCLMSA-N 2 1 398.551 3.279 20 0 GGADMP Cc1nn(C)c2ncc(C[NH2+]Cc3ccc(C[N@H+]4C[C@@H](C)O[C@@H](C)C4)cc3)cc12 ZINC000237783819 1433423664 /nfs/dbraw/zinc/42/36/64/1433423664.db2.gz CIHITMWGSBWZDO-CALCHBBNSA-N 2 1 393.535 3.176 20 0 GGADMP N[C@@H](C(=O)NC[C@H](c1c(F)cccc1Cl)N1CCCC1)c1ccccc1 ZINC000237823047 1433426198 /nfs/dbraw/zinc/42/61/98/1433426198.db2.gz PPFBDFWNFUAWRN-IEBWSBKVSA-N 2 1 375.875 3.432 20 0 GGADMP [NH3+]CC1(C(=O)NC[C@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CCCC1 ZINC000237826823 1433426594 /nfs/dbraw/zinc/42/65/94/1433426594.db2.gz KMUDHHACIMVPHU-LJQANCHMSA-N 2 1 383.561 3.483 20 0 GGADMP [NH3+]CC1(C(=O)NC[C@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CCCC1 ZINC000237826823 1433426595 /nfs/dbraw/zinc/42/65/95/1433426595.db2.gz KMUDHHACIMVPHU-LJQANCHMSA-N 2 1 383.561 3.483 20 0 GGADMP [NH3+][C@@H](CC(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1)c1ccccc1 ZINC000237913095 1433434007 /nfs/dbraw/zinc/43/40/07/1433434007.db2.gz LXVXJRFEDOFFAH-NRFANRHFSA-N 2 1 392.503 3.002 20 0 GGADMP [NH3+]Cc1ccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)cc1 ZINC000237990825 1433438153 /nfs/dbraw/zinc/43/81/53/1433438153.db2.gz NBISKXGUICJSID-SFHVURJKSA-N 2 1 377.410 3.168 20 0 GGADMP [NH3+]Cc1nc(C(=O)NCCCC[NH+]2CCC(Cc3ccccc3)CC2)cs1 ZINC000238033228 1433439897 /nfs/dbraw/zinc/43/98/97/1433439897.db2.gz QGCXGAUDXDGKRD-UHFFFAOYSA-N 2 1 386.565 3.067 20 0 GGADMP O=C(CC1CC[NH2+]CC1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000238132762 1433444048 /nfs/dbraw/zinc/44/40/48/1433444048.db2.gz NRHRDNATSPZPHM-UHFFFAOYSA-N 2 1 377.532 3.310 20 0 GGADMP CC[NH+](CC)CCNC(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000242982105 1433448103 /nfs/dbraw/zinc/44/81/03/1433448103.db2.gz HRLQXOBWEOSNPN-UHFFFAOYSA-N 2 1 394.563 3.445 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000245201218 1433455017 /nfs/dbraw/zinc/45/50/17/1433455017.db2.gz GKYMTZVJHCTPDV-RMJJICAUSA-N 2 1 385.552 3.352 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000245392605 1433458885 /nfs/dbraw/zinc/45/88/85/1433458885.db2.gz ULYCVFDFVRIYBO-CEXWTWQISA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000245392605 1433458887 /nfs/dbraw/zinc/45/88/87/1433458887.db2.gz ULYCVFDFVRIYBO-CEXWTWQISA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000245392605 1433458890 /nfs/dbraw/zinc/45/88/90/1433458890.db2.gz ULYCVFDFVRIYBO-CEXWTWQISA-N 2 1 392.613 3.380 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000245421845 1433464508 /nfs/dbraw/zinc/46/45/08/1433464508.db2.gz IFBKMLUDAIFCEG-OALUTQOASA-N 2 1 390.597 3.087 20 0 GGADMP CC(C)[N@@H+]1CCC[C@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245427926 1433466153 /nfs/dbraw/zinc/46/61/53/1433466153.db2.gz WLQGCTSCMLOBJE-TZIWHRDSSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245427926 1433466154 /nfs/dbraw/zinc/46/61/54/1433466154.db2.gz WLQGCTSCMLOBJE-TZIWHRDSSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000245427926 1433466155 /nfs/dbraw/zinc/46/61/55/1433466155.db2.gz WLQGCTSCMLOBJE-TZIWHRDSSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000245427926 1433466156 /nfs/dbraw/zinc/46/61/56/1433466156.db2.gz WLQGCTSCMLOBJE-TZIWHRDSSA-N 2 1 375.532 3.417 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(Cc2ccc(CN3CC[C@@H](C[N@H+](C)CC)C3)cc2)C1 ZINC000245441429 1433468203 /nfs/dbraw/zinc/46/82/03/1433468203.db2.gz HJADEWMYNFNGKX-ZEQRLZLVSA-N 4 1 386.628 3.234 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459816 1433472635 /nfs/dbraw/zinc/47/26/35/1433472635.db2.gz VMVGMAQIALBXEH-VQTJNVASSA-N 2 1 384.520 3.492 20 0 GGADMP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459816 1433472637 /nfs/dbraw/zinc/47/26/37/1433472637.db2.gz VMVGMAQIALBXEH-VQTJNVASSA-N 2 1 384.520 3.492 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459816 1433472641 /nfs/dbraw/zinc/47/26/41/1433472641.db2.gz VMVGMAQIALBXEH-VQTJNVASSA-N 2 1 384.520 3.492 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459816 1433472644 /nfs/dbraw/zinc/47/26/44/1433472644.db2.gz VMVGMAQIALBXEH-VQTJNVASSA-N 2 1 384.520 3.492 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459816 1433472648 /nfs/dbraw/zinc/47/26/48/1433472648.db2.gz VMVGMAQIALBXEH-VQTJNVASSA-N 2 1 384.520 3.492 20 0 GGADMP COc1cccc([C@H]2[C@H](NC(=O)CN(C)Cc3ccccc3)CC[N@H+]2C2CC2)c1 ZINC000245535119 1433481774 /nfs/dbraw/zinc/48/17/74/1433481774.db2.gz FHBFBMBWQLSMOU-VWNXMTODSA-N 2 1 393.531 3.221 20 0 GGADMP COc1cccc([C@H]2[C@H](NC(=O)CN(C)Cc3ccccc3)CCN2C2CC2)c1 ZINC000245535119 1433481777 /nfs/dbraw/zinc/48/17/77/1433481777.db2.gz FHBFBMBWQLSMOU-VWNXMTODSA-N 2 1 393.531 3.221 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CN[C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)C1 ZINC000245559800 1433485085 /nfs/dbraw/zinc/48/50/85/1433485085.db2.gz MIOXADDNIBJDKB-DUXKGJEZSA-N 2 1 379.976 3.422 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1Nc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000245566988 1433486192 /nfs/dbraw/zinc/48/61/92/1433486192.db2.gz RNEGHJQYKFLIAE-AUSIDOKSSA-N 2 1 379.552 3.156 20 0 GGADMP C[C@@H]1CC[N@H+]([C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C[C@@H]1n1ccnc1 ZINC000245600624 1433489739 /nfs/dbraw/zinc/48/97/39/1433489739.db2.gz MIETWTNQLDUGIK-BVGQSLNGSA-N 2 1 376.863 3.364 20 0 GGADMP C[C@@H]1CCN([C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C[C@@H]1n1ccnc1 ZINC000245600624 1433489740 /nfs/dbraw/zinc/48/97/40/1433489740.db2.gz MIETWTNQLDUGIK-BVGQSLNGSA-N 2 1 376.863 3.364 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000245639990 1433494101 /nfs/dbraw/zinc/49/41/01/1433494101.db2.gz DCHVEVSJNTUGGX-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000245639990 1433494102 /nfs/dbraw/zinc/49/41/02/1433494102.db2.gz DCHVEVSJNTUGGX-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000245639990 1433494103 /nfs/dbraw/zinc/49/41/03/1433494103.db2.gz DCHVEVSJNTUGGX-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP CC(C)[NH+](C)CCNC(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245655109 1433496301 /nfs/dbraw/zinc/49/63/01/1433496301.db2.gz DHKTZMMJHJRFQW-YJBOKZPZSA-N 2 1 384.927 3.111 20 0 GGADMP CC(C)[NH+](C)CCNC(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245655109 1433496302 /nfs/dbraw/zinc/49/63/02/1433496302.db2.gz DHKTZMMJHJRFQW-YJBOKZPZSA-N 2 1 384.927 3.111 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000245669970 1433497368 /nfs/dbraw/zinc/49/73/68/1433497368.db2.gz FGLUUYIMZAFCJX-URVUXULASA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000245669970 1433497371 /nfs/dbraw/zinc/49/73/71/1433497371.db2.gz FGLUUYIMZAFCJX-URVUXULASA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000245669970 1433497374 /nfs/dbraw/zinc/49/73/74/1433497374.db2.gz FGLUUYIMZAFCJX-URVUXULASA-N 2 1 386.584 3.270 20 0 GGADMP C[NH+]=C(NCc1ccco1)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245669754 1433497440 /nfs/dbraw/zinc/49/74/40/1433497440.db2.gz HSBRGYHRZCWULA-KSSFIOAISA-N 2 1 378.879 3.430 20 0 GGADMP C[C@H](Oc1ccccc1)C(=O)N(C)[C@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000245702378 1433502609 /nfs/dbraw/zinc/50/26/09/1433502609.db2.gz LOXQYFNIUOOLTE-BWAGFHJFSA-N 2 1 387.568 3.250 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)NC[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)C1 ZINC000245732674 1433507568 /nfs/dbraw/zinc/50/75/68/1433507568.db2.gz UDIITGUTTGWWAY-GPMSIDNRSA-N 2 1 396.938 3.208 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CNC(=O)NC[C@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245763114 1433514030 /nfs/dbraw/zinc/51/40/30/1433514030.db2.gz ZVVQVQJJUPMXMU-MDZRGWNJSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NC[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245763114 1433514031 /nfs/dbraw/zinc/51/40/31/1433514031.db2.gz ZVVQVQJJUPMXMU-MDZRGWNJSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC[C@@H]1CNC(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245763114 1433514032 /nfs/dbraw/zinc/51/40/32/1433514032.db2.gz ZVVQVQJJUPMXMU-MDZRGWNJSA-N 2 1 396.938 3.255 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1)c1ccccc1 ZINC000245837204 1433523959 /nfs/dbraw/zinc/52/39/59/1433523959.db2.gz DKSMWZIZTGSMAE-FYYLOGMGSA-N 2 1 379.548 3.360 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000245837204 1433523966 /nfs/dbraw/zinc/52/39/66/1433523966.db2.gz DKSMWZIZTGSMAE-FYYLOGMGSA-N 2 1 379.548 3.360 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000245837204 1433523974 /nfs/dbraw/zinc/52/39/74/1433523974.db2.gz DKSMWZIZTGSMAE-FYYLOGMGSA-N 2 1 379.548 3.360 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)[C@H](C(C)C)[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000245840016 1433524763 /nfs/dbraw/zinc/52/47/63/1433524763.db2.gz YMKDUZGUJSBTPI-SBHAEUEKSA-N 2 1 381.605 3.091 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)[C@H](C(C)C)[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000245840016 1433524764 /nfs/dbraw/zinc/52/47/64/1433524764.db2.gz YMKDUZGUJSBTPI-SBHAEUEKSA-N 2 1 381.605 3.091 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000245859017 1433528478 /nfs/dbraw/zinc/52/84/78/1433528478.db2.gz BJKZDVFHVXGWJO-UVUJQTEASA-N 2 1 384.568 3.308 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000245859017 1433528479 /nfs/dbraw/zinc/52/84/79/1433528479.db2.gz BJKZDVFHVXGWJO-UVUJQTEASA-N 2 1 384.568 3.308 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000245859017 1433528481 /nfs/dbraw/zinc/52/84/81/1433528481.db2.gz BJKZDVFHVXGWJO-UVUJQTEASA-N 2 1 384.568 3.308 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)[NH+]2CCCC2)cc1 ZINC000245883738 1433533978 /nfs/dbraw/zinc/53/39/78/1433533978.db2.gz BJRPSJNXXCDJBL-VSKRKVRLSA-N 2 1 384.568 3.258 20 0 GGADMP CCC[C@H]1CN(C(=O)[C@H]2CCC[NH+]2C2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000245895251 1433536777 /nfs/dbraw/zinc/53/67/77/1433536777.db2.gz MXIDJWFOFMWZOY-XZOQPEGZSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@H]1CN(C(=O)[C@H]2CCC[NH+]2C2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000245895251 1433536784 /nfs/dbraw/zinc/53/67/84/1433536784.db2.gz MXIDJWFOFMWZOY-XZOQPEGZSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@H]1CN(C(=O)[C@H]2CCC[N@@H+]2C2CCOCC2)CC[NH+]1Cc1ccccc1 ZINC000245895251 1433536791 /nfs/dbraw/zinc/53/67/91/1433536791.db2.gz MXIDJWFOFMWZOY-XZOQPEGZSA-N 2 1 399.579 3.143 20 0 GGADMP CCC[C@H]1CN(C(=O)[C@H]2CCC[N@H+]2C2CCOCC2)CC[NH+]1Cc1ccccc1 ZINC000245895251 1433536794 /nfs/dbraw/zinc/53/67/94/1433536794.db2.gz MXIDJWFOFMWZOY-XZOQPEGZSA-N 2 1 399.579 3.143 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+]([C@H](C)c3ccncc3)CC2)C1 ZINC000245921498 1433543663 /nfs/dbraw/zinc/54/36/63/1433543663.db2.gz GQYBVWUZETWVKM-MOPGFXCFSA-N 2 1 387.572 3.027 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000245934450 1433546523 /nfs/dbraw/zinc/54/65/23/1433546523.db2.gz IUVAVILXLFFPFL-CMKODMSKSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CC[C@@H]2[C@@H](CCCN2C(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000245934450 1433546525 /nfs/dbraw/zinc/54/65/25/1433546525.db2.gz IUVAVILXLFFPFL-CMKODMSKSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CC[C@@H]2[C@@H](CCCN2C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000245934450 1433546527 /nfs/dbraw/zinc/54/65/27/1433546527.db2.gz IUVAVILXLFFPFL-CMKODMSKSA-N 2 1 390.597 3.086 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+]([C@H](C)c2ccncc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000245945970 1433548857 /nfs/dbraw/zinc/54/88/57/1433548857.db2.gz NVEFXRXRTFUFDA-GUDVDZBRSA-N 2 1 387.572 3.027 20 0 GGADMP C[C@H](c1cn(-c2ccccc2)nn1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000245988094 1433554298 /nfs/dbraw/zinc/55/42/98/1433554298.db2.gz FRLDJTLVENEUQL-GUDVDZBRSA-N 2 1 383.540 3.150 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21)c1ccccc1Cl ZINC000245993574 1433554816 /nfs/dbraw/zinc/55/48/16/1433554816.db2.gz RAEZAJZBXSPNAY-IPELMVKDSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21)c1ccccc1Cl ZINC000245993574 1433554819 /nfs/dbraw/zinc/55/48/19/1433554819.db2.gz RAEZAJZBXSPNAY-IPELMVKDSA-N 2 1 378.948 3.068 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21 ZINC000246018190 1433558393 /nfs/dbraw/zinc/55/83/93/1433558393.db2.gz URMMKMJIYJNVGC-GTWWNFFPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000246018190 1433558395 /nfs/dbraw/zinc/55/83/95/1433558395.db2.gz URMMKMJIYJNVGC-GTWWNFFPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21 ZINC000246018190 1433558397 /nfs/dbraw/zinc/55/83/97/1433558397.db2.gz URMMKMJIYJNVGC-GTWWNFFPSA-N 2 1 398.595 3.269 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)CC1 ZINC000246019473 1433558492 /nfs/dbraw/zinc/55/84/92/1433558492.db2.gz UUCMURUJYKVNOL-KAGYGMCKSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000246024649 1433558777 /nfs/dbraw/zinc/55/87/77/1433558777.db2.gz LSMPXYZXVDKJLW-GJYPPUQNSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000246024649 1433558783 /nfs/dbraw/zinc/55/87/83/1433558783.db2.gz LSMPXYZXVDKJLW-GJYPPUQNSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCCC[C@H]2S(C)(=O)=O)C1 ZINC000246041578 1433560592 /nfs/dbraw/zinc/56/05/92/1433560592.db2.gz NZUMESYTYITNCV-DUXKGJEZSA-N 2 1 378.582 3.364 20 0 GGADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+]([C@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000246111660 1433570277 /nfs/dbraw/zinc/57/02/77/1433570277.db2.gz XNNRBIPBRIVHQE-RDJZCZTQSA-N 2 1 375.479 3.126 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+]([C@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000246111660 1433570282 /nfs/dbraw/zinc/57/02/82/1433570282.db2.gz XNNRBIPBRIVHQE-RDJZCZTQSA-N 2 1 375.479 3.126 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[NH+]2C ZINC000246113354 1433570596 /nfs/dbraw/zinc/57/05/96/1433570596.db2.gz HWYXEQDRFPUNDD-QIJUGHKUSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000246113354 1433570601 /nfs/dbraw/zinc/57/06/01/1433570601.db2.gz HWYXEQDRFPUNDD-QIJUGHKUSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000246113354 1433570605 /nfs/dbraw/zinc/57/06/05/1433570605.db2.gz HWYXEQDRFPUNDD-QIJUGHKUSA-N 2 1 384.568 3.439 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[NH+]1C1CC1 ZINC000246135209 1433573114 /nfs/dbraw/zinc/57/31/14/1433573114.db2.gz BHRYCJULUIGJSK-HROGELHOSA-N 2 1 384.568 3.306 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[NH+]1C1CC1 ZINC000246135209 1433573117 /nfs/dbraw/zinc/57/31/17/1433573117.db2.gz BHRYCJULUIGJSK-HROGELHOSA-N 2 1 384.568 3.306 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000246139998 1433573728 /nfs/dbraw/zinc/57/37/28/1433573728.db2.gz JLMMMDIDAMSHSJ-ZWKOTPCHSA-N 2 1 378.586 3.401 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@H]1CCSc2ccccc21 ZINC000246177413 1433578186 /nfs/dbraw/zinc/57/81/86/1433578186.db2.gz LQCITPQNKPRXIP-HKUYNNGSSA-N 2 1 390.597 3.281 20 0 GGADMP Clc1cccc(N2CCN(CCC[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CC2)c1 ZINC000246229751 1433584356 /nfs/dbraw/zinc/58/43/56/1433584356.db2.gz FUHUPEWWFPNSMZ-CTNGQTDRSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCN[C@@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)c1 ZINC000246229751 1433584359 /nfs/dbraw/zinc/58/43/59/1433584359.db2.gz FUHUPEWWFPNSMZ-CTNGQTDRSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCN[C@@H]3CC[N@H+]4CCC[C@H]4C3)CC2)c1 ZINC000246229751 1433584362 /nfs/dbraw/zinc/58/43/62/1433584362.db2.gz FUHUPEWWFPNSMZ-CTNGQTDRSA-N 2 1 376.976 3.069 20 0 GGADMP CC(C)C[C@@H](CNC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+](C)C ZINC000246285471 1433589673 /nfs/dbraw/zinc/58/96/73/1433589673.db2.gz AHFUYKSITHKVIJ-UEXGIBASSA-N 2 1 375.557 3.002 20 0 GGADMP CC(C)C[C@@H](CNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+](C)C ZINC000246285471 1433589678 /nfs/dbraw/zinc/58/96/78/1433589678.db2.gz AHFUYKSITHKVIJ-UEXGIBASSA-N 2 1 375.557 3.002 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246288146 1433590033 /nfs/dbraw/zinc/59/00/33/1433590033.db2.gz AQEPNOXGBZKVOV-SBHAEUEKSA-N 2 1 386.584 3.126 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)C1 ZINC000246290954 1433590367 /nfs/dbraw/zinc/59/03/67/1433590367.db2.gz DFLVCIRKEKWUEB-CEXWTWQISA-N 2 1 376.545 3.178 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)C1 ZINC000246290954 1433590370 /nfs/dbraw/zinc/59/03/70/1433590370.db2.gz DFLVCIRKEKWUEB-CEXWTWQISA-N 2 1 376.545 3.178 20 0 GGADMP C[N@@H+](CCCNC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)C1CCCCC1 ZINC000246298921 1433591569 /nfs/dbraw/zinc/59/15/69/1433591569.db2.gz IYZHQYDHJZEEMV-RXVVDRJESA-N 2 1 376.589 3.299 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C1CCCCC1 ZINC000246298921 1433591572 /nfs/dbraw/zinc/59/15/72/1433591572.db2.gz IYZHQYDHJZEEMV-RXVVDRJESA-N 2 1 376.589 3.299 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C1CCCCC1 ZINC000246298921 1433591574 /nfs/dbraw/zinc/59/15/74/1433591574.db2.gz IYZHQYDHJZEEMV-RXVVDRJESA-N 2 1 376.589 3.299 20 0 GGADMP C[N@@H+](CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)C1CCCCC1 ZINC000246298900 1433591648 /nfs/dbraw/zinc/59/16/48/1433591648.db2.gz IYZHQYDHJZEEMV-GHTZIAJQSA-N 2 1 376.589 3.299 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C1CCCCC1 ZINC000246298900 1433591653 /nfs/dbraw/zinc/59/16/53/1433591653.db2.gz IYZHQYDHJZEEMV-GHTZIAJQSA-N 2 1 376.589 3.299 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C1CCCCC1 ZINC000246298900 1433591657 /nfs/dbraw/zinc/59/16/57/1433591657.db2.gz IYZHQYDHJZEEMV-GHTZIAJQSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000246311465 1433593056 /nfs/dbraw/zinc/59/30/56/1433593056.db2.gz DTPOUCLTEWPRBV-CDNPAEQRSA-N 2 1 389.584 3.046 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246321649 1433594566 /nfs/dbraw/zinc/59/45/66/1433594566.db2.gz KOQJREKFBVJLTJ-CUXKYVRBSA-N 2 1 390.616 3.403 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246321649 1433594568 /nfs/dbraw/zinc/59/45/68/1433594568.db2.gz KOQJREKFBVJLTJ-CUXKYVRBSA-N 2 1 390.616 3.403 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246321649 1433594571 /nfs/dbraw/zinc/59/45/71/1433594571.db2.gz KOQJREKFBVJLTJ-CUXKYVRBSA-N 2 1 390.616 3.403 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H](C)C[NH+]1CCCC1 ZINC000246324292 1433594990 /nfs/dbraw/zinc/59/49/90/1433594990.db2.gz OCVGQWMZCNANSZ-UNMCSNQZSA-N 2 1 386.584 3.272 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N(C)[C@H]2CC[NH+](C)C[C@H]2C)C1 ZINC000246324753 1433595227 /nfs/dbraw/zinc/59/52/27/1433595227.db2.gz NFKOUIQCZAEYKK-KNKQGSTJSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N(C)[C@H]2CC[N@H+](C)C[C@H]2C)C1 ZINC000246324753 1433595228 /nfs/dbraw/zinc/59/52/28/1433595228.db2.gz NFKOUIQCZAEYKK-KNKQGSTJSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)C1 ZINC000246324753 1433595229 /nfs/dbraw/zinc/59/52/29/1433595229.db2.gz NFKOUIQCZAEYKK-KNKQGSTJSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)[C@@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)C[N@H+]1C1CC1 ZINC000246364932 1433600922 /nfs/dbraw/zinc/60/09/22/1433600922.db2.gz HNEPDHXMJHKCQS-OXFYSEKESA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)[C@@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)C[NH+]1C1CC1 ZINC000246364932 1433600924 /nfs/dbraw/zinc/60/09/24/1433600924.db2.gz HNEPDHXMJHKCQS-OXFYSEKESA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C[NH+]1C1CC1 ZINC000246364932 1433600927 /nfs/dbraw/zinc/60/09/27/1433600927.db2.gz HNEPDHXMJHKCQS-OXFYSEKESA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)[C@@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)C[N@H+]1C1CC1 ZINC000246364939 1433601151 /nfs/dbraw/zinc/60/11/51/1433601151.db2.gz HNEPDHXMJHKCQS-WRWLIDTKSA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)[C@@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)C[NH+]1C1CC1 ZINC000246364939 1433601155 /nfs/dbraw/zinc/60/11/55/1433601155.db2.gz HNEPDHXMJHKCQS-WRWLIDTKSA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C[NH+]1C1CC1 ZINC000246364939 1433601158 /nfs/dbraw/zinc/60/11/58/1433601158.db2.gz HNEPDHXMJHKCQS-WRWLIDTKSA-N 2 1 395.469 3.182 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1cccc(F)c1 ZINC000246374035 1433602382 /nfs/dbraw/zinc/60/23/82/1433602382.db2.gz HSZULKHBRSZECN-DZFGPLHGSA-N 2 1 388.531 3.087 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1cccc(F)c1 ZINC000246374057 1433602785 /nfs/dbraw/zinc/60/27/85/1433602785.db2.gz HSZULKHBRSZECN-IOMROCGXSA-N 2 1 388.531 3.087 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)ccc1S(C)(=O)=O ZINC000246374037 1433602964 /nfs/dbraw/zinc/60/29/64/1433602964.db2.gz JOSXMMDPNIVJOP-IAGOWNOFSA-N 2 1 382.570 3.117 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)ccc1S(C)(=O)=O ZINC000246374037 1433602967 /nfs/dbraw/zinc/60/29/67/1433602967.db2.gz JOSXMMDPNIVJOP-IAGOWNOFSA-N 2 1 382.570 3.117 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000246376189 1433603040 /nfs/dbraw/zinc/60/30/40/1433603040.db2.gz HBFIYVRBGDEPPN-PKTZIBPZSA-N 2 1 398.595 3.211 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccco1 ZINC000246379513 1433603915 /nfs/dbraw/zinc/60/39/15/1433603915.db2.gz IDNSRIBHGJZCQB-DFQSSKMNSA-N 2 1 388.556 3.321 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@H]1CC[N@H+](C)C[C@H]1C ZINC000246389421 1433605540 /nfs/dbraw/zinc/60/55/40/1433605540.db2.gz OFTKXUMMCGMRBK-DGYCAGFBSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@H]1CC[NH+](C)C[C@H]1C ZINC000246389421 1433605541 /nfs/dbraw/zinc/60/55/41/1433605541.db2.gz OFTKXUMMCGMRBK-DGYCAGFBSA-N 2 1 386.584 3.125 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)[C@H]1CC[NH+](C)C[C@H]1C ZINC000246389421 1433605542 /nfs/dbraw/zinc/60/55/42/1433605542.db2.gz OFTKXUMMCGMRBK-DGYCAGFBSA-N 2 1 386.584 3.125 20 0 GGADMP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+][C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000246402977 1433607532 /nfs/dbraw/zinc/60/75/32/1433607532.db2.gz LWLNBCJXNNEANW-WFXMLNOXSA-N 2 1 375.557 3.363 20 0 GGADMP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+][C@@H]2C[C@H](C)[N@@H+](C)C[C@H]2C)cc1 ZINC000246471884 1433617795 /nfs/dbraw/zinc/61/77/95/1433617795.db2.gz QPBVDSQNBNTYHM-OEMYIYORSA-N 2 1 375.557 3.361 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246492544 1433620468 /nfs/dbraw/zinc/62/04/68/1433620468.db2.gz HFLMDVDHIBWNOJ-LAUBAEHRSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246492544 1433620469 /nfs/dbraw/zinc/62/04/69/1433620469.db2.gz HFLMDVDHIBWNOJ-LAUBAEHRSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246492544 1433620470 /nfs/dbraw/zinc/62/04/70/1433620470.db2.gz HFLMDVDHIBWNOJ-LAUBAEHRSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246492544 1433620471 /nfs/dbraw/zinc/62/04/71/1433620471.db2.gz HFLMDVDHIBWNOJ-LAUBAEHRSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246492544 1433620472 /nfs/dbraw/zinc/62/04/72/1433620472.db2.gz HFLMDVDHIBWNOJ-LAUBAEHRSA-N 2 1 381.520 3.012 20 0 GGADMP COc1cc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc(OC)c1OC ZINC000246496230 1433621073 /nfs/dbraw/zinc/62/10/73/1433621073.db2.gz SGDUUIYRVZSBCZ-ZYSHUDEJSA-N 2 1 392.540 3.131 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C[N@H+]1Cc1ccccc1 ZINC000246510328 1433623389 /nfs/dbraw/zinc/62/33/89/1433623389.db2.gz UAGPMPAUDJHMIR-ANZJIFDASA-N 2 1 396.579 3.308 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C[NH+]1Cc1ccccc1 ZINC000246510328 1433623393 /nfs/dbraw/zinc/62/33/93/1433623393.db2.gz UAGPMPAUDJHMIR-ANZJIFDASA-N 2 1 396.579 3.308 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C[NH+]1Cc1ccccc1 ZINC000246510328 1433623402 /nfs/dbraw/zinc/62/34/02/1433623402.db2.gz UAGPMPAUDJHMIR-ANZJIFDASA-N 2 1 396.579 3.308 20 0 GGADMP CCCCOc1cccc(CNC(=O)CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246528897 1433625608 /nfs/dbraw/zinc/62/56/08/1433625608.db2.gz JGIRZODATIUMOL-REWPJTCUSA-N 2 1 399.579 3.430 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000246544308 1433628382 /nfs/dbraw/zinc/62/83/82/1433628382.db2.gz YJAOJSKQWJGQPZ-FCHUYYIVSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000246544308 1433628383 /nfs/dbraw/zinc/62/83/83/1433628383.db2.gz YJAOJSKQWJGQPZ-FCHUYYIVSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000246544308 1433628384 /nfs/dbraw/zinc/62/83/84/1433628384.db2.gz YJAOJSKQWJGQPZ-FCHUYYIVSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)N[C@@H]2c3ccccc3CC[C@H]2n2ccnc2)C1 ZINC000246547630 1433629418 /nfs/dbraw/zinc/62/94/18/1433629418.db2.gz DEOSVDMEDKWEHB-DUXKGJEZSA-N 2 1 381.524 3.143 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)NCCC1CC[NH+](C)CC1 ZINC000246559822 1433631164 /nfs/dbraw/zinc/63/11/64/1433631164.db2.gz AFGABUCKMZKQSN-NGRWLJPCSA-N 2 1 386.584 3.174 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000246569682 1433632853 /nfs/dbraw/zinc/63/28/53/1433632853.db2.gz ANYAEELMUIOVFK-NGRWLJPCSA-N 2 1 391.625 3.334 20 0 GGADMP CSCC[C@@H](C)[N@@H+](C)CC(=O)N1CCC[NH+](Cc2ccccc2C)CC1 ZINC000246572540 1433633383 /nfs/dbraw/zinc/63/33/83/1433633383.db2.gz AGUDGUHUPOCGCP-LJQANCHMSA-N 2 1 377.598 3.103 20 0 GGADMP CSCC[C@@H](C)[NH+](C)CC(=O)N1CCC[N@H+](Cc2ccccc2C)CC1 ZINC000246572540 1433633384 /nfs/dbraw/zinc/63/33/84/1433633384.db2.gz AGUDGUHUPOCGCP-LJQANCHMSA-N 2 1 377.598 3.103 20 0 GGADMP CSCC[C@@H](C)[NH+](C)CC(=O)N1CCC[N@@H+](Cc2ccccc2C)CC1 ZINC000246572540 1433633387 /nfs/dbraw/zinc/63/33/87/1433633387.db2.gz AGUDGUHUPOCGCP-LJQANCHMSA-N 2 1 377.598 3.103 20 0 GGADMP CC(C)[NH2+]C1CCN(C(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000246602869 1433638335 /nfs/dbraw/zinc/63/83/35/1433638335.db2.gz TUYROLFIVBQPSI-NGRWLJPCSA-N 2 1 386.584 3.315 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C[N@H+]1C1CC1 ZINC000246639248 1433643658 /nfs/dbraw/zinc/64/36/58/1433643658.db2.gz YBRQWPFDPFOMPD-AKVSHQRBSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)C[NH+]1C1CC1 ZINC000246639248 1433643661 /nfs/dbraw/zinc/64/36/61/1433643661.db2.gz YBRQWPFDPFOMPD-AKVSHQRBSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)C[NH+]1C1CC1 ZINC000246639248 1433643664 /nfs/dbraw/zinc/64/36/64/1433643664.db2.gz YBRQWPFDPFOMPD-AKVSHQRBSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C[N@H+]1C1CC1 ZINC000246639271 1433643974 /nfs/dbraw/zinc/64/39/74/1433643974.db2.gz YBRQWPFDPFOMPD-NBIWHTTOSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)C[NH+]1C1CC1 ZINC000246639271 1433643978 /nfs/dbraw/zinc/64/39/78/1433643978.db2.gz YBRQWPFDPFOMPD-NBIWHTTOSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)C[NH+]1C1CC1 ZINC000246639271 1433643981 /nfs/dbraw/zinc/64/39/81/1433643981.db2.gz YBRQWPFDPFOMPD-NBIWHTTOSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246649193 1433645204 /nfs/dbraw/zinc/64/52/04/1433645204.db2.gz ZHOLWKXXMCKVNG-PABCKOPISA-N 2 1 398.595 3.270 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)NC[C@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000246724314 1433655786 /nfs/dbraw/zinc/65/57/86/1433655786.db2.gz VKXYBZVCBPSPGQ-ROUUACIJSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000246724314 1433655793 /nfs/dbraw/zinc/65/57/93/1433655793.db2.gz VKXYBZVCBPSPGQ-ROUUACIJSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)C1 ZINC000246724314 1433655802 /nfs/dbraw/zinc/65/58/02/1433655802.db2.gz VKXYBZVCBPSPGQ-ROUUACIJSA-N 2 1 392.613 3.162 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)C1 ZINC000246724314 1433655807 /nfs/dbraw/zinc/65/58/07/1433655807.db2.gz VKXYBZVCBPSPGQ-ROUUACIJSA-N 2 1 392.613 3.162 20 0 GGADMP Clc1ccccc1N1CCN(CCC[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000246731072 1433656627 /nfs/dbraw/zinc/65/66/27/1433656627.db2.gz NYFLIZYQNZQXTQ-OALUTQOASA-N 2 1 376.976 3.069 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCN(CC(F)(F)F)C2=O)C1 ZINC000246766075 1433662817 /nfs/dbraw/zinc/66/28/17/1433662817.db2.gz OAWZEENNSAPBMA-QAPCUYQASA-N 2 1 383.458 3.171 20 0 GGADMP CC[C@@H]1CCCC[N@@H+]1CCNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000246788152 1433666636 /nfs/dbraw/zinc/66/66/36/1433666636.db2.gz XIHRSFRTEXHVBD-GHTZIAJQSA-N 2 1 388.556 3.466 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000246788152 1433666643 /nfs/dbraw/zinc/66/66/43/1433666643.db2.gz XIHRSFRTEXHVBD-GHTZIAJQSA-N 2 1 388.556 3.466 20 0 GGADMP CC[C@H]1CCCC[N@@H+]1CCNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000246788161 1433666851 /nfs/dbraw/zinc/66/68/51/1433666851.db2.gz XIHRSFRTEXHVBD-RXVVDRJESA-N 2 1 388.556 3.466 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000246788161 1433666852 /nfs/dbraw/zinc/66/68/52/1433666852.db2.gz XIHRSFRTEXHVBD-RXVVDRJESA-N 2 1 388.556 3.466 20 0 GGADMP CCCOc1cccc(CNC(=O)CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246832426 1433675938 /nfs/dbraw/zinc/67/59/38/1433675938.db2.gz OENQMJRZBRNTRW-SIKLNZKXSA-N 2 1 385.552 3.040 20 0 GGADMP CCCOc1cccc(CNC(=O)CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246832445 1433676013 /nfs/dbraw/zinc/67/60/13/1433676013.db2.gz OENQMJRZBRNTRW-UGKGYDQZSA-N 2 1 385.552 3.040 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1)c1ccccc1Cl ZINC000246844535 1433677596 /nfs/dbraw/zinc/67/75/96/1433677596.db2.gz KONDJOZCRMBFRG-KFKAGJAMSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1)c1ccccc1Cl ZINC000246844535 1433677599 /nfs/dbraw/zinc/67/75/99/1433677599.db2.gz KONDJOZCRMBFRG-KFKAGJAMSA-N 2 1 378.948 3.068 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000246872724 1433680979 /nfs/dbraw/zinc/68/09/79/1433680979.db2.gz DARYLRMTUZYZGI-YTQUADARSA-N 2 1 381.586 3.241 20 0 GGADMP C[C@@H](NC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)C(C)(C)C[NH+](C)C ZINC000246880360 1433681802 /nfs/dbraw/zinc/68/18/02/1433681802.db2.gz GQFIDUNJUSERLT-KZNAEPCWSA-N 2 1 375.557 3.002 20 0 GGADMP C[C@@H](NC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)(C)C[NH+](C)C ZINC000246880339 1433681960 /nfs/dbraw/zinc/68/19/60/1433681960.db2.gz GQFIDUNJUSERLT-FGTMMUONSA-N 2 1 375.557 3.002 20 0 GGADMP C[C@@H](NC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)(C)C[NH+](C)C ZINC000246880339 1433681964 /nfs/dbraw/zinc/68/19/64/1433681964.db2.gz GQFIDUNJUSERLT-FGTMMUONSA-N 2 1 375.557 3.002 20 0 GGADMP O=C(COc1ccccc1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)N1CCCC1 ZINC000246883313 1433682328 /nfs/dbraw/zinc/68/23/28/1433682328.db2.gz TUYVMWLAWLTZBF-UGKGYDQZSA-N 2 1 397.563 3.137 20 0 GGADMP CC(C)c1ccc(CCNC(=O)CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000246882195 1433682348 /nfs/dbraw/zinc/68/23/48/1433682348.db2.gz QPBTUCJGAZVTNJ-GMAHTHKFSA-N 2 1 383.580 3.417 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CC[C@@H](C[NH+]4CCCCC4)C3)cc2)C[C@H](C)O1 ZINC000246888386 1433683234 /nfs/dbraw/zinc/68/32/34/1433683234.db2.gz HASPWAMVIYRJLH-VWPQPMDRSA-N 2 1 399.579 3.244 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CC[C@@H](C[NH+]4CCCCC4)C3)cc2)C[C@H](C)O1 ZINC000246888386 1433683239 /nfs/dbraw/zinc/68/32/39/1433683239.db2.gz HASPWAMVIYRJLH-VWPQPMDRSA-N 2 1 399.579 3.244 20 0 GGADMP O=C([C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000246900185 1433684496 /nfs/dbraw/zinc/68/44/96/1433684496.db2.gz XPXNHSZBASBEJE-SFTDATJTSA-N 2 1 387.543 3.372 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246914196 1433686361 /nfs/dbraw/zinc/68/63/61/1433686361.db2.gz LCYKQLKZFOCKAW-ZJOUEHCJSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246914196 1433686365 /nfs/dbraw/zinc/68/63/65/1433686365.db2.gz LCYKQLKZFOCKAW-ZJOUEHCJSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)C1 ZINC000246914196 1433686372 /nfs/dbraw/zinc/68/63/72/1433686372.db2.gz LCYKQLKZFOCKAW-ZJOUEHCJSA-N 2 1 387.568 3.100 20 0 GGADMP O=C(CCN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)NCc1ccccc1Cl ZINC000246919367 1433687596 /nfs/dbraw/zinc/68/75/96/1433687596.db2.gz SKHDHAXHVGGHHP-FXAWDEMLSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)NCc1ccccc1Cl ZINC000246919367 1433687597 /nfs/dbraw/zinc/68/75/97/1433687597.db2.gz SKHDHAXHVGGHHP-FXAWDEMLSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)NCc1ccccc1Cl ZINC000246919367 1433687598 /nfs/dbraw/zinc/68/75/98/1433687598.db2.gz SKHDHAXHVGGHHP-FXAWDEMLSA-N 2 1 375.944 3.295 20 0 GGADMP O=C(CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)NCc1ccccc1Cl ZINC000246919367 1433687599 /nfs/dbraw/zinc/68/75/99/1433687599.db2.gz SKHDHAXHVGGHHP-FXAWDEMLSA-N 2 1 375.944 3.295 20 0 GGADMP COc1ccc(NC(=O)N(C)[C@@H]2CCCC[C@@H]2[N@@H+](C)C2CCN(C)CC2)cc1 ZINC000247199977 1433690436 /nfs/dbraw/zinc/69/04/36/1433690436.db2.gz YOCFKRKGMNMSGJ-LEWJYISDSA-N 2 1 388.556 3.496 20 0 GGADMP COc1ccc(NC(=O)N(C)[C@@H]2CCCC[C@H]2[N@@H+](C)C2CCN(C)CC2)cc1 ZINC000247199990 1433690664 /nfs/dbraw/zinc/69/06/64/1433690664.db2.gz YOCFKRKGMNMSGJ-NHCUHLMSSA-N 2 1 388.556 3.496 20 0 GGADMP C[C@H]([NH2+]CCCN1CC[N@@H+](C)C[C@H]1c1ccccc1)c1ccc([S@](C)=O)cc1 ZINC000247227969 1433693032 /nfs/dbraw/zinc/69/30/32/1433693032.db2.gz YBIOCPUUIMHXOY-AMAALNMCSA-N 2 1 399.604 3.453 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)C1 ZINC000247299164 1433701859 /nfs/dbraw/zinc/70/18/59/1433701859.db2.gz FWJYQGFSOYJNIX-QHAWAJNXSA-N 2 1 378.605 3.404 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[NH+]3CC[C@@H]4[C@@H](CCC[N@@H+]4C)C3)CC[C@H]21 ZINC000247348781 1433711097 /nfs/dbraw/zinc/71/10/97/1433711097.db2.gz YAFGOAGETMJLIC-UEQSERJNSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C)C3)CC[C@H]21 ZINC000247348781 1433711103 /nfs/dbraw/zinc/71/11/03/1433711103.db2.gz YAFGOAGETMJLIC-UEQSERJNSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[N@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C)C3)CC[C@H]21 ZINC000247348781 1433711111 /nfs/dbraw/zinc/71/11/11/1433711111.db2.gz YAFGOAGETMJLIC-UEQSERJNSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C)C3)CC[C@H]21 ZINC000247348760 1433711444 /nfs/dbraw/zinc/71/14/44/1433711444.db2.gz YAFGOAGETMJLIC-MOUTVQLLSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C)C3)CC[C@H]21 ZINC000247348760 1433711449 /nfs/dbraw/zinc/71/14/49/1433711449.db2.gz YAFGOAGETMJLIC-MOUTVQLLSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C)C3)CC[C@H]21 ZINC000247348760 1433711453 /nfs/dbraw/zinc/71/14/53/1433711453.db2.gz YAFGOAGETMJLIC-MOUTVQLLSA-N 4 1 390.660 3.379 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CCCC[NH+]1CC ZINC000247352618 1433711867 /nfs/dbraw/zinc/71/18/67/1433711867.db2.gz BGAHIBQDHQARIK-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CCCC[N@@H+]1CC ZINC000247352618 1433711875 /nfs/dbraw/zinc/71/18/75/1433711875.db2.gz BGAHIBQDHQARIK-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@@H]1CCCC[N@H+]1CC ZINC000247352618 1433711880 /nfs/dbraw/zinc/71/18/80/1433711880.db2.gz BGAHIBQDHQARIK-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)C1 ZINC000247394400 1433716292 /nfs/dbraw/zinc/71/62/92/1433716292.db2.gz QPVQXNOVHORVMJ-HSALFYBXSA-N 2 1 378.605 3.403 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)C1 ZINC000247411767 1433718968 /nfs/dbraw/zinc/71/89/68/1433718968.db2.gz ZFDURNYTEARICR-DENIHFKCSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000247411767 1433718973 /nfs/dbraw/zinc/71/89/73/1433718973.db2.gz ZFDURNYTEARICR-DENIHFKCSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000247411767 1433718979 /nfs/dbraw/zinc/71/89/79/1433718979.db2.gz ZFDURNYTEARICR-DENIHFKCSA-N 2 1 386.584 3.402 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)N(C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247412065 1433719199 /nfs/dbraw/zinc/71/91/99/1433719199.db2.gz STPXEFOSJUHGPP-URVUXULASA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247412065 1433719200 /nfs/dbraw/zinc/71/92/00/1433719200.db2.gz STPXEFOSJUHGPP-URVUXULASA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCC[NH+](CCNC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000247412065 1433719201 /nfs/dbraw/zinc/71/92/01/1433719201.db2.gz STPXEFOSJUHGPP-URVUXULASA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000247419250 1433720033 /nfs/dbraw/zinc/72/00/33/1433720033.db2.gz UPQVACTVCLWYEX-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000247419250 1433720036 /nfs/dbraw/zinc/72/00/36/1433720036.db2.gz UPQVACTVCLWYEX-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000247419250 1433720041 /nfs/dbraw/zinc/72/00/41/1433720041.db2.gz UPQVACTVCLWYEX-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000247445675 1433723470 /nfs/dbraw/zinc/72/34/70/1433723470.db2.gz YCVLCTJVDZRKEO-MKRFIIIDSA-N 2 1 384.568 3.148 20 0 GGADMP C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247445675 1433723475 /nfs/dbraw/zinc/72/34/75/1433723475.db2.gz YCVLCTJVDZRKEO-MKRFIIIDSA-N 2 1 384.568 3.148 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000247463866 1433725842 /nfs/dbraw/zinc/72/58/42/1433725842.db2.gz RBZHXRRRLMQNIW-RZUBCFFCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000247463866 1433725847 /nfs/dbraw/zinc/72/58/47/1433725847.db2.gz RBZHXRRRLMQNIW-RZUBCFFCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000247463866 1433725853 /nfs/dbraw/zinc/72/58/53/1433725853.db2.gz RBZHXRRRLMQNIW-RZUBCFFCSA-N 2 1 386.584 3.270 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2cc(Cl)ccc2OC[C@H]2CCCO2)CC1 ZINC000247474846 1433726923 /nfs/dbraw/zinc/72/69/23/1433726923.db2.gz SWBNWJLNIGPMPX-HXUWFJFHSA-N 2 1 395.975 3.015 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N[C@H]1CC[NH+](CC2CCCC2)C1 ZINC000247494565 1433729746 /nfs/dbraw/zinc/72/97/46/1433729746.db2.gz WKLHCSWZMUXWSM-GOTSBHOMSA-N 2 1 398.595 3.115 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC000247494565 1433729749 /nfs/dbraw/zinc/72/97/49/1433729749.db2.gz WKLHCSWZMUXWSM-GOTSBHOMSA-N 2 1 398.595 3.115 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000247494565 1433729754 /nfs/dbraw/zinc/72/97/54/1433729754.db2.gz WKLHCSWZMUXWSM-GOTSBHOMSA-N 2 1 398.595 3.115 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000247496586 1433729864 /nfs/dbraw/zinc/72/98/64/1433729864.db2.gz WTRGGQBTJAJDIX-YADHBBJMSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@H]1CCCC[NH+]1CCNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000247496586 1433729869 /nfs/dbraw/zinc/72/98/69/1433729869.db2.gz WTRGGQBTJAJDIX-YADHBBJMSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@H]1CCCC[NH+]1CCNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000247496586 1433729872 /nfs/dbraw/zinc/72/98/72/1433729872.db2.gz WTRGGQBTJAJDIX-YADHBBJMSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CC[C@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000247523717 1433733306 /nfs/dbraw/zinc/73/33/06/1433733306.db2.gz ZHBRPRWXHFPQSG-RBBKRZOGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000247523717 1433733318 /nfs/dbraw/zinc/73/33/18/1433733318.db2.gz ZHBRPRWXHFPQSG-RBBKRZOGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)C1 ZINC000247523717 1433733327 /nfs/dbraw/zinc/73/33/27/1433733327.db2.gz ZHBRPRWXHFPQSG-RBBKRZOGSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@H]2c3ccccc3CC[C@@H]2n2ccnc2)C[N@H+]1C1CC1 ZINC000247535298 1433734079 /nfs/dbraw/zinc/73/40/79/1433734079.db2.gz POWDEXLQQLLEJA-GWKIZSTFSA-N 2 1 379.508 3.036 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000247568640 1433738398 /nfs/dbraw/zinc/73/83/98/1433738398.db2.gz SFIGFUFCYLLHAT-QWFCFKBJSA-N 2 1 398.551 3.338 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000247618997 1433740335 /nfs/dbraw/zinc/74/03/35/1433740335.db2.gz SWOKNTZEQWJMJW-NGRWLJPCSA-N 2 1 397.567 3.428 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000247618997 1433740337 /nfs/dbraw/zinc/74/03/37/1433740337.db2.gz SWOKNTZEQWJMJW-NGRWLJPCSA-N 2 1 397.567 3.428 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000247654169 1433743732 /nfs/dbraw/zinc/74/37/32/1433743732.db2.gz WUPGAIMMGJIYDJ-OEWRPIJISA-N 2 1 384.568 3.069 20 0 GGADMP C[N@@H+](CC1CC[NH+](C[C@H](O)c2ccccc2)CC1)[C@H]1Cc2ccccc2[C@@H]1O ZINC000247710091 1433747357 /nfs/dbraw/zinc/74/73/57/1433747357.db2.gz RSJIYFMBSJJNSJ-HJOGWXRNSA-N 2 1 380.532 3.022 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)NC[C@H]2CC[NH+](C3CC3)C2)CC1 ZINC000247891888 1433755588 /nfs/dbraw/zinc/75/55/88/1433755588.db2.gz FODIKUCJCJSHEE-AZUAARDMSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@H]1CCCC[NH+]1CCC1CCN(C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000247891888 1433755592 /nfs/dbraw/zinc/75/55/92/1433755592.db2.gz FODIKUCJCJSHEE-AZUAARDMSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@H]1CCCC[NH+]1CCC1CCN(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CC1 ZINC000247891888 1433755595 /nfs/dbraw/zinc/75/55/95/1433755595.db2.gz FODIKUCJCJSHEE-AZUAARDMSA-N 2 1 376.589 3.157 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000247929059 1433756931 /nfs/dbraw/zinc/75/69/31/1433756931.db2.gz BWBZWDGXLVGXRQ-FSSWDIPSSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000247929059 1433756934 /nfs/dbraw/zinc/75/69/34/1433756934.db2.gz BWBZWDGXLVGXRQ-FSSWDIPSSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000247929059 1433756937 /nfs/dbraw/zinc/75/69/37/1433756937.db2.gz BWBZWDGXLVGXRQ-FSSWDIPSSA-N 2 1 384.568 3.024 20 0 GGADMP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H]2CO)nnn1-c1ccc(Cl)cc1 ZINC000247968036 1433760012 /nfs/dbraw/zinc/76/00/12/1433760012.db2.gz HAJXSZQTXPGALU-BEFAXECRSA-N 2 1 391.947 3.117 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1)N1CCOCC1 ZINC000248070061 1433767332 /nfs/dbraw/zinc/76/73/32/1433767332.db2.gz MNOUJGGDJIPXAH-LMNJBCLMSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000248070061 1433767336 /nfs/dbraw/zinc/76/73/36/1433767336.db2.gz MNOUJGGDJIPXAH-LMNJBCLMSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000248070061 1433767341 /nfs/dbraw/zinc/76/73/41/1433767341.db2.gz MNOUJGGDJIPXAH-LMNJBCLMSA-N 2 1 386.540 3.028 20 0 GGADMP CC[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248123465 1433771322 /nfs/dbraw/zinc/77/13/22/1433771322.db2.gz NQPSGAFHRKGXFV-PKTZIBPZSA-N 2 1 379.548 3.495 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)CC[C@@H]21 ZINC000248123549 1433771376 /nfs/dbraw/zinc/77/13/76/1433771376.db2.gz NRKOLQNYQBQTSG-MNEFBYGVSA-N 2 1 393.478 3.200 20 0 GGADMP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c1)CC2 ZINC000248137794 1433773166 /nfs/dbraw/zinc/77/31/66/1433773166.db2.gz PFYBIDBZJXSQDT-GGAORHGYSA-N 2 1 377.532 3.469 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1)C[NH+]1CCCC1 ZINC000248145916 1433774155 /nfs/dbraw/zinc/77/41/55/1433774155.db2.gz QDEODDGWYFNWRY-AKIFATBCSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000248175070 1433777774 /nfs/dbraw/zinc/77/77/74/1433777774.db2.gz VLZGKGXVUUMCKF-XPWALMASSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000248175070 1433777781 /nfs/dbraw/zinc/77/77/81/1433777781.db2.gz VLZGKGXVUUMCKF-XPWALMASSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000248175070 1433777791 /nfs/dbraw/zinc/77/77/91/1433777791.db2.gz VLZGKGXVUUMCKF-XPWALMASSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1C(=O)NC[C@H](c1cccc(OC)c1)[NH+](CC)CC ZINC000248179717 1433777851 /nfs/dbraw/zinc/77/78/51/1433777851.db2.gz XTEZLAOGMPMVBA-LEWJYISDSA-N 2 1 375.557 3.459 20 0 GGADMP C[C@@H](CSC(C)(C)C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248185732 1433778462 /nfs/dbraw/zinc/77/84/62/1433778462.db2.gz XHWBOCZWMTVOED-QFBILLFUSA-N 2 1 377.598 3.394 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)CC(=O)Nc2cccnc2Cl)[C@H](C)C1 ZINC000248215787 1433780048 /nfs/dbraw/zinc/78/00/48/1433780048.db2.gz ZPRDSNPHBZYELH-ZACQAIPSSA-N 2 1 396.963 3.179 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(CNC(=O)[C@H]3CC[NH+](C4CCCCC4)C3)c2)CCO1 ZINC000248371890 1433789120 /nfs/dbraw/zinc/78/91/20/1433789120.db2.gz ZGBPBBRWSFMMNY-UGKGYDQZSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(CNC(=O)[C@H]3CC[NH+](C4CCCCC4)C3)c2)CCO1 ZINC000248371890 1433789123 /nfs/dbraw/zinc/78/91/23/1433789123.db2.gz ZGBPBBRWSFMMNY-UGKGYDQZSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@H]1C[NH+](Cc2cccc(CNC(=O)[C@H]3CC[N@@H+](C4CCCCC4)C3)c2)CCO1 ZINC000248371890 1433789127 /nfs/dbraw/zinc/78/91/27/1433789127.db2.gz ZGBPBBRWSFMMNY-UGKGYDQZSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@H]1C[NH+](Cc2cccc(CNC(=O)[C@H]3CC[N@H+](C4CCCCC4)C3)c2)CCO1 ZINC000248371890 1433789130 /nfs/dbraw/zinc/78/91/30/1433789130.db2.gz ZGBPBBRWSFMMNY-UGKGYDQZSA-N 2 1 399.579 3.178 20 0 GGADMP COc1cccc([C@@H]2CCC[N@@H+]2CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000248389784 1433793180 /nfs/dbraw/zinc/79/31/80/1433793180.db2.gz BHMPWTGJJBDBMF-FCHUYYIVSA-N 2 1 381.520 3.251 20 0 GGADMP COc1cccc([C@@H]2CCC[N@H+]2CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000248389784 1433793181 /nfs/dbraw/zinc/79/31/81/1433793181.db2.gz BHMPWTGJJBDBMF-FCHUYYIVSA-N 2 1 381.520 3.251 20 0 GGADMP CNC(=O)c1cccc(CC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000248390011 1433793507 /nfs/dbraw/zinc/79/35/07/1433793507.db2.gz BEJUDJGXKRTVJJ-RBZQAINGSA-N 2 1 391.559 3.479 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCC(=O)Nc1cc(N)ccc1F ZINC000248395052 1433795479 /nfs/dbraw/zinc/79/54/79/1433795479.db2.gz IRPXVRFCCNUCJJ-DTVZVWBHSA-N 2 1 398.526 3.483 20 0 GGADMP CNC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000248401553 1433797649 /nfs/dbraw/zinc/79/76/49/1433797649.db2.gz LWBQWVVOSHSCHH-DNVJHFABSA-N 2 1 377.532 3.437 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N[C@@H](C)[C@H]2CCC[NH+](C3CCC3)C2)C1 ZINC000248401537 1433797668 /nfs/dbraw/zinc/79/76/68/1433797668.db2.gz LVEAYGOMJKFIDV-ZCNNSNEGSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)C1 ZINC000248401537 1433797670 /nfs/dbraw/zinc/79/76/70/1433797670.db2.gz LVEAYGOMJKFIDV-ZCNNSNEGSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000248401537 1433797673 /nfs/dbraw/zinc/79/76/73/1433797673.db2.gz LVEAYGOMJKFIDV-ZCNNSNEGSA-N 2 1 378.605 3.307 20 0 GGADMP C[C@@H](NC(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248401539 1433797710 /nfs/dbraw/zinc/79/77/10/1433797710.db2.gz LVFZBIBWIFVWFQ-WCIQWLHISA-N 2 1 378.605 3.307 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248401539 1433797713 /nfs/dbraw/zinc/79/77/13/1433797713.db2.gz LVFZBIBWIFVWFQ-WCIQWLHISA-N 2 1 378.605 3.307 20 0 GGADMP C[C@@H](NC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248401539 1433797718 /nfs/dbraw/zinc/79/77/18/1433797718.db2.gz LVFZBIBWIFVWFQ-WCIQWLHISA-N 2 1 378.605 3.307 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N[C@H](C)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000248401640 1433797889 /nfs/dbraw/zinc/79/78/89/1433797889.db2.gz MCSNBCXAGIQPQP-SBHAEUEKSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248401640 1433797895 /nfs/dbraw/zinc/79/78/95/1433797895.db2.gz MCSNBCXAGIQPQP-SBHAEUEKSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248401640 1433797902 /nfs/dbraw/zinc/79/79/02/1433797902.db2.gz MCSNBCXAGIQPQP-SBHAEUEKSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N[C@H](C)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248401641 1433798086 /nfs/dbraw/zinc/79/80/86/1433798086.db2.gz MCSNBCXAGIQPQP-SFHLNBCPSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248401641 1433798091 /nfs/dbraw/zinc/79/80/91/1433798091.db2.gz MCSNBCXAGIQPQP-SFHLNBCPSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248401641 1433798096 /nfs/dbraw/zinc/79/80/96/1433798096.db2.gz MCSNBCXAGIQPQP-SFHLNBCPSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248406882 1433799907 /nfs/dbraw/zinc/79/99/07/1433799907.db2.gz SVYJDZDBRVXSLN-QKNQBKEWSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)C[C@@H](C)O1 ZINC000248410733 1433800373 /nfs/dbraw/zinc/80/03/73/1433800373.db2.gz HKUTYWOWULCPFN-ONIFWJIJSA-N 3 1 385.596 3.376 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCC[C@H]2C[NH+](Cc3ccccc3)C[C@@H]21 ZINC000248411752 1433800517 /nfs/dbraw/zinc/80/05/17/1433800517.db2.gz ZPKLPHMAQHWWQW-NEWJYFPISA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[NH+]1CCCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000248411752 1433800519 /nfs/dbraw/zinc/80/05/19/1433800519.db2.gz ZPKLPHMAQHWWQW-NEWJYFPISA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[NH+]1CCCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000248411752 1433800520 /nfs/dbraw/zinc/80/05/20/1433800520.db2.gz ZPKLPHMAQHWWQW-NEWJYFPISA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCC[C@H]2C[NH+](Cc3ccccc3)C[C@H]21 ZINC000248411750 1433800724 /nfs/dbraw/zinc/80/07/24/1433800724.db2.gz ZPKLPHMAQHWWQW-CJRSTVEYSA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[NH+]1CCCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248411750 1433800725 /nfs/dbraw/zinc/80/07/25/1433800725.db2.gz ZPKLPHMAQHWWQW-CJRSTVEYSA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[NH+]1CCCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248411750 1433800726 /nfs/dbraw/zinc/80/07/26/1433800726.db2.gz ZPKLPHMAQHWWQW-CJRSTVEYSA-N 3 1 385.596 3.114 20 0 GGADMP CO[C@]1(C)C[C@H]([NH+](C)CC2(C[N@H+](C)[C@H]3C[C@@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000248417678 1433801090 /nfs/dbraw/zinc/80/10/90/1433801090.db2.gz JSMLUQMHMHVNHK-MOXQZVSFSA-N 2 1 396.616 3.274 20 0 GGADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc2c(c1)OCCO2 ZINC000248455544 1433804077 /nfs/dbraw/zinc/80/40/77/1433804077.db2.gz RNVLDLPOAWARMS-NHCUHLMSSA-N 2 1 382.504 3.265 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000248460137 1433804667 /nfs/dbraw/zinc/80/46/67/1433804667.db2.gz ODDSAYODEDGUBO-IRXDYDNUSA-N 2 1 386.458 3.253 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000248460137 1433804668 /nfs/dbraw/zinc/80/46/68/1433804668.db2.gz ODDSAYODEDGUBO-IRXDYDNUSA-N 2 1 386.458 3.253 20 0 GGADMP COc1cccc(C[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)C2CC2)c1 ZINC000248459515 1433804706 /nfs/dbraw/zinc/80/47/06/1433804706.db2.gz VTMKPQORWPKLGR-ISKFKSNPSA-N 2 1 380.532 3.373 20 0 GGADMP C[C@@H](CCNC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCCCC1 ZINC000248509663 1433806290 /nfs/dbraw/zinc/80/62/90/1433806290.db2.gz ZCHOCRMCZGJAJS-SLFFLAALSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H](CCNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCCCC1 ZINC000248509663 1433806291 /nfs/dbraw/zinc/80/62/91/1433806291.db2.gz ZCHOCRMCZGJAJS-SLFFLAALSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@H]1CCOc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248551353 1433807851 /nfs/dbraw/zinc/80/78/51/1433807851.db2.gz GQCLEYNUFOQIKX-IIMDRIAPSA-N 2 1 385.552 3.258 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@H]1CCOc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248551353 1433807853 /nfs/dbraw/zinc/80/78/53/1433807853.db2.gz GQCLEYNUFOQIKX-IIMDRIAPSA-N 2 1 385.552 3.258 20 0 GGADMP CC[C@H]([NH2+]CCCC[N@H+]1CCC[C@H]1CO)c1cc(Br)ccc1O ZINC000248589067 1433809992 /nfs/dbraw/zinc/80/99/92/1433809992.db2.gz YSKNEYKVJDIKPE-RDJZCZTQSA-N 2 1 385.346 3.432 20 0 GGADMP CC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H]1CO)c1cc(Br)ccc1O ZINC000248589066 1433810082 /nfs/dbraw/zinc/81/00/82/1433810082.db2.gz YSKNEYKVJDIKPE-DOTOQJQBSA-N 2 1 385.346 3.432 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1)[C@@H](c1ccccc1)[NH+](C)C ZINC000248622487 1433812057 /nfs/dbraw/zinc/81/20/57/1433812057.db2.gz BEKPNZMCXGPNMS-APTRMMRNSA-N 2 1 395.547 3.085 20 0 GGADMP C[C@H](NC(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@@H](c1ccccc1)[NH+](C)C ZINC000248622487 1433812058 /nfs/dbraw/zinc/81/20/58/1433812058.db2.gz BEKPNZMCXGPNMS-APTRMMRNSA-N 2 1 395.547 3.085 20 0 GGADMP CC[C@H]([NH2+][C@H](C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)c1c(C)noc1C ZINC000248642602 1433813197 /nfs/dbraw/zinc/81/31/97/1433813197.db2.gz ZSWHYGIRIKDRLX-UXPWSPDFSA-N 2 1 384.524 3.111 20 0 GGADMP CC[C@H]([NH2+][C@H](C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(C)noc1C ZINC000248642602 1433813198 /nfs/dbraw/zinc/81/31/98/1433813198.db2.gz ZSWHYGIRIKDRLX-UXPWSPDFSA-N 2 1 384.524 3.111 20 0 GGADMP COc1ccsc1[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248652076 1433813690 /nfs/dbraw/zinc/81/36/90/1433813690.db2.gz XUMZNSYRSKQPOT-MAUKXSAKSA-N 2 1 387.549 3.305 20 0 GGADMP CCN(CCC[NH+](C)C)C(=O)NC[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000248679933 1433814886 /nfs/dbraw/zinc/81/48/86/1433814886.db2.gz CKFHPULDSZDPJH-APWZRJJASA-N 2 1 398.954 3.455 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCCN1Cc1ccc(F)cc1 ZINC000248709879 1433816699 /nfs/dbraw/zinc/81/66/99/1433816699.db2.gz BXUYCDCTXWAXQZ-JTHBVZDNSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000248709879 1433816700 /nfs/dbraw/zinc/81/67/00/1433816700.db2.gz BXUYCDCTXWAXQZ-JTHBVZDNSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000248709879 1433816701 /nfs/dbraw/zinc/81/67/01/1433816701.db2.gz BXUYCDCTXWAXQZ-JTHBVZDNSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+]1Cc1ccc(F)cc1 ZINC000248709879 1433816704 /nfs/dbraw/zinc/81/67/04/1433816704.db2.gz BXUYCDCTXWAXQZ-JTHBVZDNSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+]1Cc1ccc(F)cc1 ZINC000248709879 1433816705 /nfs/dbraw/zinc/81/67/05/1433816705.db2.gz BXUYCDCTXWAXQZ-JTHBVZDNSA-N 2 1 395.522 3.428 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000248737561 1433818887 /nfs/dbraw/zinc/81/88/87/1433818887.db2.gz LFOYFOSPHLWISN-RBBKRZOGSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000248737561 1433818889 /nfs/dbraw/zinc/81/88/89/1433818889.db2.gz LFOYFOSPHLWISN-RBBKRZOGSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000248737561 1433818890 /nfs/dbraw/zinc/81/88/90/1433818890.db2.gz LFOYFOSPHLWISN-RBBKRZOGSA-N 2 1 386.584 3.320 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000248750045 1433819920 /nfs/dbraw/zinc/81/99/20/1433819920.db2.gz OKDKZKJFRLAZDV-FGZHOGPDSA-N 2 1 384.568 3.168 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)C[C@@H]2COCCN2C(=O)OC(C)(C)C)C1 ZINC000248770467 1433821558 /nfs/dbraw/zinc/82/15/58/1433821558.db2.gz XZHFBWIJJYYLOB-GUDVDZBRSA-N 2 1 383.577 3.111 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N[C@H]1CC[NH+](CC2CCCC2)C1 ZINC000248779066 1433822060 /nfs/dbraw/zinc/82/20/60/1433822060.db2.gz UVCZJTQSQQIERR-VXKWHMMOSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC000248779066 1433822061 /nfs/dbraw/zinc/82/20/61/1433822061.db2.gz UVCZJTQSQQIERR-VXKWHMMOSA-N 2 1 384.568 3.072 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000248779066 1433822062 /nfs/dbraw/zinc/82/20/62/1433822062.db2.gz UVCZJTQSQQIERR-VXKWHMMOSA-N 2 1 384.568 3.072 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000248799124 1433822985 /nfs/dbraw/zinc/82/29/85/1433822985.db2.gz JNNIVLQSKPBMBO-PGRDOPGGSA-N 2 1 384.568 3.213 20 0 GGADMP O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)[C@H]1CC[NH+](C2CCCCC2)C1 ZINC000248855246 1433826153 /nfs/dbraw/zinc/82/61/53/1433826153.db2.gz VWCHSXOCSAJOQX-GMAHTHKFSA-N 2 1 399.579 3.048 20 0 GGADMP O=C(NC[C@H]1C[NH+](Cc2ccccc2)CCCO1)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000248855246 1433826154 /nfs/dbraw/zinc/82/61/54/1433826154.db2.gz VWCHSXOCSAJOQX-GMAHTHKFSA-N 2 1 399.579 3.048 20 0 GGADMP O=C1c2ccccc2CCN1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248884415 1433827622 /nfs/dbraw/zinc/82/76/22/1433827622.db2.gz LQEYWDICFKEMTK-WBDAEOGXSA-N 2 1 389.543 3.470 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000248894765 1433828337 /nfs/dbraw/zinc/82/83/37/1433828337.db2.gz YLAWYWUEQGKEPK-WOJBJXKFSA-N 2 1 386.584 3.113 20 0 GGADMP CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)C1(C)C ZINC000248912907 1433829314 /nfs/dbraw/zinc/82/93/14/1433829314.db2.gz VPAHZDDEQDMTTO-NJDAHSKKSA-N 2 1 387.568 3.066 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000248917237 1433829456 /nfs/dbraw/zinc/82/94/56/1433829456.db2.gz DKSDJZYKJQPODZ-VXKWHMMOSA-N 2 1 386.584 3.270 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[C@H](C)C1 ZINC000248944961 1433830218 /nfs/dbraw/zinc/83/02/18/1433830218.db2.gz DHDHMFYNKQJYMP-HDAAZOAOSA-N 2 1 387.568 3.079 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[C@H](C)C1 ZINC000248944961 1433830219 /nfs/dbraw/zinc/83/02/19/1433830219.db2.gz DHDHMFYNKQJYMP-HDAAZOAOSA-N 2 1 387.568 3.079 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccccc2CC)[C@H](C)C1 ZINC000248957015 1433830554 /nfs/dbraw/zinc/83/05/54/1433830554.db2.gz FYCZMQRYCFHFGU-HBFSDRIKSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccccc2CC)[C@H](C)C1 ZINC000248957015 1433830556 /nfs/dbraw/zinc/83/05/56/1433830556.db2.gz FYCZMQRYCFHFGU-HBFSDRIKSA-N 2 1 375.557 3.303 20 0 GGADMP CCN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000249274672 1433840033 /nfs/dbraw/zinc/84/00/33/1433840033.db2.gz CMUZPXRCUGJVDN-VQTJNVASSA-N 2 1 384.524 3.188 20 0 GGADMP CCN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249274672 1433840034 /nfs/dbraw/zinc/84/00/34/1433840034.db2.gz CMUZPXRCUGJVDN-VQTJNVASSA-N 2 1 384.524 3.188 20 0 GGADMP CN(C)[C@H](CNC(=O)CN1CCC[C@H]1CC(=O)c1cccs1)c1ccccc1 ZINC000249283191 1433840330 /nfs/dbraw/zinc/84/03/30/1433840330.db2.gz HHDLXAAYKPJPAI-RBUKOAKNSA-N 2 1 399.560 3.204 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)NCc2ccccc2Cl)[C@@H](C)C1 ZINC000249416513 1433843388 /nfs/dbraw/zinc/84/33/88/1433843388.db2.gz GOWQWCDNCJZXRE-ZWOKBUDYSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)NCc2ccccc2Cl)[C@@H](C)C1 ZINC000249416513 1433843389 /nfs/dbraw/zinc/84/33/89/1433843389.db2.gz GOWQWCDNCJZXRE-ZWOKBUDYSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc3oc(C(=O)OC)cc3c2)[C@@H](C)C1 ZINC000249437350 1433843910 /nfs/dbraw/zinc/84/39/10/1433843910.db2.gz SKXVMCUTQCSJMB-LPHOPBHVSA-N 2 1 388.508 3.446 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000249437434 1433843950 /nfs/dbraw/zinc/84/39/50/1433843950.db2.gz SLUGCQBBIILVJX-ZJOUEHCJSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000249437434 1433843951 /nfs/dbraw/zinc/84/39/51/1433843951.db2.gz SLUGCQBBIILVJX-ZJOUEHCJSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)NCc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249442488 1433843962 /nfs/dbraw/zinc/84/39/62/1433843962.db2.gz MMMZMEPGJQABJV-ZWOKBUDYSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)NCc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249442488 1433843964 /nfs/dbraw/zinc/84/39/64/1433843964.db2.gz MMMZMEPGJQABJV-ZWOKBUDYSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NCc2ccc(Cl)cc2)[C@H](C)C1 ZINC000249442486 1433844002 /nfs/dbraw/zinc/84/40/02/1433844002.db2.gz MMMZMEPGJQABJV-HLIPFELVSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NCc2ccc(Cl)cc2)[C@H](C)C1 ZINC000249442486 1433844003 /nfs/dbraw/zinc/84/40/03/1433844003.db2.gz MMMZMEPGJQABJV-HLIPFELVSA-N 2 1 395.975 3.071 20 0 GGADMP CC(C)[NH+]1CCN(CCCN2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000249457407 1433844266 /nfs/dbraw/zinc/84/42/66/1433844266.db2.gz YGUUTWRBJFBEJT-DQEYMECFSA-N 2 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000249457407 1433844267 /nfs/dbraw/zinc/84/42/67/1433844267.db2.gz YGUUTWRBJFBEJT-DQEYMECFSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000249457407 1433844269 /nfs/dbraw/zinc/84/42/69/1433844269.db2.gz YGUUTWRBJFBEJT-DQEYMECFSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)CC1 ZINC000249457407 1433844270 /nfs/dbraw/zinc/84/42/70/1433844270.db2.gz YGUUTWRBJFBEJT-DQEYMECFSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000249457407 1433844271 /nfs/dbraw/zinc/84/42/71/1433844271.db2.gz YGUUTWRBJFBEJT-DQEYMECFSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCCN2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000249457409 1433844301 /nfs/dbraw/zinc/84/43/01/1433844301.db2.gz YGUUTWRBJFBEJT-LOSJGSFVSA-N 2 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000249457409 1433844303 /nfs/dbraw/zinc/84/43/03/1433844303.db2.gz YGUUTWRBJFBEJT-LOSJGSFVSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000249457409 1433844304 /nfs/dbraw/zinc/84/43/04/1433844304.db2.gz YGUUTWRBJFBEJT-LOSJGSFVSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)CC1 ZINC000249457409 1433844305 /nfs/dbraw/zinc/84/43/05/1433844305.db2.gz YGUUTWRBJFBEJT-LOSJGSFVSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000249457409 1433844306 /nfs/dbraw/zinc/84/43/06/1433844306.db2.gz YGUUTWRBJFBEJT-LOSJGSFVSA-N 3 1 398.639 3.389 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)[C@H](C)C1 ZINC000249461964 1433844361 /nfs/dbraw/zinc/84/43/61/1433844361.db2.gz QZQMFDUXDLLVRI-LDIYZUBKSA-N 2 1 381.605 3.042 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)[C@H](C)C1 ZINC000249461964 1433844362 /nfs/dbraw/zinc/84/43/62/1433844362.db2.gz QZQMFDUXDLLVRI-LDIYZUBKSA-N 2 1 381.605 3.042 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(CC)cc2)[C@H](C)C1 ZINC000249466530 1433844513 /nfs/dbraw/zinc/84/45/13/1433844513.db2.gz SLGAKIXQQJVSGF-OPYAIIAOSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(CC)cc2)[C@H](C)C1 ZINC000249466530 1433844514 /nfs/dbraw/zinc/84/45/14/1433844514.db2.gz SLGAKIXQQJVSGF-OPYAIIAOSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCC(=O)N[C@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000249486861 1433844827 /nfs/dbraw/zinc/84/48/27/1433844827.db2.gz YITDHCUYZJMTBH-QKLQHJQFSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000249486861 1433844828 /nfs/dbraw/zinc/84/48/28/1433844828.db2.gz YITDHCUYZJMTBH-QKLQHJQFSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000249486861 1433844830 /nfs/dbraw/zinc/84/48/30/1433844830.db2.gz YITDHCUYZJMTBH-QKLQHJQFSA-N 2 1 395.975 3.244 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)NC[C@H]3CC[NH+](C4CC4)C3)cc2)C1 ZINC000249524145 1433846234 /nfs/dbraw/zinc/84/62/34/1433846234.db2.gz QRIPAIRCOJBWFG-XQBPLPMBSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@H]3CC[N@@H+](C4CC4)C3)cc2)C1 ZINC000249524145 1433846235 /nfs/dbraw/zinc/84/62/35/1433846235.db2.gz QRIPAIRCOJBWFG-XQBPLPMBSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NC[C@H]3CC[N@H+](C4CC4)C3)cc2)C1 ZINC000249524145 1433846236 /nfs/dbraw/zinc/84/62/36/1433846236.db2.gz QRIPAIRCOJBWFG-XQBPLPMBSA-N 2 1 398.595 3.448 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@H+]1CCC[C@H](C)C1)N1CCc2sccc2C1 ZINC000249526557 1433846248 /nfs/dbraw/zinc/84/62/48/1433846248.db2.gz UHVKFZAQSUVLSG-ROUUACIJSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@@H+]1CCC[C@H](C)C1)[NH+]1CCc2sccc2C1 ZINC000249526557 1433846249 /nfs/dbraw/zinc/84/62/49/1433846249.db2.gz UHVKFZAQSUVLSG-ROUUACIJSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@H+]1CCC[C@H](C)C1)[NH+]1CCc2sccc2C1 ZINC000249526557 1433846251 /nfs/dbraw/zinc/84/62/51/1433846251.db2.gz UHVKFZAQSUVLSG-ROUUACIJSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCC[C@H](C)C1)[N@@H+]1CCc2sccc2C1 ZINC000249526557 1433846253 /nfs/dbraw/zinc/84/62/53/1433846253.db2.gz UHVKFZAQSUVLSG-ROUUACIJSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCC[C@H](C)C1)[N@H+]1CCc2sccc2C1 ZINC000249526557 1433846254 /nfs/dbraw/zinc/84/62/54/1433846254.db2.gz UHVKFZAQSUVLSG-ROUUACIJSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@@H+]1CCCC[C@H]1C)[NH+]1CCc2sccc2C1 ZINC000249530734 1433846539 /nfs/dbraw/zinc/84/65/39/1433846539.db2.gz YIQOGHQQLYXYLN-MSOLQXFVSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[N@H+]1CCCC[C@H]1C)[NH+]1CCc2sccc2C1 ZINC000249530734 1433846540 /nfs/dbraw/zinc/84/65/40/1433846540.db2.gz YIQOGHQQLYXYLN-MSOLQXFVSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCCC[C@H]1C)[N@@H+]1CCc2sccc2C1 ZINC000249530734 1433846541 /nfs/dbraw/zinc/84/65/41/1433846541.db2.gz YIQOGHQQLYXYLN-MSOLQXFVSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCCC[C@H]1C)[N@H+]1CCc2sccc2C1 ZINC000249530734 1433846542 /nfs/dbraw/zinc/84/65/42/1433846542.db2.gz YIQOGHQQLYXYLN-MSOLQXFVSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000249682323 1433848804 /nfs/dbraw/zinc/84/88/04/1433848804.db2.gz ACWSIEGMYOSOAJ-FXAWDEMLSA-N 2 1 378.536 3.240 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)C(C)C ZINC000249733141 1433850223 /nfs/dbraw/zinc/85/02/23/1433850223.db2.gz BYAMZFKDAWHXJK-OALUTQOASA-N 2 1 375.557 3.146 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)C(=O)NC(=O)NC(C)(C)C ZINC000249747026 1433850866 /nfs/dbraw/zinc/85/08/66/1433850866.db2.gz DEWDWVOXLQNHOS-DLBZAZTESA-N 2 1 388.556 3.021 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000249790760 1433852160 /nfs/dbraw/zinc/85/21/60/1433852160.db2.gz USUHZAOFXMDFOV-MSOLQXFVSA-N 2 1 390.547 3.210 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@@H](c2nccs2)C1 ZINC000249902378 1433853498 /nfs/dbraw/zinc/85/34/98/1433853498.db2.gz UBYZFMMKLYUOFJ-MISYRCLQSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@H](c2nccs2)C1 ZINC000249902378 1433853499 /nfs/dbraw/zinc/85/34/99/1433853499.db2.gz UBYZFMMKLYUOFJ-MISYRCLQSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000249902378 1433853501 /nfs/dbraw/zinc/85/35/01/1433853501.db2.gz UBYZFMMKLYUOFJ-MISYRCLQSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@H](c2nccs2)C1 ZINC000249902378 1433853502 /nfs/dbraw/zinc/85/35/02/1433853502.db2.gz UBYZFMMKLYUOFJ-MISYRCLQSA-N 2 1 398.576 3.102 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)C1CCSCC1 ZINC000250084365 1433854317 /nfs/dbraw/zinc/85/43/17/1433854317.db2.gz PMSGVHBNTZJYFB-OXQOHEQNSA-N 2 1 375.582 3.005 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000250575630 1433856976 /nfs/dbraw/zinc/85/69/76/1433856976.db2.gz ZHTAVFZFSKKHPQ-QZTJIDSGSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[N@H+]1CCC[C@@H](C)C1 ZINC000250575630 1433856977 /nfs/dbraw/zinc/85/69/77/1433856977.db2.gz ZHTAVFZFSKKHPQ-QZTJIDSGSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)N2CC[C@@H](C[NH+](C)C)C2)C1 ZINC000251504128 1433858538 /nfs/dbraw/zinc/85/85/38/1433858538.db2.gz FUBOSAUTCZGNFI-ZCNNSNEGSA-N 2 1 386.584 3.258 20 0 GGADMP C[NH+](C)C[C@@H]1CCN(C(=O)NC[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)C1 ZINC000251545721 1433858735 /nfs/dbraw/zinc/85/87/35/1433858735.db2.gz GURZXWGTIDHHJU-QOKNQOGYSA-N 2 1 396.938 3.065 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H](C1CC1)[NH+](C)Cc1ccccc1 ZINC000251554489 1433858972 /nfs/dbraw/zinc/85/89/72/1433858972.db2.gz HZGYLDNJKPUPFI-BHIFYINESA-N 2 1 384.568 3.165 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000251554489 1433858974 /nfs/dbraw/zinc/85/89/74/1433858974.db2.gz HZGYLDNJKPUPFI-BHIFYINESA-N 2 1 384.568 3.165 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000251554489 1433858975 /nfs/dbraw/zinc/85/89/75/1433858975.db2.gz HZGYLDNJKPUPFI-BHIFYINESA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000252094692 1433862700 /nfs/dbraw/zinc/86/27/00/1433862700.db2.gz FGQIGYXLQXHLCC-FGTMMUONSA-N 2 1 378.586 3.305 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)N2CC[NH+](C)C[C@H]2c2ccccc2)C1 ZINC000252193460 1433862787 /nfs/dbraw/zinc/86/27/87/1433862787.db2.gz VFYJFXGHGUELER-ZVDOUQERSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)N2CC[NH+](C)C[C@H]2c2ccccc2)C1 ZINC000252193460 1433862788 /nfs/dbraw/zinc/86/27/88/1433862788.db2.gz VFYJFXGHGUELER-ZVDOUQERSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)C1 ZINC000252193460 1433862791 /nfs/dbraw/zinc/86/27/91/1433862791.db2.gz VFYJFXGHGUELER-ZVDOUQERSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC000252193460 1433862792 /nfs/dbraw/zinc/86/27/92/1433862792.db2.gz VFYJFXGHGUELER-ZVDOUQERSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N(C)[C@@H]3CC[NH+](C)C[C@H]3C)cc2)C1 ZINC000252651978 1433863840 /nfs/dbraw/zinc/86/38/40/1433863840.db2.gz WTYCWUTVORDHEO-WOIUINJBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N(C)[C@@H]3CC[N@H+](C)C[C@H]3C)cc2)C1 ZINC000252651978 1433863842 /nfs/dbraw/zinc/86/38/42/1433863842.db2.gz WTYCWUTVORDHEO-WOIUINJBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N(C)[C@@H]3CC[N@@H+](C)C[C@H]3C)cc2)C1 ZINC000252651978 1433863843 /nfs/dbraw/zinc/86/38/43/1433863843.db2.gz WTYCWUTVORDHEO-WOIUINJBSA-N 2 1 386.584 3.400 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1F ZINC000253357709 1433866041 /nfs/dbraw/zinc/86/60/41/1433866041.db2.gz DZRUTGZRFHMXCE-HZPDHXFCSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1F ZINC000253357709 1433866042 /nfs/dbraw/zinc/86/60/42/1433866042.db2.gz DZRUTGZRFHMXCE-HZPDHXFCSA-N 2 1 387.503 3.239 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(OC)c1 ZINC000255086050 1433876050 /nfs/dbraw/zinc/87/60/50/1433876050.db2.gz GPURWVWOJANTIQ-AMAHLLERSA-N 2 1 388.552 3.276 20 0 GGADMP C/C=C\c1ccc(OC[C@H](O)C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(OC)c1 ZINC000255086050 1433876051 /nfs/dbraw/zinc/87/60/51/1433876051.db2.gz GPURWVWOJANTIQ-AMAHLLERSA-N 2 1 388.552 3.276 20 0 GGADMP C/C=C\c1ccc(OC[C@@H](O)C[N@H+](C)C2CC[NH+](CCC)CC2)c(OC)c1 ZINC000255324691 1433880386 /nfs/dbraw/zinc/88/03/86/1433880386.db2.gz VDBUEFXHNZNCJK-BPJPHKDRSA-N 2 1 376.541 3.274 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]C/C=C\c3ccc(F)cc3)c2)C1 ZINC000255571060 1433885558 /nfs/dbraw/zinc/88/55/58/1433885558.db2.gz NZDXSAIOMSXZMQ-KGRKVLGDSA-N 2 1 381.495 3.326 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]C/C=C\c2ccc(F)cc2)c1 ZINC000255776690 1433889652 /nfs/dbraw/zinc/88/96/52/1433889652.db2.gz XEGSNFOYHXLCHW-RQOWECAXSA-N 2 1 397.494 3.290 20 0 GGADMP CC[C@@H](CNC(=O)N[C@H]1CC[N@H+](C2CCCC2)C1)[NH+]1CCc2ccccc2C1 ZINC000261479712 1433896837 /nfs/dbraw/zinc/89/68/37/1433896837.db2.gz ZXVYQMWRAZYYNP-SFTDATJTSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@@H](CNC(=O)N[C@H]1CC[NH+](C2CCCC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000261479712 1433896839 /nfs/dbraw/zinc/89/68/39/1433896839.db2.gz ZXVYQMWRAZYYNP-SFTDATJTSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@@H](CNC(=O)N[C@H]1CC[NH+](C2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000261479712 1433896841 /nfs/dbraw/zinc/89/68/41/1433896841.db2.gz ZXVYQMWRAZYYNP-SFTDATJTSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@H](CNC(=O)N[C@H]1CC[N@H+](C2CCCC2)C1)[NH+]1CCc2ccccc2C1 ZINC000261479706 1433896849 /nfs/dbraw/zinc/89/68/49/1433896849.db2.gz ZXVYQMWRAZYYNP-LEWJYISDSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@H](CNC(=O)N[C@H]1CC[NH+](C2CCCC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000261479706 1433896852 /nfs/dbraw/zinc/89/68/52/1433896852.db2.gz ZXVYQMWRAZYYNP-LEWJYISDSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@H](CNC(=O)N[C@H]1CC[NH+](C2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000261479706 1433896853 /nfs/dbraw/zinc/89/68/53/1433896853.db2.gz ZXVYQMWRAZYYNP-LEWJYISDSA-N 2 1 384.568 3.139 20 0 GGADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000261820224 1433905353 /nfs/dbraw/zinc/90/53/53/1433905353.db2.gz KGLRBUDMGUPJTC-VKJFTORMSA-N 2 1 399.457 3.226 20 0 GGADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000261820218 1433905357 /nfs/dbraw/zinc/90/53/57/1433905357.db2.gz KGLRBUDMGUPJTC-RKVPGOIHSA-N 2 1 399.457 3.226 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]1CC(=O)N1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000261817525 1433905434 /nfs/dbraw/zinc/90/54/34/1433905434.db2.gz SHPILOGTILYCBM-FUHWJXTLSA-N 2 1 383.458 3.257 20 0 GGADMP FC(F)(F)c1cc(C[N@@H+]2CC[C@H](N3CC[NH2+]CC3)C2)cc(C(F)(F)F)c1 ZINC000261827816 1433905831 /nfs/dbraw/zinc/90/58/31/1433905831.db2.gz AAUITIBLHXIDJN-HNNXBMFYSA-N 2 1 381.364 3.204 20 0 GGADMP FC(F)(F)c1cc(C[N@H+]2CC[C@H](N3CC[NH2+]CC3)C2)cc(C(F)(F)F)c1 ZINC000261827816 1433905832 /nfs/dbraw/zinc/90/58/32/1433905832.db2.gz AAUITIBLHXIDJN-HNNXBMFYSA-N 2 1 381.364 3.204 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]1CC(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000261867366 1433908544 /nfs/dbraw/zinc/90/85/44/1433908544.db2.gz XMMBUWYYCMGFAN-FCHUYYIVSA-N 2 1 377.532 3.438 20 0 GGADMP Cc1ccc(-c2nc(C[N@@H+]3CCC[C@@H](CNC(=O)[C@H]4CCC[NH2+]4)C3)cs2)cc1 ZINC000261897600 1433910632 /nfs/dbraw/zinc/91/06/32/1433910632.db2.gz REZGFOCDMZESPJ-FXAWDEMLSA-N 2 1 398.576 3.199 20 0 GGADMP Cc1ccc(-c2nc(C[N@H+]3CCC[C@@H](CNC(=O)[C@H]4CCC[NH2+]4)C3)cs2)cc1 ZINC000261897600 1433910633 /nfs/dbraw/zinc/91/06/33/1433910633.db2.gz REZGFOCDMZESPJ-FXAWDEMLSA-N 2 1 398.576 3.199 20 0 GGADMP Cc1cccn2cc(COc3ccc(C[N@@H+]4CC[C@@]5(CC[NH2+]C5)C4)cc3)nc12 ZINC000261936385 1433914116 /nfs/dbraw/zinc/91/41/16/1433914116.db2.gz DGVKRPVKLBSQQQ-HSZRJFAPSA-N 2 1 376.504 3.407 20 0 GGADMP Cc1cccn2cc(COc3ccc(C[N@H+]4CC[C@@]5(CC[NH2+]C5)C4)cc3)nc12 ZINC000261936385 1433914120 /nfs/dbraw/zinc/91/41/20/1433914120.db2.gz DGVKRPVKLBSQQQ-HSZRJFAPSA-N 2 1 376.504 3.407 20 0 GGADMP O=C([C@H]1CCC[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1)N1CC[NH2+]CC1 ZINC000261959793 1433916461 /nfs/dbraw/zinc/91/64/61/1433916461.db2.gz PCHPWCGUOHIMJH-AWEZNQCLSA-N 2 1 389.849 3.003 20 0 GGADMP O=C([C@H]1CCC[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1)N1CC[NH2+]CC1 ZINC000261959793 1433916470 /nfs/dbraw/zinc/91/64/70/1433916470.db2.gz PCHPWCGUOHIMJH-AWEZNQCLSA-N 2 1 389.849 3.003 20 0 GGADMP C[NH2+]CCC1CC[NH+](Cc2nc(-c3ccc(OC(F)F)c(OC)c3)no2)CC1 ZINC000261970739 1433917850 /nfs/dbraw/zinc/91/78/50/1433917850.db2.gz DAIXYLKRONEBNO-UHFFFAOYSA-N 2 1 396.438 3.168 20 0 GGADMP O=C(NC[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1)[C@H]1CC12CC[NH2+]CC2 ZINC000261969902 1433917911 /nfs/dbraw/zinc/91/79/11/1433917911.db2.gz UHYNEXRPYJKBIV-RTBURBONSA-N 2 1 375.944 3.200 20 0 GGADMP O=C(NC[C@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1)[C@H]1CC12CC[NH2+]CC2 ZINC000261969902 1433917922 /nfs/dbraw/zinc/91/79/22/1433917922.db2.gz UHYNEXRPYJKBIV-RTBURBONSA-N 2 1 375.944 3.200 20 0 GGADMP O=C(NC[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000261969891 1433917987 /nfs/dbraw/zinc/91/79/87/1433917987.db2.gz UHYNEXRPYJKBIV-MOPGFXCFSA-N 2 1 375.944 3.200 20 0 GGADMP O=C(NC[C@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000261969891 1433917993 /nfs/dbraw/zinc/91/79/93/1433917993.db2.gz UHYNEXRPYJKBIV-MOPGFXCFSA-N 2 1 375.944 3.200 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2ccccc2OC)cc1)C1CC1 ZINC000261974883 1433918010 /nfs/dbraw/zinc/91/80/10/1433918010.db2.gz NNKYAMFIOUZVPT-QFIPXVFZSA-N 2 1 393.531 3.466 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2ccccc2OC)cc1)C1CC1 ZINC000261974883 1433918014 /nfs/dbraw/zinc/91/80/14/1433918014.db2.gz NNKYAMFIOUZVPT-QFIPXVFZSA-N 2 1 393.531 3.466 20 0 GGADMP O=C(NC[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1)[C@H]1CC12CC[NH2+]CC2 ZINC000261969899 1433918178 /nfs/dbraw/zinc/91/81/78/1433918178.db2.gz UHYNEXRPYJKBIV-RBUKOAKNSA-N 2 1 375.944 3.200 20 0 GGADMP O=C(NC[C@@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1)[C@H]1CC12CC[NH2+]CC2 ZINC000261969899 1433918185 /nfs/dbraw/zinc/91/81/85/1433918185.db2.gz UHYNEXRPYJKBIV-RBUKOAKNSA-N 2 1 375.944 3.200 20 0 GGADMP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000261981107 1433919316 /nfs/dbraw/zinc/91/93/16/1433919316.db2.gz RIRWOMXKOBDWFA-QAPCUYQASA-N 2 1 383.458 3.094 20 0 GGADMP [NH3+]CCC(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccc(SC(F)(F)F)cc1 ZINC000262029440 1433923248 /nfs/dbraw/zinc/92/32/48/1433923248.db2.gz NXSGRCUFCLPOHJ-AWEZNQCLSA-N 2 1 375.460 3.118 20 0 GGADMP [NH3+]CCC(=O)NC[C@H]1CCCC[N@H+]1Cc1ccc(SC(F)(F)F)cc1 ZINC000262029442 1433923353 /nfs/dbraw/zinc/92/33/53/1433923353.db2.gz NXSGRCUFCLPOHJ-CQSZACIVSA-N 2 1 375.460 3.118 20 0 GGADMP C[NH2+]CCC1CCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000262102851 1433926915 /nfs/dbraw/zinc/92/69/15/1433926915.db2.gz SZNYVUYEJWAXHG-FQEVSTJZSA-N 2 1 397.485 3.289 20 0 GGADMP C[NH2+]CCC1CCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000262102855 1433927283 /nfs/dbraw/zinc/92/72/83/1433927283.db2.gz SZNYVUYEJWAXHG-HXUWFJFHSA-N 2 1 397.485 3.289 20 0 GGADMP COc1ccccc1-c1ccc(C[N@H+]2CCCC[C@@H]2CNC(=O)CC[NH3+])cc1 ZINC000262120315 1433927582 /nfs/dbraw/zinc/92/75/82/1433927582.db2.gz XEWWFBFUTKAGSY-HXUWFJFHSA-N 2 1 381.520 3.182 20 0 GGADMP O=C(Nc1cccc(C[N@H+]2CC[C@H](N3CC[NH2+]CC3)C2)c1)c1ccc(Cl)cc1 ZINC000262136789 1433928202 /nfs/dbraw/zinc/92/82/02/1433928202.db2.gz OTZLQYCYZAXSGH-NRFANRHFSA-N 2 1 398.938 3.072 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)C2C[C@H]3CCC[C@@H](C2)C3[NH3+])[C@H]1c1cccs1 ZINC000262278909 1433933493 /nfs/dbraw/zinc/93/34/93/1433933493.db2.gz LKVKYBCCTMAVKH-YHAOAENYSA-N 2 1 375.582 3.401 20 0 GGADMP C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)C3C[C@H]4CCC[C@@H](C3)C4[NH3+])cc2)C1 ZINC000262303742 1433934257 /nfs/dbraw/zinc/93/42/57/1433934257.db2.gz OFDURMNKZBWTKN-ACOKINFVSA-N 2 1 385.552 3.499 20 0 GGADMP C[C@H](C(=O)N1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1)C1C[NH2+]C1 ZINC000262409661 1433938191 /nfs/dbraw/zinc/93/81/91/1433938191.db2.gz QNMCOFXLCFUJKW-HNNXBMFYSA-N 2 1 387.524 3.054 20 0 GGADMP C[C@@H](C(=O)N(Cc1ccccn1)[C@H]1CCC[NH2+]CC1)[N@@H+](C)Cc1ccccc1 ZINC000262438610 1433939190 /nfs/dbraw/zinc/93/91/90/1433939190.db2.gz UQSYHTNFHOHQLE-UGKGYDQZSA-N 2 1 380.536 3.073 20 0 GGADMP C[C@@H](CC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)[C@H]1CCC[NH2+]C1 ZINC000262673606 1433949204 /nfs/dbraw/zinc/94/92/04/1433949204.db2.gz QEHREKMDBLNTAB-HKUYNNGSSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@@H](CC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)[C@H]1CCC[NH2+]C1 ZINC000262673606 1433949209 /nfs/dbraw/zinc/94/92/09/1433949209.db2.gz QEHREKMDBLNTAB-HKUYNNGSSA-N 2 1 377.960 3.400 20 0 GGADMP COc1ccc([C@H](CNC(=O)[C@@H]([NH3+])c2ccc(C)cc2)[NH+]2CCCCC2)cc1 ZINC000262672198 1433949370 /nfs/dbraw/zinc/94/93/70/1433949370.db2.gz SBUVOZMUQZOXQB-VXKWHMMOSA-N 2 1 381.520 3.347 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1(C)C ZINC000262752397 1433954035 /nfs/dbraw/zinc/95/40/35/1433954035.db2.gz ACTVHYKREJXHJN-XTQVGHSUSA-N 2 1 387.568 3.067 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1(C)C ZINC000262762680 1433954434 /nfs/dbraw/zinc/95/44/34/1433954434.db2.gz DSGHPKFOJDVBST-WGGBDISSSA-N 2 1 387.568 3.067 20 0 GGADMP CCO[C@H]1C[C@@]([NH3+])(C(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1(C)C ZINC000262792592 1433956620 /nfs/dbraw/zinc/95/66/20/1433956620.db2.gz OKZYGIQXIQXHDZ-XUZZJYLKSA-N 2 1 395.547 3.017 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)NCc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)C1(C)C ZINC000262816461 1433958429 /nfs/dbraw/zinc/95/84/29/1433958429.db2.gz WWJKYRHKIMRFMD-LLBVYWAGSA-N 2 1 387.568 3.210 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)NCc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)C1(C)C ZINC000262816468 1433958490 /nfs/dbraw/zinc/95/84/90/1433958490.db2.gz WWJKYRHKIMRFMD-XTQVGHSUSA-N 2 1 387.568 3.210 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)NCc2ccccc2C[N@H+]2CCCC[C@@H]2C)C1(C)C ZINC000262818696 1433958681 /nfs/dbraw/zinc/95/86/81/1433958681.db2.gz XNWDYUHYYWOLLE-WGGBDISSSA-N 2 1 387.568 3.210 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1ccn([C@@H]2CCC[NH2+]C2)n1 ZINC000262832923 1433959962 /nfs/dbraw/zinc/95/99/62/1433959962.db2.gz SEYVPSXPDVGUTA-WIYYLYMNSA-N 2 1 395.551 3.112 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccn([C@H]4CCC[NH2+]C4)n3)cc2)C1 ZINC000262834192 1433960099 /nfs/dbraw/zinc/96/00/99/1433960099.db2.gz SJRIORMPYKNQTL-XLIONFOSSA-N 2 1 381.524 3.292 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1ccn([C@H]2CCC[NH2+]C2)n1 ZINC000262832921 1433960209 /nfs/dbraw/zinc/96/02/09/1433960209.db2.gz SEYVPSXPDVGUTA-RXVVDRJESA-N 2 1 395.551 3.112 20 0 GGADMP Cc1ccc(NC(=O)[C@@](C)([NH3+])c2ccccc2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000262909178 1433966217 /nfs/dbraw/zinc/96/62/17/1433966217.db2.gz QMTSSBSFBLMGKH-QHCPKHFHSA-N 2 1 394.519 3.232 20 0 GGADMP C[C@]1([NH3+])CCCC[C@@H]1C(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000263197042 1433993810 /nfs/dbraw/zinc/99/38/10/1433993810.db2.gz INMAVMJMUQZGFQ-LMMKCTJWSA-N 2 1 383.458 3.304 20 0 GGADMP Cc1ccc(NC(=O)[C@H]2CCCC[C@]2(C)[NH3+])cc1NC(=O)C[NH+]1CCCCC1 ZINC000263246696 1433998032 /nfs/dbraw/zinc/99/80/32/1433998032.db2.gz PJZDXAUYRBBELI-GCJKJVERSA-N 2 1 386.540 3.266 20 0 GGADMP COCCC[NH+]1CCC([NH2+]Cc2ccc(OCc3ccncc3)c(OC)c2)CC1 ZINC000263739192 1434027222 /nfs/dbraw/zinc/02/72/22/1434027222.db2.gz DWIIMKSYVHICAZ-UHFFFAOYSA-N 2 1 399.535 3.260 20 0 GGADMP COCCC[NH+]1CCC([NH2+]Cc2ccc(OC)c(OCc3cccnc3)c2)CC1 ZINC000263759888 1434030394 /nfs/dbraw/zinc/03/03/94/1434030394.db2.gz HWLDYRFYSBGJIT-UHFFFAOYSA-N 2 1 399.535 3.260 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cn3ccccc3n2)cc1OC ZINC000263880326 1434044975 /nfs/dbraw/zinc/04/49/75/1434044975.db2.gz BUFDYXRRDDLPDH-UHFFFAOYSA-N 2 1 382.508 3.353 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000264304349 1434095135 /nfs/dbraw/zinc/09/51/35/1434095135.db2.gz ZPABXFXGWAKBOP-UHFFFAOYSA-N 2 1 375.476 3.102 20 0 GGADMP Cc1sc2nc([C@H](C)[N@@H+](C)CC3CC[NH+](C[C@H](C)O)CC3)[nH]c(=O)c2c1C ZINC000264359318 1434101829 /nfs/dbraw/zinc/10/18/29/1434101829.db2.gz JELBFOYJUPDTEG-JSGCOSHPSA-N 2 1 392.569 3.099 20 0 GGADMP Cc1sc2nc([C@H](C)[N@H+](C)CC3CC[NH+](C[C@H](C)O)CC3)[nH]c(=O)c2c1C ZINC000264359318 1434101830 /nfs/dbraw/zinc/10/18/30/1434101830.db2.gz JELBFOYJUPDTEG-JSGCOSHPSA-N 2 1 392.569 3.099 20 0 GGADMP Cc1sc2nc([C@H](C)[N@@H+](C)CC3CC[NH+](C[C@@H](C)O)CC3)[nH]c(=O)c2c1C ZINC000264359319 1434101870 /nfs/dbraw/zinc/10/18/70/1434101870.db2.gz JELBFOYJUPDTEG-OCCSQVGLSA-N 2 1 392.569 3.099 20 0 GGADMP Cc1sc2nc([C@H](C)[N@H+](C)CC3CC[NH+](C[C@@H](C)O)CC3)[nH]c(=O)c2c1C ZINC000264359319 1434101877 /nfs/dbraw/zinc/10/18/77/1434101877.db2.gz JELBFOYJUPDTEG-OCCSQVGLSA-N 2 1 392.569 3.099 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCSCC1)N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000264447117 1434113910 /nfs/dbraw/zinc/11/39/10/1434113910.db2.gz FVSHUGATOVLUNU-IBGZPJMESA-N 2 1 388.581 3.328 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)cc1)[NH+]1CCOCC1 ZINC000265359584 1434224344 /nfs/dbraw/zinc/22/43/44/1434224344.db2.gz FZFALZNZFYTAJV-GHTZIAJQSA-N 2 1 386.540 3.172 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)NC2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000265487820 1434238889 /nfs/dbraw/zinc/23/88/89/1434238889.db2.gz FOOZWAZXUKJLOU-HXUWFJFHSA-N 2 1 387.568 3.149 20 0 GGADMP CCOC(=O)CCCC[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000265811086 1434267036 /nfs/dbraw/zinc/26/70/36/1434267036.db2.gz PVKQDHALYJMJSF-NRFANRHFSA-N 2 1 376.541 3.097 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2cc(C(N)=O)ccc2C[NH+](C)C)cc1 ZINC000266076839 1434301613 /nfs/dbraw/zinc/30/16/13/1434301613.db2.gz YOJOYJHOVULKDZ-UHFFFAOYSA-N 2 1 396.535 3.331 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)[C@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)C1 ZINC000266426786 1434334780 /nfs/dbraw/zinc/33/47/80/1434334780.db2.gz RFVVGWWUFMPIMS-QUCCMNQESA-N 2 1 397.485 3.241 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)[C@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)C1 ZINC000266426786 1434334781 /nfs/dbraw/zinc/33/47/81/1434334781.db2.gz RFVVGWWUFMPIMS-QUCCMNQESA-N 2 1 397.485 3.241 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000266426786 1434334782 /nfs/dbraw/zinc/33/47/82/1434334782.db2.gz RFVVGWWUFMPIMS-QUCCMNQESA-N 2 1 397.485 3.241 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C(=O)[C@@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)C1 ZINC000266426788 1434334837 /nfs/dbraw/zinc/33/48/37/1434334837.db2.gz RFVVGWWUFMPIMS-UYAOXDASSA-N 2 1 397.485 3.241 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)[C@@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)C1 ZINC000266426788 1434334838 /nfs/dbraw/zinc/33/48/38/1434334838.db2.gz RFVVGWWUFMPIMS-UYAOXDASSA-N 2 1 397.485 3.241 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000266426788 1434334840 /nfs/dbraw/zinc/33/48/40/1434334840.db2.gz RFVVGWWUFMPIMS-UYAOXDASSA-N 2 1 397.485 3.241 20 0 GGADMP C[NH+](C)C/C=C/C(=O)N(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000266460285 1434339497 /nfs/dbraw/zinc/33/94/97/1434339497.db2.gz HJVGOXKTNGRUKP-AHKGRUIUSA-N 2 1 383.458 3.017 20 0 GGADMP CC[N@@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)NCCCCn1cc[nH+]c1C ZINC000266738748 1434369709 /nfs/dbraw/zinc/36/97/09/1434369709.db2.gz CLTKNYIGJCIOHV-NRFANRHFSA-N 2 1 398.555 3.063 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)NCCCCn1cc[nH+]c1C ZINC000266738748 1434369710 /nfs/dbraw/zinc/36/97/10/1434369710.db2.gz CLTKNYIGJCIOHV-NRFANRHFSA-N 2 1 398.555 3.063 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@@H]2CCc3c2cccc3F)c1 ZINC000266998556 1434397640 /nfs/dbraw/zinc/39/76/40/1434397640.db2.gz BQFWODHWBNMWMV-JOCHJYFZSA-N 2 1 397.494 3.264 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCc4c3cccc4F)c2)C1 ZINC000267078590 1434405968 /nfs/dbraw/zinc/40/59/68/1434405968.db2.gz UNPPQRIRBSDWRF-GCJKJVERSA-N 2 1 381.495 3.300 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000267298172 1434420557 /nfs/dbraw/zinc/42/05/57/1434420557.db2.gz FANNXQFOAZBICX-XMSQKQJNSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000267359325 1434425516 /nfs/dbraw/zinc/42/55/16/1434425516.db2.gz IZQNSTCFNCKSEZ-CEMLEFRQSA-N 2 1 384.568 3.024 20 0 GGADMP CC(C)(C)OC1CC[NH+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000268289407 1434509022 /nfs/dbraw/zinc/50/90/22/1434509022.db2.gz ISWXIYCABPISQC-UHFFFAOYSA-N 2 1 387.568 3.178 20 0 GGADMP C[C@H]1C[C@H](NCc2ccc(N3CCOCC3)nc2)CC[N@H+]1Cc1ccccc1 ZINC000268741806 1434551881 /nfs/dbraw/zinc/55/18/81/1434551881.db2.gz GDNKEDOUDWWDJW-SIKLNZKXSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CCN1Cc1ccccc1 ZINC000268741806 1434551882 /nfs/dbraw/zinc/55/18/82/1434551882.db2.gz GDNKEDOUDWWDJW-SIKLNZKXSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CC[N@@H+]1Cc1ccccc1 ZINC000268741806 1434551883 /nfs/dbraw/zinc/55/18/83/1434551883.db2.gz GDNKEDOUDWWDJW-SIKLNZKXSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCOCC3)nc2)CC[N@H+]1Cc1ccccc1 ZINC000268741806 1434551884 /nfs/dbraw/zinc/55/18/84/1434551884.db2.gz GDNKEDOUDWWDJW-SIKLNZKXSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2Cn2cncn2)CC[N@@H+]1Cc1ccccc1 ZINC000268760190 1434553744 /nfs/dbraw/zinc/55/37/44/1434553744.db2.gz LAXSMLHOXQQMMD-WMZHIEFXSA-N 2 1 375.520 3.469 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2Cn2cncn2)CC[N@H+]1Cc1ccccc1 ZINC000268760190 1434553746 /nfs/dbraw/zinc/55/37/46/1434553746.db2.gz LAXSMLHOXQQMMD-WMZHIEFXSA-N 2 1 375.520 3.469 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000268770894 1434555189 /nfs/dbraw/zinc/55/51/89/1434555189.db2.gz SLCGIONEMPONKH-VOQZNFBZSA-N 2 1 384.520 3.237 20 0 GGADMP COCc1ccc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)o1 ZINC000268772735 1434555590 /nfs/dbraw/zinc/55/55/90/1434555590.db2.gz FWJJKIULBVDQTF-UHFFFAOYSA-N 2 1 388.508 3.205 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Cn3cncn3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000268775919 1434555976 /nfs/dbraw/zinc/55/59/76/1434555976.db2.gz VVJFGFBGSGUKAL-WMZHIEFXSA-N 2 1 375.520 3.469 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Cn3cncn3)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268775919 1434555978 /nfs/dbraw/zinc/55/59/78/1434555978.db2.gz VVJFGFBGSGUKAL-WMZHIEFXSA-N 2 1 375.520 3.469 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(CS(C)(=O)=O)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000268808198 1434559766 /nfs/dbraw/zinc/55/97/66/1434559766.db2.gz SOYPJNAJKSEPDP-PGRDOPGGSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(CS(C)(=O)=O)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268808198 1434559767 /nfs/dbraw/zinc/55/97/67/1434559767.db2.gz SOYPJNAJKSEPDP-PGRDOPGGSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(CS(C)(=O)=O)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000268808197 1434559816 /nfs/dbraw/zinc/55/98/16/1434559816.db2.gz SOYPJNAJKSEPDP-GCJKJVERSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(CS(C)(=O)=O)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268808197 1434559818 /nfs/dbraw/zinc/55/98/18/1434559818.db2.gz SOYPJNAJKSEPDP-GCJKJVERSA-N 2 1 386.561 3.374 20 0 GGADMP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)cc1 ZINC000268811254 1434560037 /nfs/dbraw/zinc/56/00/37/1434560037.db2.gz KYSIZVHJKLFCLM-GOSISDBHSA-N 2 1 381.520 3.324 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2ccc(OC)c(Cn3cccn3)c2)CC1 ZINC000268826582 1434561489 /nfs/dbraw/zinc/56/14/89/1434561489.db2.gz PRLPIOWRHIWTNL-FQEVSTJZSA-N 2 1 399.583 3.008 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(NS(C)(=O)=O)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268839552 1434563410 /nfs/dbraw/zinc/56/34/10/1434563410.db2.gz QMSRHMPWNJLMAT-UTKZUKDTSA-N 2 1 387.549 3.201 20 0 GGADMP CC[C@@H]([NH2+]Cc1ccc(C(=O)N2CC[NH+](C)CC2)cc1)c1ccc2c(c1)CCO2 ZINC000268842308 1434563597 /nfs/dbraw/zinc/56/35/97/1434563597.db2.gz UKGBEYYYXXWZRK-JOCHJYFZSA-N 2 1 393.531 3.250 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(C(=O)c3ccncc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000268867326 1434566181 /nfs/dbraw/zinc/56/61/81/1434566181.db2.gz WYUAUMTUMUDFIW-WMZHIEFXSA-N 2 1 392.547 3.329 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(C(=O)c3ccncc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000268867326 1434566182 /nfs/dbraw/zinc/56/61/82/1434566182.db2.gz WYUAUMTUMUDFIW-WMZHIEFXSA-N 2 1 392.547 3.329 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(C(=O)c3ccncc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000268867321 1434566193 /nfs/dbraw/zinc/56/61/93/1434566193.db2.gz WYUAUMTUMUDFIW-AUSIDOKSSA-N 2 1 392.547 3.329 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(C(=O)c3ccncc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000268867321 1434566194 /nfs/dbraw/zinc/56/61/94/1434566194.db2.gz WYUAUMTUMUDFIW-AUSIDOKSSA-N 2 1 392.547 3.329 20 0 GGADMP COc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000268875024 1434566948 /nfs/dbraw/zinc/56/69/48/1434566948.db2.gz GTWFUXVZLQCRDP-KNQAVFIVSA-N 2 1 393.531 3.170 20 0 GGADMP COCCOc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1OC ZINC000268877739 1434567287 /nfs/dbraw/zinc/56/72/87/1434567287.db2.gz ZELPYGYSMIVVBB-CEXWTWQISA-N 2 1 394.556 3.260 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000268903220 1434569377 /nfs/dbraw/zinc/56/93/77/1434569377.db2.gz WZZNWQMBULBXBF-ZDUSSCGKSA-N 2 1 384.402 3.487 20 0 GGADMP CNC(=O)[C@H](Cc1c[nH]c2ccccc12)[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000268928409 1434571787 /nfs/dbraw/zinc/57/17/87/1434571787.db2.gz WVLXRGXXFCOJJV-LLBVYWAGSA-N 2 1 396.579 3.458 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000268963811 1434576124 /nfs/dbraw/zinc/57/61/24/1434576124.db2.gz BLEYKVJIVIBVJJ-RYFAJOAYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000268963811 1434576126 /nfs/dbraw/zinc/57/61/26/1434576126.db2.gz BLEYKVJIVIBVJJ-RYFAJOAYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000268963811 1434576130 /nfs/dbraw/zinc/57/61/30/1434576130.db2.gz BLEYKVJIVIBVJJ-RYFAJOAYSA-N 2 1 384.568 3.023 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)cc1 ZINC000268972109 1434577028 /nfs/dbraw/zinc/57/70/28/1434577028.db2.gz ZPZOLTBBNIZDQF-YLJYHZDGSA-N 2 1 376.545 3.104 20 0 GGADMP Cc1ccc(NC(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000269230323 1434610548 /nfs/dbraw/zinc/61/05/48/1434610548.db2.gz CJWRCVDNFISCDT-QFUCXCTJSA-N 2 1 398.551 3.279 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=O)N(C)CCCn2cc[nH+]c2C)cc1 ZINC000269511651 1434655325 /nfs/dbraw/zinc/65/53/25/1434655325.db2.gz FLZNFIZNGMRQOW-UHFFFAOYSA-N 2 1 387.528 3.466 20 0 GGADMP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C1 ZINC000269677218 1434668682 /nfs/dbraw/zinc/66/86/82/1434668682.db2.gz CYQUAWUUHVHNDD-ZHALLVOQSA-N 2 1 381.520 3.058 20 0 GGADMP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C1 ZINC000269677215 1434668707 /nfs/dbraw/zinc/66/87/07/1434668707.db2.gz CYQUAWUUHVHNDD-YQVWRLOYSA-N 2 1 381.520 3.058 20 0 GGADMP O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C1 ZINC000269716124 1434671350 /nfs/dbraw/zinc/67/13/50/1434671350.db2.gz SFFBYFCHSRDCIQ-MJGOQNOKSA-N 2 1 381.520 3.200 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H]3CCc4c3c(F)ccc4F)c2)C1 ZINC000269884649 1434684136 /nfs/dbraw/zinc/68/41/36/1434684136.db2.gz ZVTGHAMHOLDKRD-LAUBAEHRSA-N 2 1 399.485 3.439 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4c3c(F)ccc4F)c2)C1 ZINC000269884649 1434684138 /nfs/dbraw/zinc/68/41/38/1434684138.db2.gz ZVTGHAMHOLDKRD-LAUBAEHRSA-N 2 1 399.485 3.439 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000270085899 1434701335 /nfs/dbraw/zinc/70/13/35/1434701335.db2.gz KCLTZGBMJLSNTI-JOCHJYFZSA-N 2 1 386.584 3.400 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000270085901 1434701406 /nfs/dbraw/zinc/70/14/06/1434701406.db2.gz KCLTZGBMJLSNTI-QFIPXVFZSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000270246444 1434716128 /nfs/dbraw/zinc/71/61/28/1434716128.db2.gz PWOVBONSOKNCRI-UEVCKROQSA-N 2 1 398.595 3.413 20 0 GGADMP COc1ccc(-c2n[nH]cc2C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000271206645 1434808085 /nfs/dbraw/zinc/80/80/85/1434808085.db2.gz KIAWWADJRRASSG-UHFFFAOYSA-N 2 1 397.567 3.076 20 0 GGADMP CC(=O)Nc1cccc(OCC[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)c1 ZINC000271425086 1434823749 /nfs/dbraw/zinc/82/37/49/1434823749.db2.gz CNEQMOCOQIICNV-UHFFFAOYSA-N 2 1 399.510 3.460 20 0 GGADMP Cc1c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cnn1-c1ccc(F)cc1 ZINC000271503967 1434830041 /nfs/dbraw/zinc/83/00/41/1434830041.db2.gz MKTZCFZZOZPMFY-ARBPTSGCSA-N 2 1 386.515 3.348 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccc(S(N)(=O)=O)c1 ZINC000271611897 1434839000 /nfs/dbraw/zinc/83/90/00/1434839000.db2.gz AVHPJPSWBNESCT-FUHIMQAGSA-N 2 1 387.549 3.038 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccc(S(N)(=O)=O)c1 ZINC000271611897 1434839002 /nfs/dbraw/zinc/83/90/02/1434839002.db2.gz AVHPJPSWBNESCT-FUHIMQAGSA-N 2 1 387.549 3.038 20 0 GGADMP CN(CC[N@@H+](C)Cc1ccc(OCc2cccnc2)cc1)C1CC[NH+](C)CC1 ZINC000271619767 1434839619 /nfs/dbraw/zinc/83/96/19/1434839619.db2.gz DPQXPJGPNSPOLH-UHFFFAOYSA-N 2 1 382.552 3.118 20 0 GGADMP C[NH+](CCCn1ccnc1)Cc1cccc(C[N@@H+](C)CCCn2ccnc2)c1 ZINC000271682979 1434844007 /nfs/dbraw/zinc/84/40/07/1434844007.db2.gz KFHTUMBYGKNEMB-UHFFFAOYSA-N 2 1 380.540 3.124 20 0 GGADMP C[C@H]([NH2+][C@@H]1CCCN(CC(F)(F)F)C1=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272160669 1434875460 /nfs/dbraw/zinc/87/54/60/1434875460.db2.gz DMBSQJVDVIMLFY-RYQLBKOJSA-N 2 1 383.458 3.040 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272270322 1434883007 /nfs/dbraw/zinc/88/30/07/1434883007.db2.gz CZDGXYOEPOWNKE-GHTZIAJQSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272270322 1434883010 /nfs/dbraw/zinc/88/30/10/1434883010.db2.gz CZDGXYOEPOWNKE-GHTZIAJQSA-N 2 1 383.540 3.134 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000272316911 1434886801 /nfs/dbraw/zinc/88/68/01/1434886801.db2.gz KDAFHASKTJBAPK-MSOLQXFVSA-N 2 1 389.590 3.044 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000272316911 1434886803 /nfs/dbraw/zinc/88/68/03/1434886803.db2.gz KDAFHASKTJBAPK-MSOLQXFVSA-N 2 1 389.590 3.044 20 0 GGADMP C[C@H]([NH2+]C1CCN(C(=O)c2ccco2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272345890 1434889128 /nfs/dbraw/zinc/88/91/28/1434889128.db2.gz PTABIZQODKBOOA-AZUAARDMSA-N 2 1 381.520 3.384 20 0 GGADMP C[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272350887 1434889389 /nfs/dbraw/zinc/88/93/89/1434889389.db2.gz YETOJTVCDFYTJV-JBACZVJFSA-N 2 1 395.551 3.008 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272375461 1434891416 /nfs/dbraw/zinc/89/14/16/1434891416.db2.gz HCXTZZJXJXDCRL-GHTZIAJQSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272375461 1434891418 /nfs/dbraw/zinc/89/14/18/1434891418.db2.gz HCXTZZJXJXDCRL-GHTZIAJQSA-N 2 1 383.540 3.182 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272400184 1434893986 /nfs/dbraw/zinc/89/39/86/1434893986.db2.gz YSPHCUZGOQVKFJ-VJBMBRPKSA-N 2 1 398.595 3.270 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272447592 1434896984 /nfs/dbraw/zinc/89/69/84/1434896984.db2.gz MDERSAGXOVDMSK-YSIASYRMSA-N 2 1 384.524 3.092 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272447592 1434896986 /nfs/dbraw/zinc/89/69/86/1434896986.db2.gz MDERSAGXOVDMSK-YSIASYRMSA-N 2 1 384.524 3.092 20 0 GGADMP C[N@H+]1CC[C@@H]2CCN(C(=O)Nc3ccc(OCC[NH+]4CCCCC4)cc3)[C@@H]2C1 ZINC000272449721 1434897213 /nfs/dbraw/zinc/89/72/13/1434897213.db2.gz PLOGFYPPXJBGNS-WIYYLYMNSA-N 2 1 386.540 3.109 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H]2C[C@@H](NC(=O)OC(C)(C)C)c3ccccc32)CC1 ZINC000272508465 1434901849 /nfs/dbraw/zinc/90/18/49/1434901849.db2.gz FWEYALOVFFIKFP-WOJBJXKFSA-N 2 1 389.540 3.398 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000272534802 1434904998 /nfs/dbraw/zinc/90/49/98/1434904998.db2.gz PDWOYLSULQSAJV-BDKRGJGYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272534802 1434905001 /nfs/dbraw/zinc/90/50/01/1434905001.db2.gz PDWOYLSULQSAJV-BDKRGJGYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272534802 1434905003 /nfs/dbraw/zinc/90/50/03/1434905003.db2.gz PDWOYLSULQSAJV-BDKRGJGYSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+]1CCC(C)(CNC(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000272535528 1434905341 /nfs/dbraw/zinc/90/53/41/1434905341.db2.gz NDKLMAZTFYHMKJ-UHFFFAOYSA-N 2 1 376.570 3.089 20 0 GGADMP C[C@H](NC(=O)N1CCC(CC[NH+](C)C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272543432 1434906067 /nfs/dbraw/zinc/90/60/67/1434906067.db2.gz QDTYTHULIFLKAY-SIKLNZKXSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21 ZINC000272579352 1434910354 /nfs/dbraw/zinc/91/03/54/1434910354.db2.gz MGKNYCNIVWVGLJ-PSWRPDDJSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000272579352 1434910357 /nfs/dbraw/zinc/91/03/57/1434910357.db2.gz MGKNYCNIVWVGLJ-PSWRPDDJSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21 ZINC000272579352 1434910360 /nfs/dbraw/zinc/91/03/60/1434910360.db2.gz MGKNYCNIVWVGLJ-PSWRPDDJSA-N 2 1 384.568 3.023 20 0 GGADMP Cc1ccc([C@@H]([NH2+]CC2=CC[N@@H+](C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000272609116 1434914436 /nfs/dbraw/zinc/91/44/36/1434914436.db2.gz KCWPQTMSUIROEL-JOCHJYFZSA-N 2 1 384.545 3.339 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[NH+](C)C[C@@H]21 ZINC000272610113 1434914886 /nfs/dbraw/zinc/91/48/86/1434914886.db2.gz RPDDLYXGGRGKBJ-AVRDEDQJSA-N 2 1 396.535 3.147 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[NH+](C)C[C@@H]21 ZINC000272610113 1434914890 /nfs/dbraw/zinc/91/48/90/1434914890.db2.gz RPDDLYXGGRGKBJ-AVRDEDQJSA-N 2 1 396.535 3.147 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[N@H+](C)C[C@@H]21 ZINC000272610113 1434914895 /nfs/dbraw/zinc/91/48/95/1434914895.db2.gz RPDDLYXGGRGKBJ-AVRDEDQJSA-N 2 1 396.535 3.147 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[N@@H+](C)C[C@@H]21 ZINC000272610113 1434914898 /nfs/dbraw/zinc/91/48/98/1434914898.db2.gz RPDDLYXGGRGKBJ-AVRDEDQJSA-N 2 1 396.535 3.147 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(N2CCO[C@H](C)C2)nc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272691942 1434923290 /nfs/dbraw/zinc/92/32/90/1434923290.db2.gz WBSJSBDAYPEPIE-QTEQDKRBSA-N 2 1 394.563 3.307 20 0 GGADMP C[C@@H](NC(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1)C1=CC[NH+](C)CC1 ZINC000272707854 1434924695 /nfs/dbraw/zinc/92/46/95/1434924695.db2.gz HBYRIDGYAKIMMT-GOSISDBHSA-N 2 1 396.535 3.361 20 0 GGADMP C[C@@H](NC(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1)C1=CC[NH+](C)CC1 ZINC000272707854 1434924698 /nfs/dbraw/zinc/92/46/98/1434924698.db2.gz HBYRIDGYAKIMMT-GOSISDBHSA-N 2 1 396.535 3.361 20 0 GGADMP C[C@@H](NC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1)C1=CC[N@H+](C)CC1 ZINC000272707854 1434924700 /nfs/dbraw/zinc/92/47/00/1434924700.db2.gz HBYRIDGYAKIMMT-GOSISDBHSA-N 2 1 396.535 3.361 20 0 GGADMP C[C@@H](NC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1)C1=CC[N@@H+](C)CC1 ZINC000272707854 1434924702 /nfs/dbraw/zinc/92/47/02/1434924702.db2.gz HBYRIDGYAKIMMT-GOSISDBHSA-N 2 1 396.535 3.361 20 0 GGADMP CCNC(=O)COc1cccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000272762070 1434929026 /nfs/dbraw/zinc/92/90/26/1434929026.db2.gz LTRDNKFNUNGJGV-SIKLNZKXSA-N 2 1 395.547 3.202 20 0 GGADMP CCNC(=O)COc1cccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000272762069 1434929036 /nfs/dbraw/zinc/92/90/36/1434929036.db2.gz LTRDNKFNUNGJGV-KNQAVFIVSA-N 2 1 395.547 3.202 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(-n2cccn2)cc1 ZINC000272794032 1434931429 /nfs/dbraw/zinc/93/14/29/1434931429.db2.gz YAEIIKGCTRRMOR-WZONZLPQSA-N 2 1 376.504 3.290 20 0 GGADMP C[C@@H](NC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)C1=CC[NH+](C)CC1 ZINC000272937427 1434942383 /nfs/dbraw/zinc/94/23/83/1434942383.db2.gz LQWGEDDXUNTGON-QGZVFWFLSA-N 2 1 390.959 3.208 20 0 GGADMP C[C@@H](NC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)C1=CC[NH+](C)CC1 ZINC000272937427 1434942385 /nfs/dbraw/zinc/94/23/85/1434942385.db2.gz LQWGEDDXUNTGON-QGZVFWFLSA-N 2 1 390.959 3.208 20 0 GGADMP C[C@@H](NC(=O)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1)C1=CC[N@H+](C)CC1 ZINC000272937427 1434942386 /nfs/dbraw/zinc/94/23/86/1434942386.db2.gz LQWGEDDXUNTGON-QGZVFWFLSA-N 2 1 390.959 3.208 20 0 GGADMP C[C@@H](NC(=O)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1)C1=CC[N@@H+](C)CC1 ZINC000272937427 1434942388 /nfs/dbraw/zinc/94/23/88/1434942388.db2.gz LQWGEDDXUNTGON-QGZVFWFLSA-N 2 1 390.959 3.208 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H](Cc1ccc(F)cc1)C(N)=O ZINC000272943981 1434942941 /nfs/dbraw/zinc/94/29/41/1434942941.db2.gz CMQAJZPXJLWIPF-QFIPXVFZSA-N 2 1 395.478 3.237 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccccc2OCC(=O)OC)[C@H](C)C1 ZINC000273128607 1434964563 /nfs/dbraw/zinc/96/45/63/1434964563.db2.gz ARYMEJSUXQHBOL-GGPKGHCWSA-N 2 1 392.540 3.026 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccccc2OCC(=O)OC)[C@H](C)C1 ZINC000273128607 1434964565 /nfs/dbraw/zinc/96/45/65/1434964565.db2.gz ARYMEJSUXQHBOL-GGPKGHCWSA-N 2 1 392.540 3.026 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2OCC(=O)OC)[C@@H](C)C1 ZINC000273128606 1434964704 /nfs/dbraw/zinc/96/47/04/1434964704.db2.gz ARYMEJSUXQHBOL-BJLQDIEVSA-N 2 1 392.540 3.026 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2OCC(=O)OC)[C@@H](C)C1 ZINC000273128606 1434964705 /nfs/dbraw/zinc/96/47/05/1434964705.db2.gz ARYMEJSUXQHBOL-BJLQDIEVSA-N 2 1 392.540 3.026 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H](Cc1ccccc1)C(N)=O ZINC000273371401 1434983938 /nfs/dbraw/zinc/98/39/38/1434983938.db2.gz FETKFOXOXZEFDU-QFIPXVFZSA-N 2 1 377.488 3.098 20 0 GGADMP OCC[C@@H]([NH2+]Cc1cccc(C[NH2+][C@H](CCO)c2ccco2)c1)c1ccco1 ZINC000274368894 1435065842 /nfs/dbraw/zinc/06/58/42/1435065842.db2.gz AJDLCJZOXLPDNC-WOJBJXKFSA-N 2 1 384.476 3.299 20 0 GGADMP CCn1nc(C[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c2ccccc21 ZINC000274386373 1435067032 /nfs/dbraw/zinc/06/70/32/1435067032.db2.gz BJBXHKSNMRKNIH-UHFFFAOYSA-N 2 1 378.520 3.303 20 0 GGADMP OCC[C@@H]([NH2+]Cc1ccccc1C[NH2+][C@H](CCO)c1ccco1)c1ccco1 ZINC000274392606 1435067658 /nfs/dbraw/zinc/06/76/58/1435067658.db2.gz HOCVYJJKSYMCKJ-WOJBJXKFSA-N 2 1 384.476 3.299 20 0 GGADMP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cn(C)nc2C(F)F)CC1 ZINC000274441813 1435071376 /nfs/dbraw/zinc/07/13/76/1435071376.db2.gz BZHKMXGJIDMCSC-AWEZNQCLSA-N 2 1 395.473 3.490 20 0 GGADMP C[C@H]([NH2+][C@H]1CCCN(Cc2ccccn2)C1=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274741652 1435088889 /nfs/dbraw/zinc/08/88/89/1435088889.db2.gz FIXLQNALLOWVGG-WPYKKVEZSA-N 2 1 392.547 3.073 20 0 GGADMP C[C@H]([NH2+][C@@H]1CCCN(Cc2ccccn2)C1=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274741653 1435088993 /nfs/dbraw/zinc/08/89/93/1435088993.db2.gz FIXLQNALLOWVGG-XKCSPQBFSA-N 2 1 392.547 3.073 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749792 1435089513 /nfs/dbraw/zinc/08/95/13/1435089513.db2.gz HFIDUINYCHRGCW-ZWSUVBHBSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CC[C@H](O)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274749792 1435089516 /nfs/dbraw/zinc/08/95/16/1435089516.db2.gz HFIDUINYCHRGCW-ZWSUVBHBSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CC[C@H](O)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274749792 1435089520 /nfs/dbraw/zinc/08/95/20/1435089520.db2.gz HFIDUINYCHRGCW-ZWSUVBHBSA-N 3 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[N@@H+]1CC[C@H](O)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749792 1435089523 /nfs/dbraw/zinc/08/95/23/1435089523.db2.gz HFIDUINYCHRGCW-ZWSUVBHBSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[N@H+]1CC[C@H](O)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000274749792 1435089526 /nfs/dbraw/zinc/08/95/26/1435089526.db2.gz HFIDUINYCHRGCW-ZWSUVBHBSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[NH+]1CC[C@H](O)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274749792 1435089530 /nfs/dbraw/zinc/08/95/30/1435089530.db2.gz HFIDUINYCHRGCW-ZWSUVBHBSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@H](NCc1ccccc1C[NH+]1CC[C@H](O)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274749792 1435089532 /nfs/dbraw/zinc/08/95/32/1435089532.db2.gz HFIDUINYCHRGCW-ZWSUVBHBSA-N 2 1 393.575 3.253 20 0 GGADMP C[C@@H]([NH2+]C1CCN(C2CC[NH+](C)CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274820771 1435095526 /nfs/dbraw/zinc/09/55/26/1435095526.db2.gz BOLZZOUFCNIXAK-IRLDBZIGSA-N 3 1 384.612 3.045 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCCc2nc(-c3ccccc3)no2)[C@@H](C)C1 ZINC000274830418 1435096398 /nfs/dbraw/zinc/09/63/98/1435096398.db2.gz JKXQRXYUWTUIIH-ICSRJNTNSA-N 2 1 386.540 3.396 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(CS(C)(=O)=O)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274872576 1435099888 /nfs/dbraw/zinc/09/98/88/1435099888.db2.gz GAQFUJFSMGCHGW-AVRDEDQJSA-N 2 1 386.561 3.231 20 0 GGADMP COc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1OCCO ZINC000274872523 1435099999 /nfs/dbraw/zinc/09/99/99/1435099999.db2.gz FXUYMQCAJHIJRE-RXVVDRJESA-N 2 1 384.520 3.067 20 0 GGADMP C[C@@H]([NH2+]CCCNC(=O)c1cccc(O)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274879286 1435100401 /nfs/dbraw/zinc/10/04/01/1435100401.db2.gz HGNACYXJIQRQMX-WIYYLYMNSA-N 2 1 381.520 3.012 20 0 GGADMP C[C@@H]([NH2+]CCCNC(=O)c1cccc(O)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274879277 1435100485 /nfs/dbraw/zinc/10/04/85/1435100485.db2.gz HGNACYXJIQRQMX-NQIIRXRSSA-N 2 1 381.520 3.012 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(OCC(=O)N(C)C)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274892439 1435101642 /nfs/dbraw/zinc/10/16/42/1435101642.db2.gz JPHSBFPRKKCBMV-SIKLNZKXSA-N 2 1 395.547 3.154 20 0 GGADMP Cc1[nH+]ccn1CCC[NH+]1CCC(O)(c2cccc(OC(F)(F)F)c2)CC1 ZINC000275205401 1435122920 /nfs/dbraw/zinc/12/29/20/1435122920.db2.gz GYFBPIBZSSQKRU-UHFFFAOYSA-N 2 1 383.414 3.464 20 0 GGADMP CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000275532389 1435146131 /nfs/dbraw/zinc/14/61/31/1435146131.db2.gz LYUIFJZCXPHMQF-VZGLXOSZSA-N 2 1 394.563 3.481 20 0 GGADMP C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000275643922 1435155681 /nfs/dbraw/zinc/15/56/81/1435155681.db2.gz MBGXWECYVJUNEN-NRFANRHFSA-N 2 1 394.563 3.477 20 0 GGADMP C[NH+](C)CCc1ccccc1NC(=O)N1CC[NH+](CCc2cccs2)CC1 ZINC000275651490 1435156531 /nfs/dbraw/zinc/15/65/31/1435156531.db2.gz MWRXFOGEADIAKM-UHFFFAOYSA-N 2 1 386.565 3.244 20 0 GGADMP C[NH+]1CCN(C(=O)c2ccc(C[NH2+][C@H]3CCC[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000275685677 1435159562 /nfs/dbraw/zinc/15/95/62/1435159562.db2.gz ZVMMFHNVBDOWKU-MSOLQXFVSA-N 2 1 383.458 3.285 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)CC2)n[nH]1 ZINC000275928015 1435180351 /nfs/dbraw/zinc/18/03/51/1435180351.db2.gz QZZGRNXGGRNHJN-KSEOMHKRSA-N 2 1 379.552 3.187 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N(C)Cc2ccccc2C)[C@@H](C)C1 ZINC000276286947 1435202476 /nfs/dbraw/zinc/20/24/76/1435202476.db2.gz VBPUUWHMQBJGQP-VWPQPMDRSA-N 2 1 389.584 3.069 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N(C)Cc2ccccc2C)[C@@H](C)C1 ZINC000276286947 1435202479 /nfs/dbraw/zinc/20/24/79/1435202479.db2.gz VBPUUWHMQBJGQP-VWPQPMDRSA-N 2 1 389.584 3.069 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccc3c(c2)CC[NH2+]CC3)CC1 ZINC000276472542 1435213329 /nfs/dbraw/zinc/21/33/29/1435213329.db2.gz BPBZXGWQRWCVKT-UHFFFAOYSA-N 2 1 391.559 3.359 20 0 GGADMP C[NH+](C)CCCCCCCNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000276504201 1435214902 /nfs/dbraw/zinc/21/49/02/1435214902.db2.gz PQMCJWJGPSUVPW-NRFANRHFSA-N 2 1 389.588 3.057 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)CC[NH2+]CC3)CC[N@H+]1Cc1ccccc1 ZINC000276728386 1435228428 /nfs/dbraw/zinc/22/84/28/1435228428.db2.gz YHQRJLSKILIFED-NTKDMRAZSA-N 2 1 391.559 3.500 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccn([C@@H]3CCC[NH2+]C3)n2)cc1 ZINC000276737746 1435228995 /nfs/dbraw/zinc/22/89/95/1435228995.db2.gz AKWNZCPJFIKJIR-FXAWDEMLSA-N 2 1 381.524 3.434 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[NH+]2CCC[C@@H]2C(N)=O)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000276932065 1435244571 /nfs/dbraw/zinc/24/45/71/1435244571.db2.gz OIKMEQCYCREVPC-CYJAXWMASA-N 2 1 397.523 3.120 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[NH+]2CCC[C@@H]2C(N)=O)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276932065 1435244572 /nfs/dbraw/zinc/24/45/72/1435244572.db2.gz OIKMEQCYCREVPC-CYJAXWMASA-N 2 1 397.523 3.120 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[N@@H+]2CCC[C@@H]2C(N)=O)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276932065 1435244573 /nfs/dbraw/zinc/24/45/73/1435244573.db2.gz OIKMEQCYCREVPC-CYJAXWMASA-N 2 1 397.523 3.120 20 0 GGADMP C[C@@H](c1nc(-c2ccccc2C[N@H+]2CCC[C@@H]2C(N)=O)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276932065 1435244574 /nfs/dbraw/zinc/24/45/74/1435244574.db2.gz OIKMEQCYCREVPC-CYJAXWMASA-N 2 1 397.523 3.120 20 0 GGADMP C[C@H](c1nc(-c2ccc(N3CCC[NH+](C)CC3)nc2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276981630 1435249409 /nfs/dbraw/zinc/24/94/09/1435249409.db2.gz WBQXWBMHBQYGFU-IXDOHACOSA-N 2 1 384.528 3.207 20 0 GGADMP C[C@H](c1nc(-c2ccc(N3CCC[N@H+](C)CC3)nc2)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276981630 1435249412 /nfs/dbraw/zinc/24/94/12/1435249412.db2.gz WBQXWBMHBQYGFU-IXDOHACOSA-N 2 1 384.528 3.207 20 0 GGADMP C[C@H](c1nc(-c2ccc(N3CCC[N@@H+](C)CC3)nc2)no1)[NH+]1[C@H](C)CC[C@@H]1C ZINC000276981630 1435249415 /nfs/dbraw/zinc/24/94/15/1435249415.db2.gz WBQXWBMHBQYGFU-IXDOHACOSA-N 2 1 384.528 3.207 20 0 GGADMP C[C@@H](c1nc(-c2ccc(N3CCC[N@@H+](C)CC3)nc2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000276981633 1435249488 /nfs/dbraw/zinc/24/94/88/1435249488.db2.gz WBQXWBMHBQYGFU-ZACQAIPSSA-N 2 1 384.528 3.207 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)NCCc1c[nH]c2ccccc12 ZINC000277135117 1435266427 /nfs/dbraw/zinc/26/64/27/1435266427.db2.gz TVAWKQBJGKIERT-GOSISDBHSA-N 2 1 395.551 3.386 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)NCCc1c[nH]c2ccccc12 ZINC000277135117 1435266430 /nfs/dbraw/zinc/26/64/30/1435266430.db2.gz TVAWKQBJGKIERT-GOSISDBHSA-N 2 1 395.551 3.386 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)NCc1ccc(COCC)cc1 ZINC000277135004 1435266468 /nfs/dbraw/zinc/26/64/68/1435266468.db2.gz SXSKJHMAEYECEX-UHFFFAOYSA-N 2 1 386.540 3.010 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)NCc1ccc(COCC)cc1 ZINC000277135004 1435266473 /nfs/dbraw/zinc/26/64/73/1435266473.db2.gz SXSKJHMAEYECEX-UHFFFAOYSA-N 2 1 386.540 3.010 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)N[C@@H](C)c1ccccc1OC ZINC000277223934 1435280986 /nfs/dbraw/zinc/28/09/86/1435280986.db2.gz OFEQOQQVUSWKPR-ROUUACIJSA-N 2 1 386.540 3.432 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)N[C@@H](C)c1ccccc1OC ZINC000277223934 1435280987 /nfs/dbraw/zinc/28/09/87/1435280987.db2.gz OFEQOQQVUSWKPR-ROUUACIJSA-N 2 1 386.540 3.432 20 0 GGADMP COc1ccc(CC[C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)cc1O ZINC000277288960 1435289990 /nfs/dbraw/zinc/28/99/90/1435289990.db2.gz TYHVTLGXCHPJQI-HNNXBMFYSA-N 2 1 384.524 3.387 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NCC2CC[NH+](C3CC3)CC2)cc1)[NH+]1CCOCC1 ZINC000277760529 1435327968 /nfs/dbraw/zinc/32/79/68/1435327968.db2.gz RGHPOOLWVZRQDR-KRWDZBQOSA-N 2 1 386.540 3.076 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)CC1 ZINC000277995516 1435348617 /nfs/dbraw/zinc/34/86/17/1435348617.db2.gz NQDOAQJLJTWZKE-SFHVURJKSA-N 2 1 388.556 3.455 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000277995516 1435348619 /nfs/dbraw/zinc/34/86/19/1435348619.db2.gz NQDOAQJLJTWZKE-SFHVURJKSA-N 2 1 388.556 3.455 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NCC1CC[NH+](C2CC2)CC1 ZINC000278031546 1435351955 /nfs/dbraw/zinc/35/19/55/1435351955.db2.gz KCRRPKLQQPCBMH-GCJKJVERSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NCC1CC[NH+](C2CC2)CC1 ZINC000278031550 1435352084 /nfs/dbraw/zinc/35/20/84/1435352084.db2.gz KCRRPKLQQPCBMH-PGRDOPGGSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000278082048 1435357374 /nfs/dbraw/zinc/35/73/74/1435357374.db2.gz PEKPYXOYFZURCZ-GHTZIAJQSA-N 2 1 384.568 3.213 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC1CC[NH+](C2CC2)CC1 ZINC000278105149 1435359856 /nfs/dbraw/zinc/35/98/56/1435359856.db2.gz JSVSIJARDAVNQT-QFIPXVFZSA-N 2 1 398.595 3.414 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NCCCCCCC[NH+](C)C)CC1 ZINC000278283885 1435376365 /nfs/dbraw/zinc/37/63/65/1435376365.db2.gz TXHUHWNSHCZLJA-UHFFFAOYSA-N 2 1 376.545 3.455 20 0 GGADMP C[C@H](NC(=O)NCC1CC[NH+](C2CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000278289482 1435376745 /nfs/dbraw/zinc/37/67/45/1435376745.db2.gz ZPGQHJCAFXBHFZ-RXVVDRJESA-N 2 1 384.568 3.071 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(OCc2nccn2C)cc1 ZINC000278363132 1435384069 /nfs/dbraw/zinc/38/40/69/1435384069.db2.gz BMDUAHMERJCHLX-RBUKOAKNSA-N 2 1 386.540 3.151 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]CCOCC(F)(F)C(F)F)CC2)cc1 ZINC000278408393 1435388306 /nfs/dbraw/zinc/38/83/06/1435388306.db2.gz HIQDGABRWZVGLY-UHFFFAOYSA-N 2 1 380.401 3.339 20 0 GGADMP CCOc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1F ZINC000278488753 1435394728 /nfs/dbraw/zinc/39/47/28/1435394728.db2.gz LUGNQTTZOJDLTG-FQEVSTJZSA-N 2 1 399.510 3.212 20 0 GGADMP C[C@H](C(=O)N1CCc2ccccc2C1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278806665 1435425475 /nfs/dbraw/zinc/42/54/75/1435425475.db2.gz GGNYJXRVFDYWNX-GOSISDBHSA-N 2 1 392.547 3.372 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NCc2ccc(CC[NH+](C)C)cc2)CC1 ZINC000278835685 1435428890 /nfs/dbraw/zinc/42/88/90/1435428890.db2.gz JDYGWKWEYFSCEI-UHFFFAOYSA-N 2 1 396.535 3.247 20 0 GGADMP COc1cccc(NC(=O)CC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000278973114 1435447419 /nfs/dbraw/zinc/44/74/19/1435447419.db2.gz YBZFWJZIWNMORR-UHFFFAOYSA-N 2 1 382.508 3.436 20 0 GGADMP C[NH+](C)Cc1ccc(-c2noc([C@H](c3ccccc3)N3CC[NH+](C)CC3)n2)cc1 ZINC000278997375 1435450264 /nfs/dbraw/zinc/45/02/64/1435450264.db2.gz QXDBZFCSKMWTAX-NRFANRHFSA-N 2 1 391.519 3.135 20 0 GGADMP C[NH+](C)CCc1ccccc1NC(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279314268 1435485498 /nfs/dbraw/zinc/48/54/98/1435485498.db2.gz CVSJHHOSQLLWIA-SZPZYZBQSA-N 2 1 392.547 3.386 20 0 GGADMP Cn1cc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c(-c2ccncc2)n1 ZINC000279355358 1435490451 /nfs/dbraw/zinc/49/04/51/1435490451.db2.gz GMVIJIFPAXJVRH-UHFFFAOYSA-N 2 1 376.508 3.395 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)C23CCC[NH+]2CCC3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000279533818 1435510532 /nfs/dbraw/zinc/51/05/32/1435510532.db2.gz UWQLBTBONCJXDR-CRAIPNDOSA-N 2 1 379.907 3.217 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)C23CCC[NH+]2CCC3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000279533821 1435510717 /nfs/dbraw/zinc/51/07/17/1435510717.db2.gz UWQLBTBONCJXDR-MAUKXSAKSA-N 2 1 379.907 3.217 20 0 GGADMP Clc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCOCC2)c(-n2cncn2)c1 ZINC000279776005 1435541241 /nfs/dbraw/zinc/54/12/41/1435541241.db2.gz BRVYLLZDHGJRMK-UHFFFAOYSA-N 2 1 397.910 3.043 20 0 GGADMP COc1cc2c(cc1OC)[C@@H]([NH2+]C1CCN(c3cc(C)[nH+]c(C)n3)CC1)CC2 ZINC000279930708 1435564977 /nfs/dbraw/zinc/56/49/77/1435564977.db2.gz ASBRXNZRJCALOS-IBGZPJMESA-N 2 1 382.508 3.357 20 0 GGADMP COc1cc2c(cc1OC)[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)CC2 ZINC000280024236 1435579016 /nfs/dbraw/zinc/57/90/16/1435579016.db2.gz HOYZUWAVNVYJKU-TZIWHRDSSA-N 2 1 382.504 3.048 20 0 GGADMP CC(C)(C)C(=O)N1CCC(C[N@@H+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC000280465712 1435665357 /nfs/dbraw/zinc/66/53/57/1435665357.db2.gz OQIBPOXGZSWUNY-SZPZYZBQSA-N 2 1 383.580 3.335 20 0 GGADMP CC(C)(C)C(=O)N1CCC(C[NH+]2C[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC000280465712 1435665365 /nfs/dbraw/zinc/66/53/65/1435665365.db2.gz OQIBPOXGZSWUNY-SZPZYZBQSA-N 2 1 383.580 3.335 20 0 GGADMP CC(C)(C)C(=O)N1CCC(C[NH+]2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC000280465712 1435665372 /nfs/dbraw/zinc/66/53/72/1435665372.db2.gz OQIBPOXGZSWUNY-SZPZYZBQSA-N 2 1 383.580 3.335 20 0 GGADMP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cn1 ZINC000280542974 1435676549 /nfs/dbraw/zinc/67/65/49/1435676549.db2.gz DBDHXBCVGCWWOV-FGZHOGPDSA-N 2 1 380.536 3.317 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+]Cc2ccc(N(C)c3ccccc3)nc2)CC1 ZINC000280645838 1435696918 /nfs/dbraw/zinc/69/69/18/1435696918.db2.gz NRGGIBCYOFVHQN-UHFFFAOYSA-N 2 1 381.568 3.357 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H](c3cccnc3)C3CCC3)c2)C1 ZINC000280923697 1435742124 /nfs/dbraw/zinc/74/21/24/1435742124.db2.gz RFTQNJXVYLGTLR-XZOQPEGZSA-N 2 1 392.547 3.410 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@@H+](C)CCC[NH+]1CCCC1 ZINC000281287614 1435802496 /nfs/dbraw/zinc/80/24/96/1435802496.db2.gz JBSLXCMMOZSOPL-UHFFFAOYSA-N 2 1 383.540 3.235 20 0 GGADMP CN(CCC[NH+]1CCCC1)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000281307395 1435803220 /nfs/dbraw/zinc/80/32/20/1435803220.db2.gz IEJBSWOIUZRXHT-UHFFFAOYSA-N 2 1 376.570 3.185 20 0 GGADMP [NH3+]CC[C@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000281611033 1435815499 /nfs/dbraw/zinc/81/54/99/1435815499.db2.gz BFFJHSUGVAMFHP-MJGOQNOKSA-N 2 1 383.458 3.028 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccnn1-c1ccccc1 ZINC000281725886 1435819649 /nfs/dbraw/zinc/81/96/49/1435819649.db2.gz USEISJPSYXGIAS-AVRDEDQJSA-N 2 1 376.504 3.290 20 0 GGADMP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ncnn1-c1ccccc1 ZINC000281871458 1435824937 /nfs/dbraw/zinc/82/49/37/1435824937.db2.gz CHTGTURBTFNHIQ-UHFFFAOYSA-N 2 1 376.508 3.401 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ncnn1-c1ccccc1 ZINC000281871458 1435824939 /nfs/dbraw/zinc/82/49/39/1435824939.db2.gz CHTGTURBTFNHIQ-UHFFFAOYSA-N 2 1 376.508 3.401 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]C2CCN(Cc3c(F)cccc3Cl)CC2)CC1(C)C ZINC000282111092 1435835087 /nfs/dbraw/zinc/83/50/87/1435835087.db2.gz AFNSWYQFGDWDNC-UHFFFAOYSA-N 2 1 396.982 3.059 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3ccc(-c4cnn(C)c4)s3)CC2)nc(C)[nH+]1 ZINC000282159559 1435836827 /nfs/dbraw/zinc/83/68/27/1435836827.db2.gz CUGQNKXBLGKPQX-UHFFFAOYSA-N 2 1 382.537 3.314 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3cnn(C)c3)s2)[C@H](C)C1 ZINC000282207999 1435838437 /nfs/dbraw/zinc/83/84/37/1435838437.db2.gz IUZYQEGHDVDYPC-APWZRJJASA-N 2 1 376.570 3.375 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3cnn(C)c3)s2)[C@@H](C)C1 ZINC000282208001 1435838455 /nfs/dbraw/zinc/83/84/55/1435838455.db2.gz IUZYQEGHDVDYPC-LPHOPBHVSA-N 2 1 376.570 3.375 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000282402238 1435845891 /nfs/dbraw/zinc/84/58/91/1435845891.db2.gz FIIFSWZVHVOZMK-QHCPKHFHSA-N 3 1 386.628 3.293 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000282402238 1435845892 /nfs/dbraw/zinc/84/58/92/1435845892.db2.gz FIIFSWZVHVOZMK-QHCPKHFHSA-N 3 1 386.628 3.293 20 0 GGADMP CCS(=O)(=O)CCCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000282449506 1435847567 /nfs/dbraw/zinc/84/75/67/1435847567.db2.gz ITMBTPJRWALTHS-FQEVSTJZSA-N 2 1 380.598 3.482 20 0 GGADMP CCS(=O)(=O)CCCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282449506 1435847568 /nfs/dbraw/zinc/84/75/68/1435847568.db2.gz ITMBTPJRWALTHS-FQEVSTJZSA-N 2 1 380.598 3.482 20 0 GGADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)c(-c2cnn(C)c2)c1 ZINC000282655312 1435855247 /nfs/dbraw/zinc/85/52/47/1435855247.db2.gz MHZZSHKUOUAHML-HSZRJFAPSA-N 2 1 390.531 3.252 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1=CC[NH+](C)CC1 ZINC000282703449 1435857070 /nfs/dbraw/zinc/85/70/70/1435857070.db2.gz JMGXBFCCQFVFIH-RXVVDRJESA-N 2 1 384.568 3.237 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[NH+](Cc2ccccc2)CC1(C)C)C1=CC[N@H+](C)CC1 ZINC000282703449 1435857071 /nfs/dbraw/zinc/85/70/71/1435857071.db2.gz JMGXBFCCQFVFIH-RXVVDRJESA-N 2 1 384.568 3.237 20 0 GGADMP C[C@H](NC(=O)N[C@H]1CC[NH+](Cc2ccccc2)CC1(C)C)C1=CC[N@@H+](C)CC1 ZINC000282703449 1435857072 /nfs/dbraw/zinc/85/70/72/1435857072.db2.gz JMGXBFCCQFVFIH-RXVVDRJESA-N 2 1 384.568 3.237 20 0 GGADMP Cc1nn(-c2ccccn2)c(C)c1C[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000282769091 1435859627 /nfs/dbraw/zinc/85/96/27/1435859627.db2.gz JHQLUYGWROOKNW-HDICACEKSA-N 2 1 397.567 3.205 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH2+]C2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1 ZINC000283248536 1435881174 /nfs/dbraw/zinc/88/11/74/1435881174.db2.gz JSPWOJNINZTCSZ-FGZHOGPDSA-N 2 1 386.628 3.149 20 0 GGADMP O[C@@H]1[C@H](C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)CCC12CCOCC2 ZINC000283468537 1435891263 /nfs/dbraw/zinc/89/12/63/1435891263.db2.gz WAVSNMQABCCXSI-JFDBCFPISA-N 2 1 384.564 3.054 20 0 GGADMP O=C1CCCCN1CC1CCN(C[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)CC1 ZINC000283915996 1435951362 /nfs/dbraw/zinc/95/13/62/1435951362.db2.gz CBQPKGMPXPIEEE-QHCPKHFHSA-N 2 1 399.579 3.002 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000284293448 1436010755 /nfs/dbraw/zinc/01/07/55/1436010755.db2.gz YDGVYGDMIBRDLZ-AZUAARDMSA-N 2 1 387.568 3.396 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000284293452 1436010821 /nfs/dbraw/zinc/01/08/21/1436010821.db2.gz YDGVYGDMIBRDLZ-QUCCMNQESA-N 2 1 387.568 3.396 20 0 GGADMP Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C1CCOCC1 ZINC000284751945 1436046436 /nfs/dbraw/zinc/04/64/36/1436046436.db2.gz FZKUQKVDMDQSRM-WBADGQHESA-N 2 1 394.563 3.388 20 0 GGADMP Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C1CCOCC1 ZINC000284751945 1436046442 /nfs/dbraw/zinc/04/64/42/1436046442.db2.gz FZKUQKVDMDQSRM-WBADGQHESA-N 2 1 394.563 3.388 20 0 GGADMP Cc1sc2nc(C[NH+]3CCCC3)nc(N3CCC(F)(C[NH3+])CC3)c2c1C ZINC001164391726 718813441 /nfs/dbraw/zinc/81/34/41/718813441.db2.gz HROFSJPZMOZPMM-UHFFFAOYSA-N 2 1 377.533 3.171 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@@H]4[NH2+]CC[C@@H]42)n1)CCC3)[NH+]1CCCCC1 ZINC001164411096 718875687 /nfs/dbraw/zinc/87/56/87/718875687.db2.gz MKBWJHNODLPHBN-HOTGVXAUSA-N 2 1 383.565 3.107 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@H]4[NH2+]CC[C@H]42)n1)CCCC3)[NH+]1CCCC1 ZINC001164412819 718876011 /nfs/dbraw/zinc/87/60/11/718876011.db2.gz ZSFUZWRSXZDVOD-HZPDHXFCSA-N 2 1 383.565 3.107 20 0 GGADMP C[NH+]1CCC(Oc2ccnc(N3[C@@H](C(F)(F)F)CCC34CC[NH2+]CC4)c2)CC1 ZINC001164413285 718881267 /nfs/dbraw/zinc/88/12/67/718881267.db2.gz GMTANTNRFZWHDB-QGZVFWFLSA-N 2 1 398.473 3.208 20 0 GGADMP [NH3+][C@@]12C[C@@H]1CN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164419133 718888076 /nfs/dbraw/zinc/88/80/76/718888076.db2.gz PYVWUPLOVOBGER-SPLOXXLWSA-N 2 1 383.565 3.093 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4C[C@H]5C[C@@]5([NH3+])C4)c23)C1 ZINC001164416582 718888333 /nfs/dbraw/zinc/88/83/33/718888333.db2.gz DJFHDCOQDKSZPO-DOQJBMMISA-N 2 1 397.592 3.339 20 0 GGADMP [NH3+][C@@]12C[C@@H]1CCN(c1nc(C[NH+]3CCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164420160 718896534 /nfs/dbraw/zinc/89/65/34/718896534.db2.gz KQZHRNMYNACUJK-LHSJRXKWSA-N 2 1 383.565 3.093 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4C[C@@H]5[C@@H]([NH3+])[C@@H]5C4)c23)C1 ZINC001164440933 718986276 /nfs/dbraw/zinc/98/62/76/718986276.db2.gz SWSFOAMQAJXRNR-NEVJAFOQSA-N 2 1 397.592 3.195 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@H]4[NH2+]C[C@H]42)n1)CCC3)[NH+]1CCCCC1 ZINC001164448430 718999916 /nfs/dbraw/zinc/99/99/16/718999916.db2.gz IBYJTXTZQQFBRE-HZPDHXFCSA-N 2 1 383.565 3.107 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CCC[C@@H]5[NH2+]C[C@H]54)c32)C1 ZINC001164447681 719000174 /nfs/dbraw/zinc/00/01/74/719000174.db2.gz DHTZPADZNORVAE-HYVNUMGLSA-N 2 1 397.592 3.353 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CCC[C@@H]3[NH2+]C[C@H]32)n1 ZINC001164448264 719001798 /nfs/dbraw/zinc/00/17/98/719001798.db2.gz GQNTVUHDTUNOQP-DLBZAZTESA-N 2 1 379.533 3.361 20 0 GGADMP C[NH+]1CCC(Oc2ccnc(N3CC[C@]4(C[NH2+]C[C@H]4c4ccccc4)C3)c2)CC1 ZINC001164619624 719049222 /nfs/dbraw/zinc/04/92/22/719049222.db2.gz CZBKUUWMIDMURJ-UPVQGACJSA-N 2 1 392.547 3.138 20 0 GGADMP Cc1nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc(N2CCCC2)[nH+]1 ZINC001164629170 719057928 /nfs/dbraw/zinc/05/79/28/719057928.db2.gz WHKLCWHORMEUSB-NHCUHLMSSA-N 2 1 377.536 3.486 20 0 GGADMP [NH3+]C1([C@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]2CF)CC1 ZINC001164627452 719116913 /nfs/dbraw/zinc/11/69/13/719116913.db2.gz KMDOKBICULVFII-UXHICEINSA-N 2 1 380.511 3.153 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nnc(Cl)c3ccsc32)c2c1CC[NH2+]C2 ZINC001164683469 719612121 /nfs/dbraw/zinc/61/21/21/719612121.db2.gz JESJYPMUSJVSCC-UHFFFAOYSA-N 2 1 376.917 3.016 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nnc(Cl)c3ccsc32)c2c1CC[NH2+]C2 ZINC001164683469 719612133 /nfs/dbraw/zinc/61/21/33/719612133.db2.gz JESJYPMUSJVSCC-UHFFFAOYSA-N 2 1 376.917 3.016 20 0 GGADMP Cc1cccc2c1nc(Cl)nc2-n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164684227 719615958 /nfs/dbraw/zinc/61/59/58/719615958.db2.gz NLEYQWTWJWSIFD-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1cccc2c1nc(Cl)nc2-n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164684227 719615962 /nfs/dbraw/zinc/61/59/62/719615962.db2.gz NLEYQWTWJWSIFD-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1cc(Cl)ncc1C(F)(F)n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164682016 719622600 /nfs/dbraw/zinc/62/26/00/719622600.db2.gz LBXGGLSGGNMUOX-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP Cc1cc(Cl)ncc1C(F)(F)n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164682016 719622604 /nfs/dbraw/zinc/62/26/04/719622604.db2.gz LBXGGLSGGNMUOX-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2ncnc3c2ccn3C2CCCC2)c2c1CC[NH2+]C2 ZINC001164685116 719624481 /nfs/dbraw/zinc/62/44/81/719624481.db2.gz ZYOHBIGJYDLRCN-UHFFFAOYSA-N 2 1 393.539 3.218 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2ncnc3c2ccn3C2CCCC2)c2c1CC[NH2+]C2 ZINC001164685116 719624494 /nfs/dbraw/zinc/62/44/94/719624494.db2.gz ZYOHBIGJYDLRCN-UHFFFAOYSA-N 2 1 393.539 3.218 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2cncc(Oc3cccc(F)c3)n2)c2c1CC[NH2+]C2 ZINC001164681638 719631802 /nfs/dbraw/zinc/63/18/02/719631802.db2.gz JXTKEXWRDMEYMH-UHFFFAOYSA-N 2 1 396.470 3.080 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2cncc(Oc3cccc(F)c3)n2)c2c1CC[NH2+]C2 ZINC001164681638 719631810 /nfs/dbraw/zinc/63/18/10/719631810.db2.gz JXTKEXWRDMEYMH-UHFFFAOYSA-N 2 1 396.470 3.080 20 0 GGADMP Cc1cc(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)nc(-c2cccs2)n1 ZINC001164679421 719643362 /nfs/dbraw/zinc/64/33/62/719643362.db2.gz ADIAFXGKXLXJKA-UHFFFAOYSA-N 2 1 382.537 3.185 20 0 GGADMP Cc1cc(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)nc(-c2cccs2)n1 ZINC001164679421 719643365 /nfs/dbraw/zinc/64/33/65/719643365.db2.gz ADIAFXGKXLXJKA-UHFFFAOYSA-N 2 1 382.537 3.185 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nc(C(F)F)nc3ccccc32)c2c1CC[NH2+]C2 ZINC001164679522 719643421 /nfs/dbraw/zinc/64/34/21/719643421.db2.gz FACRKTCWHMMLLL-UHFFFAOYSA-N 2 1 386.450 3.239 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nc(C(F)F)nc3ccccc32)c2c1CC[NH2+]C2 ZINC001164679522 719643424 /nfs/dbraw/zinc/64/34/24/719643424.db2.gz FACRKTCWHMMLLL-UHFFFAOYSA-N 2 1 386.450 3.239 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2ncc(F)c(-c3ccsc3)n2)c2c1CC[NH2+]C2 ZINC001164684369 719649059 /nfs/dbraw/zinc/64/90/59/719649059.db2.gz XANUFUNFABJMDM-UHFFFAOYSA-N 2 1 386.500 3.016 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2ncc(F)c(-c3ccsc3)n2)c2c1CC[NH2+]C2 ZINC001164684369 719649063 /nfs/dbraw/zinc/64/90/63/719649063.db2.gz XANUFUNFABJMDM-UHFFFAOYSA-N 2 1 386.500 3.016 20 0 GGADMP CCc1nc(Cl)nc(Cl)c1-n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164680713 719651765 /nfs/dbraw/zinc/65/17/65/719651765.db2.gz ICHCBZYJSDEQJZ-UHFFFAOYSA-N 2 1 383.327 3.017 20 0 GGADMP CCc1nc(Cl)nc(Cl)c1-n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001164680713 719651770 /nfs/dbraw/zinc/65/17/70/719651770.db2.gz ICHCBZYJSDEQJZ-UHFFFAOYSA-N 2 1 383.327 3.017 20 0 GGADMP COC[C@@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1[nH+]ccc3cc(OC)ccc31)C2 ZINC001164809802 720089837 /nfs/dbraw/zinc/08/98/37/720089837.db2.gz KMVUIESNRXIXRG-CVDCTZTESA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1[nH+]ccc3cc(OC)ccc31)C2 ZINC001164809802 720089846 /nfs/dbraw/zinc/08/98/46/720089846.db2.gz KMVUIESNRXIXRG-CVDCTZTESA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1[nH+]ccc3cc(OC)ccc31)C2 ZINC001164809804 720090542 /nfs/dbraw/zinc/09/05/42/720090542.db2.gz KMVUIESNRXIXRG-XXBNENTESA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1[nH+]ccc3cc(OC)ccc31)C2 ZINC001164809804 720090547 /nfs/dbraw/zinc/09/05/47/720090547.db2.gz KMVUIESNRXIXRG-XXBNENTESA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(N(C)C)cc[nH+]1)CC2 ZINC001164717479 720116286 /nfs/dbraw/zinc/11/62/86/720116286.db2.gz PIARAWRPIYUFEM-NRFANRHFSA-N 2 1 395.551 3.050 20 0 GGADMP CCc1cc(N2CCC3(C[C@@H](COC)[N@H+](Cc4ccccn4)C3)CC2)nc(C)[nH+]1 ZINC001164710856 720128061 /nfs/dbraw/zinc/12/80/61/720128061.db2.gz DXJDLEOLSVENAH-NRFANRHFSA-N 2 1 395.551 3.250 20 0 GGADMP CCc1cc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nc(C)[nH+]1 ZINC001164710856 720128068 /nfs/dbraw/zinc/12/80/68/720128068.db2.gz DXJDLEOLSVENAH-NRFANRHFSA-N 2 1 395.551 3.250 20 0 GGADMP COC[C@@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1[nH+]cnc3c1ccn3C(C)C)C2 ZINC001164816009 720154628 /nfs/dbraw/zinc/15/46/28/720154628.db2.gz JSVHEIALGOWDMY-AVRDEDQJSA-N 2 1 383.540 3.197 20 0 GGADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1[nH+]cnc3c1ccn3C(C)C)C2 ZINC001164816009 720154630 /nfs/dbraw/zinc/15/46/30/720154630.db2.gz JSVHEIALGOWDMY-AVRDEDQJSA-N 2 1 383.540 3.197 20 0 GGADMP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1[nH+]cnc3c1ccn3C(C)C)C2 ZINC001164816016 720155428 /nfs/dbraw/zinc/15/54/28/720155428.db2.gz JSVHEIALGOWDMY-XMSQKQJNSA-N 2 1 383.540 3.197 20 0 GGADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1[nH+]cnc3c1ccn3C(C)C)C2 ZINC001164816016 720155434 /nfs/dbraw/zinc/15/54/34/720155434.db2.gz JSVHEIALGOWDMY-XMSQKQJNSA-N 2 1 383.540 3.197 20 0 GGADMP Cc1ccc2cc[nH+]c(N3CC[C@@H]4[C@@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c2c1 ZINC001164832410 720316891 /nfs/dbraw/zinc/31/68/91/720316891.db2.gz SWUJBVFYEIUDQR-FCHUYYIVSA-N 2 1 392.547 3.455 20 0 GGADMP Cc1cccc2cc[nH+]c(N3CC[C@@H]4[C@@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c12 ZINC001164830733 720347179 /nfs/dbraw/zinc/34/71/79/720347179.db2.gz WTRSCSVPJFKKOY-LEWJYISDSA-N 2 1 392.547 3.455 20 0 GGADMP CC(C)Oc1cc[nH+]c(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164834288 720555244 /nfs/dbraw/zinc/55/52/44/720555244.db2.gz DGZCJYOUKGRDOO-SFHLNBCPSA-N 2 1 383.540 3.443 20 0 GGADMP Cc1cc2[nH]ccc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)[nH+]1 ZINC001164835523 720556158 /nfs/dbraw/zinc/55/61/58/720556158.db2.gz HQRIIIUGGKJJHI-WAOWUJCRSA-N 2 1 378.524 3.446 20 0 GGADMP Cc1nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)cc(N(C)C)[nH+]1 ZINC001164840999 720665874 /nfs/dbraw/zinc/66/58/74/720665874.db2.gz OOWYEBXACKGQNB-FQEVSTJZSA-N 2 1 395.551 3.111 20 0 GGADMP Cc1nc(N(C)C)cc(N2CCC3(C[C@H]([N@H+](C)Cc4ccccc4)CO3)CC2)[nH+]1 ZINC001164840999 720665883 /nfs/dbraw/zinc/66/58/83/720665883.db2.gz OOWYEBXACKGQNB-FQEVSTJZSA-N 2 1 395.551 3.111 20 0 GGADMP Cc1nc(N(C)C)cc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)[nH+]1 ZINC001164840999 720665891 /nfs/dbraw/zinc/66/58/91/720665891.db2.gz OOWYEBXACKGQNB-FQEVSTJZSA-N 2 1 395.551 3.111 20 0 GGADMP CN(C)c1cc[nH+]c(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164839749 720689627 /nfs/dbraw/zinc/68/96/27/720689627.db2.gz BOCZTAXUFUWYSX-NRFANRHFSA-N 2 1 380.536 3.408 20 0 GGADMP CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ccc(C[NH+](C)C3CC3)cn1)[C@@H]2C ZINC001164863795 721008954 /nfs/dbraw/zinc/00/89/54/721008954.db2.gz VCROFBVEMDPGHR-QGZVFWFLSA-N 2 1 382.556 3.294 20 0 GGADMP CC(C)[NH+](C)Cc1cnc2n1CCN(c1ccc(C[N@H+](C)C3CC3)cn1)[C@@H]2C ZINC001164863795 721008959 /nfs/dbraw/zinc/00/89/59/721008959.db2.gz VCROFBVEMDPGHR-QGZVFWFLSA-N 2 1 382.556 3.294 20 0 GGADMP CC(C)[NH+](C)Cc1cnc2n1CCN(c1ccc(C[N@@H+](C)C3CC3)cn1)[C@@H]2C ZINC001164863795 721008965 /nfs/dbraw/zinc/00/89/65/721008965.db2.gz VCROFBVEMDPGHR-QGZVFWFLSA-N 2 1 382.556 3.294 20 0 GGADMP Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(C)cc(C)[nH+]3)C2)C1 ZINC001164778039 721333280 /nfs/dbraw/zinc/33/32/80/721333280.db2.gz TUKCBSKBBVTQDF-QFIPXVFZSA-N 2 1 384.524 3.422 20 0 GGADMP Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc4[nH]ccc4c[nH+]3)C2)C1 ZINC001164776710 721337335 /nfs/dbraw/zinc/33/73/35/721337335.db2.gz HXUQMOIVYJRJEJ-QFIPXVFZSA-N 2 1 395.507 3.287 20 0 GGADMP C[N@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(N3CCCC3)cc[nH+]1)CC2 ZINC001164791156 721489370 /nfs/dbraw/zinc/48/93/70/721489370.db2.gz BQSSQXDBYRFXBC-UHFFFAOYSA-N 2 1 392.551 3.353 20 0 GGADMP C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(N3CCCC3)cc[nH+]1)CC2 ZINC001164791156 721489374 /nfs/dbraw/zinc/48/93/74/721489374.db2.gz BQSSQXDBYRFXBC-UHFFFAOYSA-N 2 1 392.551 3.353 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC2(CC([N@H+](C)Cc3ccncc3)C2)CC1 ZINC001164791663 721492178 /nfs/dbraw/zinc/49/21/78/721492178.db2.gz DKTHJPOLEWSFGS-UHFFFAOYSA-N 2 1 376.508 3.244 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164791663 721492181 /nfs/dbraw/zinc/49/21/81/721492181.db2.gz DKTHJPOLEWSFGS-UHFFFAOYSA-N 2 1 376.508 3.244 20 0 GGADMP Fc1cccc(O[C@@H]2C[C@@H]3CN(c4cc(N5CCCC5)cc[nH+]4)CC[N@H+]3C2)c1 ZINC001164906777 721545227 /nfs/dbraw/zinc/54/52/27/721545227.db2.gz LHOVFLXVXYIMRQ-TZIWHRDSSA-N 2 1 382.483 3.163 20 0 GGADMP CN(C)c1cccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)[nH+]1 ZINC001164903723 721586472 /nfs/dbraw/zinc/58/64/72/721586472.db2.gz BXKJVNWNZBGWMH-HXUWFJFHSA-N 2 1 387.478 3.280 20 0 GGADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(N4CCCC4)cc[nH+]3)C[C@@H]21 ZINC001165028644 721797826 /nfs/dbraw/zinc/79/78/26/721797826.db2.gz ZINSSHNORPSFDD-SESVDKBCSA-N 2 1 392.551 3.209 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(N4CCCC4)cc[nH+]3)C[C@@H]21 ZINC001165028644 721797828 /nfs/dbraw/zinc/79/78/28/721797828.db2.gz ZINSSHNORPSFDD-SESVDKBCSA-N 2 1 392.551 3.209 20 0 GGADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(N4CCCC4)cc[nH+]3)C[C@H]21 ZINC001165028630 721797938 /nfs/dbraw/zinc/79/79/38/721797938.db2.gz ZINSSHNORPSFDD-CEWLAPEOSA-N 2 1 392.551 3.209 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(N4CCCC4)cc[nH+]3)C[C@H]21 ZINC001165028630 721797941 /nfs/dbraw/zinc/79/79/41/721797941.db2.gz ZINSSHNORPSFDD-CEWLAPEOSA-N 2 1 392.551 3.209 20 0 GGADMP CCN(C)c1cc[nH+]c(N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165021473 721798012 /nfs/dbraw/zinc/79/80/12/721798012.db2.gz HBXVRBKCYHPHNV-YSIASYRMSA-N 2 1 380.540 3.065 20 0 GGADMP CCN(C)c1cc[nH+]c(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165021473 721798014 /nfs/dbraw/zinc/79/80/14/721798014.db2.gz HBXVRBKCYHPHNV-YSIASYRMSA-N 2 1 380.540 3.065 20 0 GGADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(NC4CC4)cc[nH+]3)C[C@@H]21 ZINC001165028005 721798220 /nfs/dbraw/zinc/79/82/20/721798220.db2.gz XVNOMXKFNOLLTE-LSTHTHJFSA-N 2 1 378.524 3.183 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(NC4CC4)cc[nH+]3)C[C@@H]21 ZINC001165028005 721798222 /nfs/dbraw/zinc/79/82/22/721798222.db2.gz XVNOMXKFNOLLTE-LSTHTHJFSA-N 2 1 378.524 3.183 20 0 GGADMP Cc1c[nH]c2nc[nH+]c(N3C[C@@H]4CCC[C@H]([N@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165021365 721798727 /nfs/dbraw/zinc/79/87/27/721798727.db2.gz GNCILNQNCXEMOM-WDSOQIARSA-N 2 1 376.508 3.398 20 0 GGADMP Cc1c[nH]c2nc[nH+]c(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165021365 721798730 /nfs/dbraw/zinc/79/87/30/721798730.db2.gz GNCILNQNCXEMOM-WDSOQIARSA-N 2 1 376.508 3.398 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165017778 721804448 /nfs/dbraw/zinc/80/44/48/721804448.db2.gz APJLCWFPQZLHEV-FFZOFVMBSA-N 2 1 376.508 3.100 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165017778 721804449 /nfs/dbraw/zinc/80/44/49/721804449.db2.gz APJLCWFPQZLHEV-FFZOFVMBSA-N 2 1 376.508 3.100 20 0 GGADMP C[NH+](C)Cc1ccnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1 ZINC001165027566 721827573 /nfs/dbraw/zinc/82/75/73/721827573.db2.gz SQTJEPJGKZLPJF-KSEOMHKRSA-N 2 1 379.552 3.275 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cc(-n4ccnc4)cc[nH+]3)C[C@H]21 ZINC001165030230 721828002 /nfs/dbraw/zinc/82/80/02/721828002.db2.gz ZCABJOJTVPAOFL-VLCRHTCISA-N 2 1 388.519 3.399 20 0 GGADMP CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001164925202 721867866 /nfs/dbraw/zinc/86/78/66/721867866.db2.gz MXGXBVOWZMLJID-GOTSBHOMSA-N 2 1 389.547 3.299 20 0 GGADMP C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001164925202 721867867 /nfs/dbraw/zinc/86/78/67/721867867.db2.gz MXGXBVOWZMLJID-GOTSBHOMSA-N 2 1 389.547 3.299 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CC[NH+]3CCN(C)C)nc1 ZINC001164930928 721887455 /nfs/dbraw/zinc/88/74/55/721887455.db2.gz DKFFTFBTBAZMQZ-VSKRKVRLSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)nc1 ZINC001164930928 721887457 /nfs/dbraw/zinc/88/74/57/721887457.db2.gz DKFFTFBTBAZMQZ-VSKRKVRLSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CC[N@H+]3CCN(C)C)nc1 ZINC001164930928 721887459 /nfs/dbraw/zinc/88/74/59/721887459.db2.gz DKFFTFBTBAZMQZ-VSKRKVRLSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CCN3CC[NH+](C)C)nc1 ZINC001164930928 721887460 /nfs/dbraw/zinc/88/74/60/721887460.db2.gz DKFFTFBTBAZMQZ-VSKRKVRLSA-N 2 1 385.600 3.233 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CCN3CC[NH+](C)C)nc1 ZINC001164930928 721887461 /nfs/dbraw/zinc/88/74/61/721887461.db2.gz DKFFTFBTBAZMQZ-VSKRKVRLSA-N 2 1 385.600 3.233 20 0 GGADMP CC[NH+](CC)C1CCN(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)CC1 ZINC001165054304 722002272 /nfs/dbraw/zinc/00/22/72/722002272.db2.gz WJILYNDBYLCLFK-UHFFFAOYSA-N 2 1 379.552 3.346 20 0 GGADMP CC[NH+](CC)C1CCN(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)CC1 ZINC001165054304 722002274 /nfs/dbraw/zinc/00/22/74/722002274.db2.gz WJILYNDBYLCLFK-UHFFFAOYSA-N 2 1 379.552 3.346 20 0 GGADMP c1cncc(C[N@@H+]2CCO[C@@H]3CN(c4ccc5c([nH+]4)CCCC5)CC[C@H]3C2)c1 ZINC001164981510 722111427 /nfs/dbraw/zinc/11/14/27/722111427.db2.gz UHEPKSULNJXMOS-RBBKRZOGSA-N 2 1 378.520 3.083 20 0 GGADMP c1cncc(C[N@H+]2CCO[C@@H]3CN(c4ccc5c([nH+]4)CCCC5)CC[C@H]3C2)c1 ZINC001164981510 722111428 /nfs/dbraw/zinc/11/14/28/722111428.db2.gz UHEPKSULNJXMOS-RBBKRZOGSA-N 2 1 378.520 3.083 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(-c2nn[nH]n2)c1 ZINC000824579147 946828124 /nfs/dbraw/zinc/82/81/24/946828124.db2.gz XVRRPMSDPJXORV-MJGOQNOKSA-N 2 1 376.508 3.082 20 0 GGADMP C[C@H]([NH2+]Cc1cc(-c2nn[nH]n2)ccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824605148 946854474 /nfs/dbraw/zinc/85/44/74/946854474.db2.gz FURMZKKDCQQAKN-MAUKXSAKSA-N 2 1 380.471 3.006 20 0 GGADMP C[C@H]([NH2+]Cc1cc(-c2nn[nH]n2)ccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000824605148 946854485 /nfs/dbraw/zinc/85/44/85/946854485.db2.gz FURMZKKDCQQAKN-MAUKXSAKSA-N 2 1 380.471 3.006 20 0 GGADMP CC[N@H+]1C[C@]2(C[C@H](O)[C@@H]([NH2+]Cc3cnc(-c4ccco4)s3)C2)[C@@H]1C(C)C ZINC001550423931 1126206609 /nfs/dbraw/zinc/20/66/09/1126206609.db2.gz URDQNMREEXZIEJ-DUPRYPCISA-N 2 1 375.538 3.363 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)CCCOc2ccccc2C(N)=O)cn1 ZINC000097162370 211359911 /nfs/dbraw/zinc/35/99/11/211359911.db2.gz ADMJYWSNTVSKKC-MRXNPFEDSA-N 2 1 393.491 3.012 20 0 GGADMP COc1ccc2nc(C)nc(NCC3([NH+]4CCCCC4)CC[NH+](C)CC3)c2c1 ZINC000095982724 211291537 /nfs/dbraw/zinc/29/15/37/211291537.db2.gz XZEXQVGOQISURU-UHFFFAOYSA-N 2 1 383.540 3.309 20 0 GGADMP COc1c(Br)cc(C[NH2+]CCC[NH+](C)C)cc1Br ZINC000020967612 210371201 /nfs/dbraw/zinc/37/12/01/210371201.db2.gz MOTLYRIDBYGRRE-UHFFFAOYSA-N 2 1 380.124 3.262 20 0 GGADMP COc1c(Br)cc(Br)cc1C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414829273 565962629 /nfs/dbraw/zinc/96/26/29/565962629.db2.gz NPZLXIUKRKDWJS-JTQLQIEISA-N 2 1 392.135 3.309 20 0 GGADMP C[N@H+](CCCO)C1CCN(c2cc[nH+]c3cc(Br)ccc32)CC1 ZINC000116262013 564206169 /nfs/dbraw/zinc/20/61/69/564206169.db2.gz CYXINPOGAGHRCA-UHFFFAOYSA-N 2 1 378.314 3.280 20 0 GGADMP C[N@@H+](CCCO)C1CCN(c2cc[nH+]c3cc(Br)ccc32)CC1 ZINC000116262013 564206170 /nfs/dbraw/zinc/20/61/70/564206170.db2.gz CYXINPOGAGHRCA-UHFFFAOYSA-N 2 1 378.314 3.280 20 0 GGADMP C[N@@H+](CCC(=O)Nc1ccc(Br)cc1F)C[C@H]1CCC[NH+](C)C1 ZINC000118841293 564247300 /nfs/dbraw/zinc/24/73/00/564247300.db2.gz GLGKHMXOEGUZAH-ZDUSSCGKSA-N 2 1 386.309 3.190 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc(Br)cc1F)C[C@H]1CCC[N@H+](C)C1 ZINC000118841293 564247304 /nfs/dbraw/zinc/24/73/04/564247304.db2.gz GLGKHMXOEGUZAH-ZDUSSCGKSA-N 2 1 386.309 3.190 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc(Br)cc1F)C[C@H]1CCC[N@@H+](C)C1 ZINC000118841293 564247307 /nfs/dbraw/zinc/24/73/07/564247307.db2.gz GLGKHMXOEGUZAH-ZDUSSCGKSA-N 2 1 386.309 3.190 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000119425828 564269921 /nfs/dbraw/zinc/26/99/21/564269921.db2.gz FVZNLLPLOJHXDD-KGLIPLIRSA-N 2 1 380.330 3.240 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119644063 564280932 /nfs/dbraw/zinc/28/09/32/564280932.db2.gz BDMLKPAGTWXXST-CYBMUJFWSA-N 2 1 380.330 3.383 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+][C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000119902307 564294030 /nfs/dbraw/zinc/29/40/30/564294030.db2.gz HWQUQKVRXROOFP-KYOSRNDESA-N 2 1 376.854 3.262 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+][C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000119902307 564294032 /nfs/dbraw/zinc/29/40/32/564294032.db2.gz HWQUQKVRXROOFP-KYOSRNDESA-N 2 1 376.854 3.262 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@H]2CCc3cc(Br)ccc32)CC1 ZINC000124346050 564479665 /nfs/dbraw/zinc/47/96/65/564479665.db2.gz OVTGMQAJYGFMKI-IBGZPJMESA-N 2 1 380.374 3.300 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@H+](CCO)Cc1cc(Br)ccc1F ZINC000125502731 564516844 /nfs/dbraw/zinc/51/68/44/564516844.db2.gz NCGVLGNGMAPYCO-UHFFFAOYSA-N 2 1 384.293 3.368 20 0 GGADMP Cc1[nH+]ccn1CCCC[N@@H+](CCO)Cc1cc(Br)ccc1F ZINC000125502731 564516848 /nfs/dbraw/zinc/51/68/48/564516848.db2.gz NCGVLGNGMAPYCO-UHFFFAOYSA-N 2 1 384.293 3.368 20 0 GGADMP C[N@@H+](Cc1ccc(-n2ccnc2)nc1)[C@@H](CO)c1cccc(Br)c1 ZINC000125830543 564527959 /nfs/dbraw/zinc/52/79/59/564527959.db2.gz NVBNSCAZTNAAJI-KRWDZBQOSA-N 2 1 387.281 3.195 20 0 GGADMP CN(Cc1ccc(-n2ccnc2)nc1)[C@@H](CO)c1cccc(Br)c1 ZINC000125830543 564527963 /nfs/dbraw/zinc/52/79/63/564527963.db2.gz NVBNSCAZTNAAJI-KRWDZBQOSA-N 2 1 387.281 3.195 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC[N@@H+]1C ZINC000127480763 564585643 /nfs/dbraw/zinc/58/56/43/564585643.db2.gz CWPUTIQYUZDUCO-BEFAXECRSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC[N@H+]1C ZINC000127480763 564585644 /nfs/dbraw/zinc/58/56/44/564585644.db2.gz CWPUTIQYUZDUCO-BEFAXECRSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]C1CCN(Cc2ccc(Br)cc2)CC1 ZINC000127487484 564585649 /nfs/dbraw/zinc/58/56/49/564585649.db2.gz QHFXONSQBXXRBG-KXBFYZLASA-N 2 1 380.374 3.343 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C1CCN(Cc2ccc(Br)cc2)CC1 ZINC000127487484 564585651 /nfs/dbraw/zinc/58/56/51/564585651.db2.gz QHFXONSQBXXRBG-KXBFYZLASA-N 2 1 380.374 3.343 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C1CCN(Cc2ccc(Br)cc2)CC1 ZINC000127487241 564585674 /nfs/dbraw/zinc/58/56/74/564585674.db2.gz QHFXONSQBXXRBG-BEFAXECRSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C1CCN(Cc2ccc(Br)cc2)CC1 ZINC000127487241 564585677 /nfs/dbraw/zinc/58/56/77/564585677.db2.gz QHFXONSQBXXRBG-BEFAXECRSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)c2cccc(Br)c21 ZINC000128136949 564608520 /nfs/dbraw/zinc/60/85/20/564608520.db2.gz XKMJGUANRHPDIV-JKIFEVAISA-N 2 1 394.357 3.174 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@@H]2CCc3c2cc(Br)cc3F)CC1 ZINC000128273776 564613497 /nfs/dbraw/zinc/61/34/97/564613497.db2.gz SYXUUVHINBGSOL-GOSISDBHSA-N 2 1 384.337 3.193 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@@H]2CCCOc3cc(Br)ccc32)CC1 ZINC000128553123 564621959 /nfs/dbraw/zinc/62/19/59/564621959.db2.gz IUHFHXMBMPKLOJ-GOSISDBHSA-N 2 1 396.373 3.280 20 0 GGADMP C[C@H](Cc1ccc(Br)c(F)c1)[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000128709154 564627196 /nfs/dbraw/zinc/62/71/96/564627196.db2.gz DPNRDJCRANQZMM-OAHLLOKOSA-N 2 1 386.353 3.136 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)N[C@@H](C)c1ccc(Br)cc1 ZINC000130812575 564693389 /nfs/dbraw/zinc/69/33/89/564693389.db2.gz FKEWVPZSHVWKNY-AWEZNQCLSA-N 2 1 393.329 3.153 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)N[C@@H](C)c1ccc(Br)cc1 ZINC000130812575 564693394 /nfs/dbraw/zinc/69/33/94/564693394.db2.gz FKEWVPZSHVWKNY-AWEZNQCLSA-N 2 1 393.329 3.153 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)N[C@H](C)c1ccc(Br)cc1 ZINC000130812792 564693750 /nfs/dbraw/zinc/69/37/50/564693750.db2.gz FKEWVPZSHVWKNY-CQSZACIVSA-N 2 1 393.329 3.153 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)N[C@H](C)c1ccc(Br)cc1 ZINC000130812792 564693755 /nfs/dbraw/zinc/69/37/55/564693755.db2.gz FKEWVPZSHVWKNY-CQSZACIVSA-N 2 1 393.329 3.153 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000130856716 564694400 /nfs/dbraw/zinc/69/44/00/564694400.db2.gz DXHJLDFFMDWLHF-ZDUSSCGKSA-N 2 1 379.302 3.303 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000130856716 564694404 /nfs/dbraw/zinc/69/44/04/564694404.db2.gz DXHJLDFFMDWLHF-ZDUSSCGKSA-N 2 1 379.302 3.303 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000134380806 564800951 /nfs/dbraw/zinc/80/09/51/564800951.db2.gz PRBLKKQSBBGYQB-GOSISDBHSA-N 2 1 398.364 3.439 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1c(Br)ccc2F ZINC000134392448 564802530 /nfs/dbraw/zinc/80/25/30/564802530.db2.gz HQGANOXLTQRRKS-DYVFJYSZSA-N 2 1 385.321 3.402 20 0 GGADMP CSC[C@H]1CCC[N@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000135424163 564831238 /nfs/dbraw/zinc/83/12/38/564831238.db2.gz VNJMBQMTPZSFCD-GOSISDBHSA-N 2 1 379.595 3.001 20 0 GGADMP Oc1ccc(Br)c(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000093735138 564889515 /nfs/dbraw/zinc/88/95/15/564889515.db2.gz UDJGTVFDHGCBBO-UHFFFAOYSA-N 2 1 383.330 3.232 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000151097708 564905356 /nfs/dbraw/zinc/90/53/56/564905356.db2.gz VDLWJAJKXSBGED-LSDHHAIUSA-N 2 1 382.346 3.488 20 0 GGADMP COCCC[C@@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(Br)cc1 ZINC000151364129 564916175 /nfs/dbraw/zinc/91/61/75/564916175.db2.gz LMCDWDDFTNXYRG-LJQANCHMSA-N 2 1 399.373 3.353 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCc2nc(C(F)(F)F)cs2)[C@H](C)C1 ZINC000152207295 564951016 /nfs/dbraw/zinc/95/10/16/564951016.db2.gz LOQBXOBMEMJLMA-ZIAGYGMSSA-N 2 1 379.492 3.431 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)C[N@@H+](C)[C@@H]2CCSC2)c2cccs2)CC1 ZINC000153289919 564989879 /nfs/dbraw/zinc/98/98/79/564989879.db2.gz CDVWTTXIVRGLHM-IAGOWNOFSA-N 2 1 381.611 3.075 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)Cn2cc(Br)cn2)cc1F ZINC000153714917 565007486 /nfs/dbraw/zinc/00/74/86/565007486.db2.gz UVZADXJRZUSPDD-LBPRGKRZSA-N 2 1 392.276 3.457 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000154459369 565040237 /nfs/dbraw/zinc/04/02/37/565040237.db2.gz SRQJRMNGBTXPOJ-LJQANCHMSA-N 2 1 380.374 3.444 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Br)cc2)CCOCC1 ZINC000155255595 565065152 /nfs/dbraw/zinc/06/51/52/565065152.db2.gz MGOPTMUJPIBWHX-YJBOKZPZSA-N 2 1 381.358 3.427 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(Br)cn2)CC1 ZINC000114475725 565074733 /nfs/dbraw/zinc/07/47/33/565074733.db2.gz GTAGHKFHAPMOHT-UHFFFAOYSA-N 2 1 397.361 3.227 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(Br)cn2)CC1 ZINC000114475725 565074734 /nfs/dbraw/zinc/07/47/34/565074734.db2.gz GTAGHKFHAPMOHT-UHFFFAOYSA-N 2 1 397.361 3.227 20 0 GGADMP C[NH+]1CCC(C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CC1 ZINC000184324372 565128461 /nfs/dbraw/zinc/12/84/61/565128461.db2.gz GZGBUWPEQFDPNL-UHFFFAOYSA-N 2 1 384.351 3.416 20 0 GGADMP O[C@H](COc1ccc(Br)cc1)C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157406091 565131328 /nfs/dbraw/zinc/13/13/28/565131328.db2.gz APKUENZVYRUKQN-ROUUACIJSA-N 2 1 397.357 3.139 20 0 GGADMP O[C@H](COc1ccc(Br)cc1)C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157406091 565131330 /nfs/dbraw/zinc/13/13/30/565131330.db2.gz APKUENZVYRUKQN-ROUUACIJSA-N 2 1 397.357 3.139 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)N[C@@H]1CC[N@H+](C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000158234370 565161013 /nfs/dbraw/zinc/16/10/13/565161013.db2.gz LTGGEXUYBCZDTF-ZACQAIPSSA-N 2 1 387.952 3.200 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)N[C@@H]1CC[N@@H+](C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000158234370 565161018 /nfs/dbraw/zinc/16/10/18/565161018.db2.gz LTGGEXUYBCZDTF-ZACQAIPSSA-N 2 1 387.952 3.200 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)N[C@H]1CC[N@H+](C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000158234210 565161198 /nfs/dbraw/zinc/16/11/98/565161198.db2.gz LTGGEXUYBCZDTF-IKGGRYGDSA-N 2 1 387.952 3.200 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)N[C@H]1CC[N@@H+](C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000158234210 565161201 /nfs/dbraw/zinc/16/12/01/565161201.db2.gz LTGGEXUYBCZDTF-IKGGRYGDSA-N 2 1 387.952 3.200 20 0 GGADMP CSc1ccc(Cl)c(C(=O)N(C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)c1 ZINC000370841824 565164077 /nfs/dbraw/zinc/16/40/77/565164077.db2.gz OMMLNGNPWNZJQO-HNNXBMFYSA-N 2 1 381.973 3.302 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(Br)cn1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185766534 565220782 /nfs/dbraw/zinc/22/07/82/565220782.db2.gz ZEUKJEXKOPMISD-KBPBESRZSA-N 2 1 395.345 3.025 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(Br)cn1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766534 565220783 /nfs/dbraw/zinc/22/07/83/565220783.db2.gz ZEUKJEXKOPMISD-KBPBESRZSA-N 2 1 395.345 3.025 20 0 GGADMP COc1cc(C[NH2+]CC2=CC[N@@H+](C)CC2)cc(Br)c1OC(F)F ZINC000271781842 565268749 /nfs/dbraw/zinc/26/87/49/565268749.db2.gz DTNLKZWFHZUBNW-UHFFFAOYSA-N 2 1 391.256 3.411 20 0 GGADMP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cccc(F)c2Br)C1 ZINC000295485762 565269238 /nfs/dbraw/zinc/26/92/38/565269238.db2.gz SIJAYWOGUKEERD-QGZVFWFLSA-N 2 1 393.300 3.445 20 0 GGADMP O[C@@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc(F)c2Br)C1 ZINC000295485762 565269243 /nfs/dbraw/zinc/26/92/43/565269243.db2.gz SIJAYWOGUKEERD-QGZVFWFLSA-N 2 1 393.300 3.445 20 0 GGADMP C[N@@H+]1CC=C(C[NH2+]C2CCN(Cc3ccccc3Br)CC2)CC1 ZINC000271846927 565270030 /nfs/dbraw/zinc/27/00/30/565270030.db2.gz HVPMHDNYYVIWAJ-UHFFFAOYSA-N 2 1 378.358 3.265 20 0 GGADMP CCS(=O)(=O)c1c(Cl)cccc1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000187110594 565309876 /nfs/dbraw/zinc/30/98/76/565309876.db2.gz ILGXSMPOTLUANP-UHFFFAOYSA-N 2 1 380.941 3.485 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2cc(Br)ncc2F)CC1 ZINC000273917357 565345977 /nfs/dbraw/zinc/34/59/77/565345977.db2.gz YXYAJBUZPHUWOI-CQSZACIVSA-N 2 1 387.341 3.052 20 0 GGADMP C[C@H]([NH2+]CCCCN1CC[NH+](CCO)CC1)c1cc(F)c(Cl)cc1Cl ZINC000168943027 565381996 /nfs/dbraw/zinc/38/19/96/565381996.db2.gz FNGONSXUTBITAU-AWEZNQCLSA-N 2 1 392.346 3.173 20 0 GGADMP Cc1ccc(Br)cc1NC(=O)CC[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000298299541 565408348 /nfs/dbraw/zinc/40/83/48/565408348.db2.gz HMWYKPMCBIRRSO-UHFFFAOYSA-N 2 1 380.330 3.303 20 0 GGADMP CC[NH+](CC)CCC[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000188686178 565416971 /nfs/dbraw/zinc/41/69/71/565416971.db2.gz QEZYWRZQWARXQV-UHFFFAOYSA-N 2 1 384.362 3.107 20 0 GGADMP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000188749670 565421366 /nfs/dbraw/zinc/42/13/66/565421366.db2.gz FNVNFHDMPQVIKF-MSOLQXFVSA-N 2 1 396.373 3.248 20 0 GGADMP Brc1ccc2[nH+]ccc(N3CC[C@H](C[NH+]4CCOCC4)C3)c2c1 ZINC000301468649 565488925 /nfs/dbraw/zinc/48/89/25/565488925.db2.gz RJPLKLOLVJCICW-CQSZACIVSA-N 2 1 376.298 3.156 20 0 GGADMP C[NH+](C)C1CCN(CCNc2cc[nH+]c3ccc(Br)cc23)CC1 ZINC000301531291 565493772 /nfs/dbraw/zinc/49/37/72/565493772.db2.gz LFSHWLWOQYPKAK-UHFFFAOYSA-N 2 1 377.330 3.435 20 0 GGADMP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](CCOc3cc(Cl)cc(Cl)c3)C2)CC1 ZINC000377920991 565505008 /nfs/dbraw/zinc/50/50/08/565505008.db2.gz WXGRTKCCJKQFSI-SFHVURJKSA-N 2 1 386.367 3.473 20 0 GGADMP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](CCOc3ccc(Cl)cc3Cl)C2)CC1 ZINC000377907860 565505262 /nfs/dbraw/zinc/50/52/62/565505262.db2.gz KKJPYRYLCUMKGX-QGZVFWFLSA-N 2 1 386.367 3.473 20 0 GGADMP Cc1nn(C)c(CNCC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1Br ZINC000379629247 565538908 /nfs/dbraw/zinc/53/89/08/565538908.db2.gz OOHLVSCFVFKGDD-CQSZACIVSA-N 2 1 379.346 3.491 20 0 GGADMP Brc1ccc([C@@H]([NH2+]C[C@@H]2CCc3[nH+]ccn3C2)c2cncnc2)cc1 ZINC000278910163 565584856 /nfs/dbraw/zinc/58/48/56/565584856.db2.gz GUDNUJKSSYKIFB-IFXJQAMLSA-N 2 1 398.308 3.377 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000173794395 565587808 /nfs/dbraw/zinc/58/78/08/565587808.db2.gz MLNSAMOKWCZNIH-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP C[C@H](C[NH2+]Cc1cc(Br)c2c(c1)OCCO2)C[NH+]1CCCCC1 ZINC000321338572 565606009 /nfs/dbraw/zinc/60/60/09/565606009.db2.gz VOQUHHLWEKEBME-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc(Br)o1 ZINC000191580803 565614757 /nfs/dbraw/zinc/61/47/57/565614757.db2.gz ZSSMAVOYZKOCMQ-MRXNPFEDSA-N 2 1 379.298 3.289 20 0 GGADMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc(Br)o1 ZINC000191580803 565614761 /nfs/dbraw/zinc/61/47/61/565614761.db2.gz ZSSMAVOYZKOCMQ-MRXNPFEDSA-N 2 1 379.298 3.289 20 0 GGADMP C[C@H](c1cccc(Br)c1)[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000325295718 565621610 /nfs/dbraw/zinc/62/16/10/565621610.db2.gz YJRABDRJXVIMNZ-VKJFTORMSA-N 2 1 394.357 3.090 20 0 GGADMP Brc1cnn(CCC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000326701034 565624809 /nfs/dbraw/zinc/62/48/09/565624809.db2.gz XDFOIPUDIHXXOB-UHFFFAOYSA-N 2 1 391.357 3.332 20 0 GGADMP CC(C)[NH+]1CCC([NH2+][C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC1 ZINC000174295820 565627951 /nfs/dbraw/zinc/62/79/51/565627951.db2.gz SMDYHFKOCMAIQW-OAHLLOKOSA-N 2 1 396.373 3.258 20 0 GGADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC1 ZINC000174295808 565628309 /nfs/dbraw/zinc/62/83/09/565628309.db2.gz SMDYHFKOCMAIQW-HNNXBMFYSA-N 2 1 396.373 3.258 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CCN(c2cccc(Br)c2)C1=O ZINC000192075015 565656307 /nfs/dbraw/zinc/65/63/07/565656307.db2.gz RGULONBYPBQXIE-KRWDZBQOSA-N 2 1 391.313 3.081 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CCN(c2cccc(Br)c2)C1=O ZINC000192075015 565656311 /nfs/dbraw/zinc/65/63/11/565656311.db2.gz RGULONBYPBQXIE-KRWDZBQOSA-N 2 1 391.313 3.081 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]Cc1ccc(Br)c(Cl)c1 ZINC000192167502 565664556 /nfs/dbraw/zinc/66/45/56/565664556.db2.gz JSLAYYNKOCJWNC-AWEZNQCLSA-N 2 1 375.738 3.429 20 0 GGADMP CN(Cc1ccccc1Br)C(=O)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000192851997 565715763 /nfs/dbraw/zinc/71/57/63/565715763.db2.gz NRALXLJEBZDDGG-ALOPSCKCSA-N 2 1 394.357 3.012 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(Cl)cs3)c2)C1 ZINC000193095336 565732512 /nfs/dbraw/zinc/73/25/12/565732512.db2.gz KWBVCUDWWRSPHA-MRXNPFEDSA-N 2 1 377.941 3.389 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)cc1Br ZINC000282180229 565767660 /nfs/dbraw/zinc/76/76/60/565767660.db2.gz FPBVLJZSSSSDQX-AWEZNQCLSA-N 2 1 384.362 3.134 20 0 GGADMP COc1ccc([C@@H](C)[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)cc1Br ZINC000282180232 565767933 /nfs/dbraw/zinc/76/79/33/565767933.db2.gz FPBVLJZSSSSDQX-CQSZACIVSA-N 2 1 384.362 3.134 20 0 GGADMP CC(C)[C@H](C(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1)[NH+](C)C ZINC000412972979 565825719 /nfs/dbraw/zinc/82/57/19/565825719.db2.gz OYHUZQITKCVLRX-GOSISDBHSA-N 2 1 396.373 3.116 20 0 GGADMP [NH3+]C1CCN(C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CC1 ZINC000332502723 565841533 /nfs/dbraw/zinc/84/15/33/565841533.db2.gz AFPRXICBRXYYFO-UHFFFAOYSA-N 2 1 385.339 3.091 20 0 GGADMP C[C@H]1CC2(C[N@H+]1Cc1nc(-c3cccc(Br)c3)no1)CC[NH2+]CC2 ZINC000333622809 565890419 /nfs/dbraw/zinc/89/04/19/565890419.db2.gz UPMNPXSSOQVKGL-ZDUSSCGKSA-N 2 1 391.313 3.463 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]1C1CCN(c2cc[nH+]c3ccc(Br)cc32)CC1 ZINC000333816386 565897471 /nfs/dbraw/zinc/89/74/71/565897471.db2.gz GRLFBZCNHIJBHM-QAPCUYQASA-N 2 1 376.298 3.330 20 0 GGADMP C[N@@H+](CCC(=O)Nc1ccc(Br)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000285509203 565911236 /nfs/dbraw/zinc/91/12/36/565911236.db2.gz NHTFSYRWSVHYML-SJPCQFCGSA-N 2 1 380.330 3.335 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc(Br)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000285509203 565911240 /nfs/dbraw/zinc/91/12/40/565911240.db2.gz NHTFSYRWSVHYML-SJPCQFCGSA-N 2 1 380.330 3.335 20 0 GGADMP C[NH+](CCC(=O)Nc1ccc(Br)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285509203 565911243 /nfs/dbraw/zinc/91/12/43/565911243.db2.gz NHTFSYRWSVHYML-SJPCQFCGSA-N 2 1 380.330 3.335 20 0 GGADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]C1CCN(Cc2cccc(Br)c2)CC1 ZINC000414351243 565913791 /nfs/dbraw/zinc/91/37/91/565913791.db2.gz MWMIVWZLDCMAAW-KXBFYZLASA-N 2 1 380.374 3.343 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C1CCN(Cc2cccc(Br)c2)CC1 ZINC000414351243 565913794 /nfs/dbraw/zinc/91/37/94/565913794.db2.gz MWMIVWZLDCMAAW-KXBFYZLASA-N 2 1 380.374 3.343 20 0 GGADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]C1CCN(Cc2cccc(Br)c2)CC1 ZINC000414351242 565913826 /nfs/dbraw/zinc/91/38/26/565913826.db2.gz MWMIVWZLDCMAAW-HNAYVOBHSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]C1CCN(Cc2cccc(Br)c2)CC1 ZINC000414351242 565913830 /nfs/dbraw/zinc/91/38/30/565913830.db2.gz MWMIVWZLDCMAAW-HNAYVOBHSA-N 2 1 380.374 3.343 20 0 GGADMP CC[NH+]1CCC([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC1 ZINC000414349112 565914019 /nfs/dbraw/zinc/91/40/19/565914019.db2.gz JSDNVRNRIVOLMR-UHFFFAOYSA-N 2 1 380.374 3.487 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC[N@@H+]1C ZINC000414356167 565914396 /nfs/dbraw/zinc/91/43/96/565914396.db2.gz YSHXXILUOWRZBU-DNVCBOLYSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC[N@H+]1C ZINC000414356167 565914401 /nfs/dbraw/zinc/91/44/01/565914401.db2.gz YSHXXILUOWRZBU-DNVCBOLYSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC[N@@H+]1C ZINC000414356168 565914720 /nfs/dbraw/zinc/91/47/20/565914720.db2.gz YSHXXILUOWRZBU-HNAYVOBHSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(Cc3cccc(Br)c3)CC2)CC[N@H+]1C ZINC000414356168 565914729 /nfs/dbraw/zinc/91/47/29/565914729.db2.gz YSHXXILUOWRZBU-HNAYVOBHSA-N 2 1 380.374 3.486 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)Nc1ccc(Br)cc1C ZINC000178440153 565918304 /nfs/dbraw/zinc/91/83/04/565918304.db2.gz GPWWKAPLPIWSSJ-UHFFFAOYSA-N 2 1 379.302 3.223 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)Nc1ccc(Br)cc1C ZINC000178440153 565918307 /nfs/dbraw/zinc/91/83/07/565918307.db2.gz GPWWKAPLPIWSSJ-UHFFFAOYSA-N 2 1 379.302 3.223 20 0 GGADMP COc1cc(Br)c(C[NH2+]C[C@H](C)Cn2cc[nH+]c2C)c(OC)c1 ZINC000178856818 565941105 /nfs/dbraw/zinc/94/11/05/565941105.db2.gz IQSHBRKAZTVKDG-LBPRGKRZSA-N 2 1 382.302 3.397 20 0 GGADMP COc1cc(Br)c(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)c(OC)c1 ZINC000178856833 565941657 /nfs/dbraw/zinc/94/16/57/565941657.db2.gz IQSHBRKAZTVKDG-GFCCVEGCSA-N 2 1 382.302 3.397 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)N[C@@H]1CC[N@H+](C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000237327125 565956611 /nfs/dbraw/zinc/95/66/11/565956611.db2.gz LTGGEXUYBCZDTF-GVDBMIGSSA-N 2 1 387.952 3.200 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)N[C@@H]1CC[N@@H+](C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000237327125 565956618 /nfs/dbraw/zinc/95/66/18/565956618.db2.gz LTGGEXUYBCZDTF-GVDBMIGSSA-N 2 1 387.952 3.200 20 0 GGADMP C[NH2+]C[C@H](C)C[NH2+]Cc1cc(Br)ccc1OCc1ccccn1 ZINC000414836918 565962106 /nfs/dbraw/zinc/96/21/06/565962106.db2.gz JTZDBXJBZLEWRT-AWEZNQCLSA-N 2 1 378.314 3.368 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414914185 565965272 /nfs/dbraw/zinc/96/52/72/565965272.db2.gz XLBUCVYJSJDPNQ-SFHVURJKSA-N 2 1 385.346 3.344 20 0 GGADMP COc1cc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc(Br)c1OC(F)F ZINC000414946386 565966671 /nfs/dbraw/zinc/96/66/71/565966671.db2.gz JMJKCTPVRHDFRA-GXSJLCMTSA-N 2 1 379.245 3.289 20 0 GGADMP COc1c(Br)cc(Br)cc1C[NH2+]C1(C)CC[NH2+]CC1 ZINC000414945785 565967064 /nfs/dbraw/zinc/96/70/64/565967064.db2.gz SCYUFFUPQITOTC-UHFFFAOYSA-N 2 1 392.135 3.452 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414955444 565967457 /nfs/dbraw/zinc/96/74/57/565967457.db2.gz UHSRUNHMJLAHLC-BLLLJJGKSA-N 2 1 377.330 3.482 20 0 GGADMP C[C@@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000415037500 565971130 /nfs/dbraw/zinc/97/11/30/565971130.db2.gz LHFIOXSYLLKNBB-LIRRHRJNSA-N 2 1 393.325 3.338 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]CCC[NH2+]C1CC1 ZINC000415068258 565971845 /nfs/dbraw/zinc/97/18/45/565971845.db2.gz MCZCWMSVFYMCMK-UHFFFAOYSA-N 2 1 377.330 3.483 20 0 GGADMP COc1sc(C[NH+]2CCC([C@@H]3OCCC[C@@H]3[NH3+])CC2)cc1Br ZINC000415111389 565973362 /nfs/dbraw/zinc/97/33/62/565973362.db2.gz QVGFMFMSEVWIGU-GJZGRUSLSA-N 2 1 389.359 3.238 20 0 GGADMP [NH3+]CCCC(=O)N1CC[NH+](Cc2ccc(-c3cccc(Cl)c3)s2)CC1 ZINC000237908372 565974074 /nfs/dbraw/zinc/97/40/74/565974074.db2.gz UFFZDHRGVDNRSZ-UHFFFAOYSA-N 2 1 377.941 3.452 20 0 GGADMP COc1ccc(Br)cc1C[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000415119290 565974720 /nfs/dbraw/zinc/97/47/20/565974720.db2.gz FFNRXNCTMWPFNV-WMZOPIPTSA-N 2 1 383.330 3.176 20 0 GGADMP C[C@H](C[N@H+]1CC2(CC[NH2+]CC2)[C@@H]2COC[C@@H]21)c1cccc(Br)c1 ZINC000415141515 565976273 /nfs/dbraw/zinc/97/62/73/565976273.db2.gz PNXXZSGZQBXKRO-OLMNPRSZSA-N 2 1 379.342 3.253 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cn2)cc1 ZINC000363016170 565987483 /nfs/dbraw/zinc/98/74/83/565987483.db2.gz RHAHWCDAAWUNCM-SJLPKXTDSA-N 2 1 375.314 3.351 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)cn2)cc1 ZINC000363016170 565987486 /nfs/dbraw/zinc/98/74/86/565987486.db2.gz RHAHWCDAAWUNCM-SJLPKXTDSA-N 2 1 375.314 3.351 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](Cc2ccc(Br)cn2)CC1 ZINC000179680148 566000466 /nfs/dbraw/zinc/00/04/66/566000466.db2.gz UMRZNIGXAYAWNE-UHFFFAOYSA-N 2 1 384.362 3.415 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2ccc(Br)cn2)CC1 ZINC000179680148 566000472 /nfs/dbraw/zinc/00/04/72/566000472.db2.gz UMRZNIGXAYAWNE-UHFFFAOYSA-N 2 1 384.362 3.415 20 0 GGADMP C[N@@H+](CC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)[C@H]1CCSC1 ZINC000245865623 566008052 /nfs/dbraw/zinc/00/80/52/566008052.db2.gz LJFWHSMGPHUDCQ-MAUKXSAKSA-N 2 1 381.973 3.030 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172545 566019949 /nfs/dbraw/zinc/01/99/49/566019949.db2.gz JFWUTMGBZXRONG-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172545 566019953 /nfs/dbraw/zinc/01/99/53/566019953.db2.gz JFWUTMGBZXRONG-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172545 566019957 /nfs/dbraw/zinc/01/99/57/566019957.db2.gz JFWUTMGBZXRONG-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172545 566019961 /nfs/dbraw/zinc/01/99/61/566019961.db2.gz JFWUTMGBZXRONG-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172545 566019964 /nfs/dbraw/zinc/01/99/64/566019964.db2.gz JFWUTMGBZXRONG-GOEBONIOSA-N 2 1 375.340 3.397 20 0 GGADMP Cc1ccc(NC(=O)[C@@H](C)N(C)C[C@H]2CCC[N@@H+](C)C2)c(Br)c1 ZINC000246214090 566021116 /nfs/dbraw/zinc/02/11/16/566021116.db2.gz YJSAWYBLXFSVOS-CABCVRRESA-N 2 1 382.346 3.358 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212767 566021258 /nfs/dbraw/zinc/02/12/58/566021258.db2.gz NXPOOJFZZRWTHD-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212767 566021261 /nfs/dbraw/zinc/02/12/61/566021261.db2.gz NXPOOJFZZRWTHD-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212767 566021265 /nfs/dbraw/zinc/02/12/65/566021265.db2.gz NXPOOJFZZRWTHD-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212767 566021269 /nfs/dbraw/zinc/02/12/69/566021269.db2.gz NXPOOJFZZRWTHD-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000246212767 566021272 /nfs/dbraw/zinc/02/12/72/566021272.db2.gz NXPOOJFZZRWTHD-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H]2CCc3c2cccc3Br)CC1 ZINC000180015549 566025421 /nfs/dbraw/zinc/02/54/21/566025421.db2.gz RZMCWEFAJAHDDE-IBGZPJMESA-N 2 1 380.374 3.444 20 0 GGADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)[C@@H](C)C1 ZINC000246439523 566029531 /nfs/dbraw/zinc/02/95/31/566029531.db2.gz OLVWFLDYOPHTNZ-MAUKXSAKSA-N 2 1 396.373 3.106 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(Br)cc2N2CCOCC2)[C@@H](C)C1 ZINC000246439523 566029536 /nfs/dbraw/zinc/02/95/36/566029536.db2.gz OLVWFLDYOPHTNZ-MAUKXSAKSA-N 2 1 396.373 3.106 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCc3c2cccc3Br)CC1 ZINC000180094812 566032557 /nfs/dbraw/zinc/03/25/57/566032557.db2.gz BPVXDSSNGFFZPT-LJQANCHMSA-N 2 1 380.374 3.300 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000247494301 566061202 /nfs/dbraw/zinc/06/12/02/566061202.db2.gz LEGTUEHPKHRJGQ-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000247494301 566061206 /nfs/dbraw/zinc/06/12/06/566061206.db2.gz LEGTUEHPKHRJGQ-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP COc1cc(Br)c(CN2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1OC ZINC000247922483 566068624 /nfs/dbraw/zinc/06/86/24/566068624.db2.gz BIFKXCNFXSVJIB-CZUORRHYSA-N 2 1 383.330 3.382 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3cccc(Br)c3)CC[C@H]21 ZINC000247979739 566069446 /nfs/dbraw/zinc/06/94/46/566069446.db2.gz MESOBNYSSFOSNI-WMLDXEAASA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CCC(=O)Nc3cccc(Br)c3)CC[C@H]21 ZINC000247979739 566069452 /nfs/dbraw/zinc/06/94/52/566069452.db2.gz MESOBNYSSFOSNI-WMLDXEAASA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CCC(=O)Nc3cccc(Br)c3)CC[C@H]21 ZINC000247979739 566069456 /nfs/dbraw/zinc/06/94/56/566069456.db2.gz MESOBNYSSFOSNI-WMLDXEAASA-N 2 1 380.330 3.194 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3ccc(Br)cc3)CC[C@H]21 ZINC000247973887 566070105 /nfs/dbraw/zinc/07/01/05/566070105.db2.gz KFCYWEPURLXUAS-RHSMWYFYSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CCC(=O)Nc3ccc(Br)cc3)CC[C@H]21 ZINC000247973887 566070107 /nfs/dbraw/zinc/07/01/07/566070107.db2.gz KFCYWEPURLXUAS-RHSMWYFYSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCC(=O)Nc3ccc(Br)cc3)CC[C@H]21 ZINC000247973887 566070111 /nfs/dbraw/zinc/07/01/11/566070111.db2.gz KFCYWEPURLXUAS-RHSMWYFYSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1ccccc1Br ZINC000288537426 566078665 /nfs/dbraw/zinc/07/86/65/566078665.db2.gz KOTWMYHFSRGEJX-UHFFFAOYSA-N 2 1 378.314 3.464 20 0 GGADMP CC[C@@H](CSC)[N@@H+](C)CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000180677611 566081702 /nfs/dbraw/zinc/08/17/02/566081702.db2.gz MNBZTCZMANIHAT-SFHVURJKSA-N 2 1 381.611 3.247 20 0 GGADMP C[C@H](N[C@@H](C(N)=O)c1ccc(Br)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248620018 566083905 /nfs/dbraw/zinc/08/39/05/566083905.db2.gz ZYFDXMKHLRDCOG-JCKWVBRZSA-N 2 1 394.357 3.218 20 0 GGADMP Cc1ccc(Br)cc1NC(=O)CC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000180829922 566092485 /nfs/dbraw/zinc/09/24/85/566092485.db2.gz QRMGUPHIGVOTFX-SQWLQELKSA-N 2 1 382.346 3.404 20 0 GGADMP Cc1ccc(Br)cc1NC(=O)CC[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000180829082 566093121 /nfs/dbraw/zinc/09/31/21/566093121.db2.gz YYYZJLBSGQDHLL-JKSUJKDBSA-N 2 1 380.330 3.303 20 0 GGADMP Cc1cc(NC(=O)C[N@@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)ccc1Br ZINC000252664124 566115639 /nfs/dbraw/zinc/11/56/39/566115639.db2.gz UVQJCYZROHYMLA-DYVFJYSZSA-N 2 1 391.313 3.476 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1cc(Br)c(Cl)s1 ZINC000289445822 566122660 /nfs/dbraw/zinc/12/26/60/566122660.db2.gz MOJVMMMCXMSJPS-UHFFFAOYSA-N 2 1 380.783 3.233 20 0 GGADMP C[C@@H](CNC(=O)[C@@](C)([NH3+])c1ccc(Br)cc1)[N@H+]1CCCC[C@H]1C ZINC000261721079 566131109 /nfs/dbraw/zinc/13/11/09/566131109.db2.gz KDRDZEHMIVZIAZ-GLJUWKHASA-N 2 1 382.346 3.002 20 0 GGADMP CCOC(=O)C[N@H+](CC1CC[NH2+]CC1)[C@@H](C)c1cccc(Br)c1 ZINC000261753673 566132635 /nfs/dbraw/zinc/13/26/35/566132635.db2.gz CJWDICMFGJAOIQ-AWEZNQCLSA-N 2 1 383.330 3.375 20 0 GGADMP CCOC(=O)C[N@@H+](CC1CC[NH2+]CC1)[C@@H](C)c1cccc(Br)c1 ZINC000261753673 566132642 /nfs/dbraw/zinc/13/26/42/566132642.db2.gz CJWDICMFGJAOIQ-AWEZNQCLSA-N 2 1 383.330 3.375 20 0 GGADMP O=C(CC[C@@H]1CC[NH2+]C1)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000261831087 566136745 /nfs/dbraw/zinc/13/67/45/566136745.db2.gz NEONEOGSENOYRI-CQSZACIVSA-N 2 1 384.351 3.464 20 0 GGADMP C[N@@H+](Cc1cccc(Br)c1OC[C@@H]1CCCO1)C[C@@H]1CCC[NH2+]C1 ZINC000261944962 566141489 /nfs/dbraw/zinc/14/14/89/566141489.db2.gz NGJONLYVYVFBLD-WBVHZDCISA-N 2 1 397.357 3.438 20 0 GGADMP C[N@H+](Cc1cccc(Br)c1OC[C@@H]1CCCO1)C[C@@H]1CCC[NH2+]C1 ZINC000261944962 566141491 /nfs/dbraw/zinc/14/14/91/566141491.db2.gz NGJONLYVYVFBLD-WBVHZDCISA-N 2 1 397.357 3.438 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3nc(-c4cccc(Br)c4)no3)C[C@H]21 ZINC000261969026 566141615 /nfs/dbraw/zinc/14/16/15/566141615.db2.gz YUBTZPRPTVIWQZ-BPLDGKMQSA-N 2 1 377.286 3.058 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4cccc(Br)c4)no3)C[C@H]21 ZINC000261969026 566141621 /nfs/dbraw/zinc/14/16/21/566141621.db2.gz YUBTZPRPTVIWQZ-BPLDGKMQSA-N 2 1 377.286 3.058 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000181459496 566142266 /nfs/dbraw/zinc/14/22/66/566142266.db2.gz IPTWOHIVEQJJFV-RVKKMQEKSA-N 2 1 396.373 3.104 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000181459496 566142270 /nfs/dbraw/zinc/14/22/70/566142270.db2.gz IPTWOHIVEQJJFV-RVKKMQEKSA-N 2 1 396.373 3.104 20 0 GGADMP C[C@H]1C[C@@H](C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC[NH2+]1 ZINC000262327470 566150922 /nfs/dbraw/zinc/15/09/22/566150922.db2.gz DLSUTZRBXVZBIQ-ZFWWWQNUSA-N 2 1 384.351 3.462 20 0 GGADMP C[NH2+]CCC(=O)N1CC[NH+](Cc2ccc(-c3ccccc3Cl)s2)CC1 ZINC000262385093 566151815 /nfs/dbraw/zinc/15/18/15/566151815.db2.gz NMSSERDOCPQQHX-UHFFFAOYSA-N 2 1 377.941 3.322 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(Br)nc1 ZINC000290592332 566180632 /nfs/dbraw/zinc/18/06/32/566180632.db2.gz GOGZAKTXQUNQLF-KSSFIOAISA-N 2 1 390.325 3.262 20 0 GGADMP C[NH2+]C[C@@H](C)CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000417999716 566187239 /nfs/dbraw/zinc/18/72/39/566187239.db2.gz VHLKKOOEPMUSOF-CYBMUJFWSA-N 2 1 387.355 3.113 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+]Cc1c(Br)cncc1Br ZINC000290801573 566189898 /nfs/dbraw/zinc/18/98/98/566189898.db2.gz FFILZJIXZXVMFC-UHFFFAOYSA-N 2 1 388.107 3.291 20 0 GGADMP CN(CC[N@@H+](C)CCCc1ccccc1Br)C1CC[NH+](C)CC1 ZINC000182272666 566194416 /nfs/dbraw/zinc/19/44/16/566194416.db2.gz HCIZFXXKZVRIQW-UHFFFAOYSA-N 2 1 382.390 3.340 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1ccc(Br)c2cccnc12 ZINC000182290782 566195093 /nfs/dbraw/zinc/19/50/93/566195093.db2.gz MFQBOHNWABSZSV-UHFFFAOYSA-N 2 1 391.357 3.067 20 0 GGADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccc(F)cc2I)C1 ZINC000418090118 566197855 /nfs/dbraw/zinc/19/78/55/566197855.db2.gz NEBCBSBJDOKPPH-GFCCVEGCSA-N 2 1 376.257 3.252 20 0 GGADMP CCC[N@@H+](C)[C@@H](CNC(=O)N[C@H](CC[NH3+])C(F)F)c1ccc(Cl)cc1 ZINC000418186112 566202451 /nfs/dbraw/zinc/20/24/51/566202451.db2.gz RNYMVCJLOFQEMX-CABCVRRESA-N 2 1 376.879 3.005 20 0 GGADMP CCC[N@@H+](C)[C@H](CNC(=O)N[C@H](CC[NH3+])C(F)F)c1ccc(Cl)cc1 ZINC000418186120 566202881 /nfs/dbraw/zinc/20/28/81/566202881.db2.gz RNYMVCJLOFQEMX-HUUCEWRRSA-N 2 1 376.879 3.005 20 0 GGADMP CN(CC(=O)Nc1ccc(Br)cc1F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000367601119 566208312 /nfs/dbraw/zinc/20/83/12/566208312.db2.gz DMLOAAHOMBMKAG-PBWFPOADSA-N 2 1 384.293 3.084 20 0 GGADMP CC[C@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481914941 566262516 /nfs/dbraw/zinc/26/25/16/566262516.db2.gz CAIIGUVZBZNFOO-YOEHRIQHSA-N 2 1 387.977 3.021 20 0 GGADMP CC[C@H]([NH2+]CCC[N@H+](C)C(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481916842 566262779 /nfs/dbraw/zinc/26/27/79/566262779.db2.gz XWOMGQPABHGLAY-INIZCTEOSA-N 2 1 375.966 3.019 20 0 GGADMP CC[C@H]([NH2+]CCC[N@@H+](C)C(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481916842 566262785 /nfs/dbraw/zinc/26/27/85/566262785.db2.gz XWOMGQPABHGLAY-INIZCTEOSA-N 2 1 375.966 3.019 20 0 GGADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)C1 ZINC000481928897 566265068 /nfs/dbraw/zinc/26/50/68/566265068.db2.gz SVVUHEJQUVRBBQ-YOEHRIQHSA-N 2 1 387.977 3.021 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)C1 ZINC000481928897 566265070 /nfs/dbraw/zinc/26/50/70/566265070.db2.gz SVVUHEJQUVRBBQ-YOEHRIQHSA-N 2 1 387.977 3.021 20 0 GGADMP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000420362926 566273247 /nfs/dbraw/zinc/27/32/47/566273247.db2.gz NIANRXNKFYPBAW-INIZCTEOSA-N 2 1 375.314 3.384 20 0 GGADMP CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@H](n2cc(C[NH3+])nn2)C1 ZINC000420387716 566275980 /nfs/dbraw/zinc/27/59/80/566275980.db2.gz WFUVLPSVSPPDHJ-IRXDYDNUSA-N 2 1 378.318 3.288 20 0 GGADMP CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@@H](n2cc(C[NH3+])nn2)C1 ZINC000420387718 566276972 /nfs/dbraw/zinc/27/69/72/566276972.db2.gz WFUVLPSVSPPDHJ-SJORKVTESA-N 2 1 378.318 3.288 20 0 GGADMP C[C@H]1CC[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H]1C[NH3+] ZINC000420410160 566277938 /nfs/dbraw/zinc/27/79/38/566277938.db2.gz RDFCDMHTNSBEJW-DZGCQCFKSA-N 2 1 375.314 3.323 20 0 GGADMP C[C@H]1CC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H]1C[NH3+] ZINC000420410160 566277945 /nfs/dbraw/zinc/27/79/45/566277945.db2.gz RDFCDMHTNSBEJW-DZGCQCFKSA-N 2 1 375.314 3.323 20 0 GGADMP C[C@@H]1CC[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H]1C[NH3+] ZINC000420410162 566278387 /nfs/dbraw/zinc/27/83/87/566278387.db2.gz RDFCDMHTNSBEJW-UKRRQHHQSA-N 2 1 375.314 3.323 20 0 GGADMP C[C@@H]1CC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H]1C[NH3+] ZINC000420410162 566278390 /nfs/dbraw/zinc/27/83/90/566278390.db2.gz RDFCDMHTNSBEJW-UKRRQHHQSA-N 2 1 375.314 3.323 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCCOc2ccc(I)cc21 ZINC000482118059 566285405 /nfs/dbraw/zinc/28/54/05/566285405.db2.gz BZOYZDGVHMLLAJ-HNNXBMFYSA-N 2 1 397.260 3.300 20 0 GGADMP O=C1Nc2ccc(Br)cc2CC[C@@H]1[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000625216573 566290545 /nfs/dbraw/zinc/29/05/45/566290545.db2.gz QWNFITCKFJLJAX-INIZCTEOSA-N 2 1 389.297 3.305 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@H]3CCc4cc(Br)ccc4NC3=O)CC[C@H]21 ZINC000625221493 566290791 /nfs/dbraw/zinc/29/07/91/566290791.db2.gz AYIXLZJVFAAOGN-OLMNPRSZSA-N 2 1 392.341 3.119 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CCc2cc(Br)ccc2NC1=O ZINC000625262791 566299793 /nfs/dbraw/zinc/29/97/93/566299793.db2.gz GNPLOLDKNAVVJC-QGZVFWFLSA-N 2 1 391.313 3.229 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CCc2cc(Br)ccc2NC1=O ZINC000625262791 566299800 /nfs/dbraw/zinc/29/98/00/566299800.db2.gz GNPLOLDKNAVVJC-QGZVFWFLSA-N 2 1 391.313 3.229 20 0 GGADMP O=C(NCC[NH2+]C1CC1)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000669471801 566305686 /nfs/dbraw/zinc/30/56/86/566305686.db2.gz ABZCKTATBAAEIU-UHFFFAOYSA-N 2 1 385.339 3.009 20 0 GGADMP CC[NH2+]CCCNC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000669471827 566306195 /nfs/dbraw/zinc/30/61/95/566306195.db2.gz MRLNMHMQSWWNQR-UHFFFAOYSA-N 2 1 387.355 3.257 20 0 GGADMP C[N@H+]1CC[C@@](O)(CNCc2ccc(-c3ccccc3Br)cc2)C1 ZINC000509472399 566308630 /nfs/dbraw/zinc/30/86/30/566308630.db2.gz RLOOKAPCHTVZMI-LJQANCHMSA-N 2 1 375.310 3.272 20 0 GGADMP CN1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000509472399 566308635 /nfs/dbraw/zinc/30/86/35/566308635.db2.gz RLOOKAPCHTVZMI-LJQANCHMSA-N 2 1 375.310 3.272 20 0 GGADMP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000509472399 566308641 /nfs/dbraw/zinc/30/86/41/566308641.db2.gz RLOOKAPCHTVZMI-LJQANCHMSA-N 2 1 375.310 3.272 20 0 GGADMP C[N@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000509472399 566308647 /nfs/dbraw/zinc/30/86/47/566308647.db2.gz RLOOKAPCHTVZMI-LJQANCHMSA-N 2 1 375.310 3.272 20 0 GGADMP O=C(NCC[NH2+]C1CC1)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000669556592 566310866 /nfs/dbraw/zinc/31/08/66/566310866.db2.gz KIKMWXKECJOTBB-UHFFFAOYSA-N 2 1 385.339 3.009 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)c(Br)c1 ZINC000669618844 566315074 /nfs/dbraw/zinc/31/50/74/566315074.db2.gz GGJAHGDULJNUMY-AWEZNQCLSA-N 2 1 384.362 3.134 20 0 GGADMP CN(C(=O)Cc1cc(Cl)cc(Cl)c1)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000625502044 566330692 /nfs/dbraw/zinc/33/06/92/566330692.db2.gz MKWMUVBCPVPAHW-GOSISDBHSA-N 2 1 384.351 3.163 20 0 GGADMP CN(C(=O)Cc1cc(Cl)cc(Cl)c1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000625502044 566330698 /nfs/dbraw/zinc/33/06/98/566330698.db2.gz MKWMUVBCPVPAHW-GOSISDBHSA-N 2 1 384.351 3.163 20 0 GGADMP Cc1ccc(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)c(Br)c1 ZINC000535847757 566332092 /nfs/dbraw/zinc/33/20/92/566332092.db2.gz ICHVLTCZIOZGNP-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCSCCOc1cccc(Br)c1 ZINC000482897386 566341039 /nfs/dbraw/zinc/34/10/39/566341039.db2.gz ZGEXFCJLSJTZQM-WMLDXEAASA-N 2 1 387.387 3.491 20 0 GGADMP Cc1[nH+]c2ccc(Br)cc2c(NCCC[NH+]2CCOCC2)c1C ZINC000462751989 566349893 /nfs/dbraw/zinc/34/98/93/566349893.db2.gz DWQWVKAPBCGHNR-UHFFFAOYSA-N 2 1 378.314 3.170 20 0 GGADMP Cc1[nH+]c2ccc(Br)cc2c(N(C)CC[NH+]2CCOCC2)c1C ZINC000462811169 566354796 /nfs/dbraw/zinc/35/47/96/566354796.db2.gz JGHRWOLFBWSWPR-UHFFFAOYSA-N 2 1 378.314 3.383 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@@H]2CCCc3ccc(Br)cc32)CC1 ZINC000536157084 566354857 /nfs/dbraw/zinc/35/48/57/566354857.db2.gz CODTVCSRUREDRY-LJQANCHMSA-N 2 1 380.374 3.444 20 0 GGADMP [NH3+][C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(Cl)c1 ZINC000649308829 566361412 /nfs/dbraw/zinc/36/14/12/566361412.db2.gz AIWWITGAYVXVAP-KDOFPFPSSA-N 2 1 377.941 3.430 20 0 GGADMP C[C@H]1CC[NH2+][C@H](C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000649330290 566361806 /nfs/dbraw/zinc/36/18/06/566361806.db2.gz NLZXPYHHZVXVGG-UGSOOPFHSA-N 2 1 384.351 3.462 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C[C@H]1C)c1ccc(Br)cc1OCCCO ZINC000462964459 566370595 /nfs/dbraw/zinc/37/05/95/566370595.db2.gz MVDIFZNUPOPWDG-JKIFEVAISA-N 2 1 385.346 3.201 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C)c1ccc(Br)cc1OCCCO ZINC000462964459 566370603 /nfs/dbraw/zinc/37/06/03/566370603.db2.gz MVDIFZNUPOPWDG-JKIFEVAISA-N 2 1 385.346 3.201 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462964458 566371656 /nfs/dbraw/zinc/37/16/56/566371656.db2.gz MVDIFZNUPOPWDG-GRDNDAEWSA-N 2 1 385.346 3.201 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462964458 566371661 /nfs/dbraw/zinc/37/16/61/566371661.db2.gz MVDIFZNUPOPWDG-GRDNDAEWSA-N 2 1 385.346 3.201 20 0 GGADMP C[NH+](C)Cc1ccsc1C(=O)NCC1([NH+]2CCSCC2)CCCCC1 ZINC000446915559 566371884 /nfs/dbraw/zinc/37/18/84/566371884.db2.gz FHAKCYUMXUUWET-UHFFFAOYSA-N 2 1 381.611 3.291 20 0 GGADMP C[C@@H](CC[NH+](C)C)[NH2+]Cc1cc(Br)cc(Br)c1N ZINC000463301114 566399861 /nfs/dbraw/zinc/39/98/61/566399861.db2.gz OAWYMDYOFAAGFX-VIFPVBQESA-N 2 1 379.140 3.224 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(Br)cc1OCCCO ZINC000463362242 566403352 /nfs/dbraw/zinc/40/33/52/566403352.db2.gz SXWMORJHLUSIHT-AWEZNQCLSA-N 2 1 396.329 3.456 20 0 GGADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(Br)cc1OCCCO ZINC000463373896 566405789 /nfs/dbraw/zinc/40/57/89/566405789.db2.gz YWOQJMKNNXRBPM-GOEBONIOSA-N 2 1 385.346 3.345 20 0 GGADMP C[C@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Br)cc1OCCCO ZINC000463373896 566405794 /nfs/dbraw/zinc/40/57/94/566405794.db2.gz YWOQJMKNNXRBPM-GOEBONIOSA-N 2 1 385.346 3.345 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)CCc2cccc(Br)c2)CC1 ZINC000463415332 566408951 /nfs/dbraw/zinc/40/89/51/566408951.db2.gz PWSHTNCLUMMAEK-UHFFFAOYSA-N 2 1 382.390 3.340 20 0 GGADMP COc1c(Br)cc(C[NH2+]C2CC[NH2+]CC2)cc1Br ZINC000577161797 566411087 /nfs/dbraw/zinc/41/10/87/566411087.db2.gz XMRDYYDMQLTBHF-UHFFFAOYSA-N 2 1 378.108 3.062 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000447571060 566417532 /nfs/dbraw/zinc/41/75/32/566417532.db2.gz WWBKRSSQDAUZNW-QWQRMKEZSA-N 2 1 377.330 3.453 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000447571060 566417538 /nfs/dbraw/zinc/41/75/38/566417538.db2.gz WWBKRSSQDAUZNW-QWQRMKEZSA-N 2 1 377.330 3.453 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H](C)[C@H](OC)c2ccc(Br)cc2)CC1 ZINC000537014784 566418029 /nfs/dbraw/zinc/41/80/29/566418029.db2.gz ZWUWZEMGXFWTKQ-KDOFPFPSSA-N 2 1 385.346 3.226 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H](C)[C@@H](OC)c2ccc(Br)cc2)CC1 ZINC000537014783 566418333 /nfs/dbraw/zinc/41/83/33/566418333.db2.gz ZWUWZEMGXFWTKQ-KBXCAEBGSA-N 2 1 385.346 3.226 20 0 GGADMP COC(=O)CC[N@H+](CCn1cc[nH+]c1C)Cc1cccc(Br)c1 ZINC000484301470 566424442 /nfs/dbraw/zinc/42/44/42/566424442.db2.gz VEYNKGLZRJQQGT-UHFFFAOYSA-N 2 1 380.286 3.019 20 0 GGADMP COC(=O)CC[N@@H+](CCn1cc[nH+]c1C)Cc1cccc(Br)c1 ZINC000484301470 566424445 /nfs/dbraw/zinc/42/44/45/566424445.db2.gz VEYNKGLZRJQQGT-UHFFFAOYSA-N 2 1 380.286 3.019 20 0 GGADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)[C@@H](C)C1 ZINC000557827122 566425622 /nfs/dbraw/zinc/42/56/22/566425622.db2.gz JCQILMZKKWLSBT-KSSFIOAISA-N 2 1 377.330 3.455 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)[C@@H](C)C1 ZINC000557827122 566425625 /nfs/dbraw/zinc/42/56/25/566425625.db2.gz JCQILMZKKWLSBT-KSSFIOAISA-N 2 1 377.330 3.455 20 0 GGADMP C[C@H]1C[C@H]([NH2+]CCn2cc(Br)cn2)CC[N@@H+]1Cc1ccccc1 ZINC000671769588 566449280 /nfs/dbraw/zinc/44/92/80/566449280.db2.gz JRIVIIWNRTVOJB-MAUKXSAKSA-N 2 1 377.330 3.288 20 0 GGADMP C[C@H]1C[C@H]([NH2+]CCn2cc(Br)cn2)CC[N@H+]1Cc1ccccc1 ZINC000671769588 566449287 /nfs/dbraw/zinc/44/92/87/566449287.db2.gz JRIVIIWNRTVOJB-MAUKXSAKSA-N 2 1 377.330 3.288 20 0 GGADMP Fc1cc(Br)ccc1CCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1 ZINC000484778319 566453676 /nfs/dbraw/zinc/45/36/76/566453676.db2.gz SPEPBORSYFPBGH-CGTJXYLNSA-N 2 1 385.321 3.268 20 0 GGADMP C[C@@H]1C[C@H](C)[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)C[C@@H]1C[NH3+] ZINC000422637618 566459217 /nfs/dbraw/zinc/45/92/17/566459217.db2.gz PCNQSYUNNQDVLS-AGIUHOORSA-N 2 1 386.309 3.222 20 0 GGADMP C[C@@H]([NH3+])C[C@@H](C)NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000577749115 566460920 /nfs/dbraw/zinc/46/09/20/566460920.db2.gz MIGCLODPDQEVPV-CHWSQXEVSA-N 2 1 387.355 3.383 20 0 GGADMP Brc1ccc2nc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)cn2c1 ZINC000422732564 566463327 /nfs/dbraw/zinc/46/33/27/566463327.db2.gz PBYOVHZFRRXVEY-BRWVUGGUSA-N 2 1 377.330 3.497 20 0 GGADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H](CO)Cc2ccccc2Br)c2ccccc21 ZINC000423076698 566473265 /nfs/dbraw/zinc/47/32/65/566473265.db2.gz RSQDQOZGUUZQJG-MJXNMMHHSA-N 2 1 375.310 3.335 20 0 GGADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H](CO)Cc2ccccc2Br)c2ccccc21 ZINC000423076697 566473727 /nfs/dbraw/zinc/47/37/27/566473727.db2.gz RSQDQOZGUUZQJG-BKTGTZMESA-N 2 1 375.310 3.335 20 0 GGADMP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(Cl)cc1I ZINC000423090758 566474908 /nfs/dbraw/zinc/47/49/08/566474908.db2.gz WBMAZWLCYDZGJA-IINYFYTJSA-N 2 1 378.685 3.422 20 0 GGADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H](CO)Cc2cc(Br)ccc2F)c2ccccc21 ZINC000423161436 566480057 /nfs/dbraw/zinc/48/00/57/566480057.db2.gz NVGMPOPIYLOZMF-RQUSPXKASA-N 2 1 393.300 3.474 20 0 GGADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H](CO)Cc2cc(F)cc(Br)c2)c2ccccc21 ZINC000423173731 566480973 /nfs/dbraw/zinc/48/09/73/566480973.db2.gz ZVITZDPRAXYEEU-BKTGTZMESA-N 2 1 393.300 3.474 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)CCCO2 ZINC000423365756 566485671 /nfs/dbraw/zinc/48/56/71/566485671.db2.gz PQJVXGJFNGXIBF-UKRRQHHQSA-N 2 1 386.277 3.237 20 0 GGADMP Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)nnn1-c1cccc(Br)c1 ZINC000423364461 566486230 /nfs/dbraw/zinc/48/62/30/566486230.db2.gz ASOURXOOYWSFHO-NILFDRSVSA-N 2 1 378.318 3.259 20 0 GGADMP Brc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423490604 566491226 /nfs/dbraw/zinc/49/12/26/566491226.db2.gz IGMYFKVWLXMFEN-DYVFJYSZSA-N 2 1 378.314 3.276 20 0 GGADMP C[C@H]1CC[NH2+][C@@H](C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000423815391 566494478 /nfs/dbraw/zinc/49/44/78/566494478.db2.gz WGQNLUVFUUKXHU-SCLBCKFNSA-N 2 1 384.351 3.462 20 0 GGADMP C[C@@H]1CC[NH2+][C@H](C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000423815389 566494932 /nfs/dbraw/zinc/49/49/32/566494932.db2.gz WGQNLUVFUUKXHU-ACJLOTCBSA-N 2 1 384.351 3.462 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ncc(I)s1 ZINC000512144341 566516937 /nfs/dbraw/zinc/51/69/37/566516937.db2.gz JVLBUADYOQZFKL-LBPRGKRZSA-N 2 1 393.338 3.492 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c(Br)c1 ZINC000424285604 566524832 /nfs/dbraw/zinc/52/48/32/566524832.db2.gz GCAZXBOJAKYYMV-AWEZNQCLSA-N 2 1 380.330 3.160 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c(Br)c1 ZINC000424285604 566524838 /nfs/dbraw/zinc/52/48/38/566524838.db2.gz GCAZXBOJAKYYMV-AWEZNQCLSA-N 2 1 380.330 3.160 20 0 GGADMP C[C@H]1CC2(C[N@H+]1CCC(=O)Nc1ccccc1Br)CC[NH2+]CC2 ZINC000424283137 566524971 /nfs/dbraw/zinc/52/49/71/566524971.db2.gz AVIQPQDZNNHFKL-AWEZNQCLSA-N 2 1 380.330 3.242 20 0 GGADMP C[C@H]1CC2(C[N@H+]1CCC(=O)Nc1cccc(Br)c1)CC[NH2+]CC2 ZINC000424288668 566525272 /nfs/dbraw/zinc/52/52/72/566525272.db2.gz KXHKWWXWZMWTTH-AWEZNQCLSA-N 2 1 380.330 3.242 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1CCC(=O)Nc1ccc(Br)cc1F)CC[NH2+]CC2 ZINC000424289079 566525464 /nfs/dbraw/zinc/52/54/64/566525464.db2.gz LKFYUTKAUJWKOL-CYBMUJFWSA-N 2 1 398.320 3.381 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1CCC(=O)Nc1ccc(Br)cc1)CC[NH2+]CC2 ZINC000424288030 566525500 /nfs/dbraw/zinc/52/55/00/566525500.db2.gz JSBMAGMPENMIMF-CQSZACIVSA-N 2 1 380.330 3.242 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2)c1ccc(Br)cc1 ZINC000424301175 566526671 /nfs/dbraw/zinc/52/66/71/566526671.db2.gz XJKIJVBDXNFNSP-GJZGRUSLSA-N 2 1 394.357 3.090 20 0 GGADMP Cc1cc(NC(=O)C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)ccc1Br ZINC000424292923 566527176 /nfs/dbraw/zinc/52/71/76/566527176.db2.gz OVJFQJWVOHHPMP-CQSZACIVSA-N 2 1 380.330 3.160 20 0 GGADMP Cc1ccc(C[N@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)cc1Br ZINC000538721294 566529712 /nfs/dbraw/zinc/52/97/12/566529712.db2.gz AGFYDOSISIYKAY-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP Cc1ccc(C[N@@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)cc1Br ZINC000538721294 566529717 /nfs/dbraw/zinc/52/97/17/566529717.db2.gz AGFYDOSISIYKAY-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1Cc1cc(Br)c3c(c1)OCCO3)CC[NH2+]CC2 ZINC000424368969 566530177 /nfs/dbraw/zinc/53/01/77/566530177.db2.gz AZBJIAANYPTJBF-CYBMUJFWSA-N 2 1 381.314 3.184 20 0 GGADMP Cc1cc(C[NH+]2CCC(n3ncc4c3C[NH2+]C4)CC2)sc1Br ZINC000424372403 566530362 /nfs/dbraw/zinc/53/03/62/566530362.db2.gz FNQLNFHXNKSJKW-UHFFFAOYSA-N 2 1 381.343 3.456 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]Cc1ccnc2c(Br)cccc12 ZINC000449151909 566533826 /nfs/dbraw/zinc/53/38/26/566533826.db2.gz YXPFKOXUTHXHIB-MRXNPFEDSA-N 2 1 392.341 3.324 20 0 GGADMP Cc1cc(Br)ccc1C[N@H+]1CC[C@@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000538763913 566533969 /nfs/dbraw/zinc/53/39/69/566533969.db2.gz BWAXWEFDUVFZQP-LJQANCHMSA-N 2 1 380.374 3.358 20 0 GGADMP Cc1cc(Br)ccc1C[N@@H+]1CC[C@@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000538763913 566533978 /nfs/dbraw/zinc/53/39/78/566533978.db2.gz BWAXWEFDUVFZQP-LJQANCHMSA-N 2 1 380.374 3.358 20 0 GGADMP Brc1cccc2c1CCC[C@H]2[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1 ZINC000578618603 566538649 /nfs/dbraw/zinc/53/86/49/566538649.db2.gz IRRUZPDHXHLOQY-MRXNPFEDSA-N 2 1 390.329 3.201 20 0 GGADMP O[C@@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(F)cc(Br)c2)C1 ZINC000449233890 566539413 /nfs/dbraw/zinc/53/94/13/566539413.db2.gz NVAOJQLHWXTSJH-LJQANCHMSA-N 2 1 393.300 3.445 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](Cc2cc(Br)cc3cccnc32)CC12CCOCC2 ZINC000578632275 566540126 /nfs/dbraw/zinc/54/01/26/566540126.db2.gz PWIBWSDKGJHWDH-INIZCTEOSA-N 2 1 390.325 3.185 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](Cc2cc(Br)cc3cccnc32)CC12CCOCC2 ZINC000578632276 566540518 /nfs/dbraw/zinc/54/05/18/566540518.db2.gz PWIBWSDKGJHWDH-MRXNPFEDSA-N 2 1 390.325 3.185 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cccc(F)c3Br)CC2)CC1 ZINC000449238115 566540666 /nfs/dbraw/zinc/54/06/66/566540666.db2.gz QEOGMFOWDJHVJN-UHFFFAOYSA-N 2 1 398.364 3.438 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cccc(Br)c3F)CC2)CC1 ZINC000449238086 566541064 /nfs/dbraw/zinc/54/10/64/566541064.db2.gz PYVYOTPSFRLQCW-UHFFFAOYSA-N 2 1 398.364 3.438 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cc(C)c(Br)cn1 ZINC000628278593 566542603 /nfs/dbraw/zinc/54/26/03/566542603.db2.gz XUEXCAXGIQCYNP-KRWDZBQOSA-N 2 1 383.378 3.000 20 0 GGADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCn2cc(Br)ccc2=O)CC1 ZINC000449379565 566554909 /nfs/dbraw/zinc/55/49/09/566554909.db2.gz TXFZBKHECUQYQW-QAPCUYQASA-N 2 1 396.373 3.244 20 0 GGADMP Cc1sc(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)cc1Br ZINC000578881034 566561938 /nfs/dbraw/zinc/56/19/38/566561938.db2.gz OIWMPTPHTUSAJZ-UHFFFAOYSA-N 2 1 395.326 3.218 20 0 GGADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856285 566562294 /nfs/dbraw/zinc/56/22/94/566562294.db2.gz NEGRZQFQUDPSSN-JKSUJKDBSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856285 566562299 /nfs/dbraw/zinc/56/22/99/566562299.db2.gz NEGRZQFQUDPSSN-JKSUJKDBSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856285 566562306 /nfs/dbraw/zinc/56/23/06/566562306.db2.gz NEGRZQFQUDPSSN-JKSUJKDBSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856285 566562312 /nfs/dbraw/zinc/56/23/12/566562312.db2.gz NEGRZQFQUDPSSN-JKSUJKDBSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CCC(CS(C)(=O)=O)CC2)[C@H]1c1cccs1 ZINC000559767389 566569604 /nfs/dbraw/zinc/56/96/04/566569604.db2.gz SJVQJZPOSISOJW-AFNJWWOFSA-N 2 1 384.611 3.324 20 0 GGADMP C[N@H+]1CCC[C@H](C[NH2+]C2CCC(CS(C)(=O)=O)CC2)[C@H]1c1cccs1 ZINC000559767389 566569611 /nfs/dbraw/zinc/56/96/11/566569611.db2.gz SJVQJZPOSISOJW-AFNJWWOFSA-N 2 1 384.611 3.324 20 0 GGADMP C[C@H]1C[N@H+](C)C[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486233025 566571290 /nfs/dbraw/zinc/57/12/90/566571290.db2.gz UZFLNFMTCBEBGV-XJKSGUPXSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@H]1C[N@@H+](C)C[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486233025 566571294 /nfs/dbraw/zinc/57/12/94/566571294.db2.gz UZFLNFMTCBEBGV-XJKSGUPXSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@H]1C[N@H+](C)C[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486233022 566571866 /nfs/dbraw/zinc/57/18/66/566571866.db2.gz UZFLNFMTCBEBGV-BBRMVZONSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486233022 566571874 /nfs/dbraw/zinc/57/18/74/566571874.db2.gz UZFLNFMTCBEBGV-BBRMVZONSA-N 2 1 384.351 3.272 20 0 GGADMP Brc1ccc2[nH+]ccc(N3CC[NH+](C[C@H]4CCCO4)CC3)c2c1 ZINC000674062529 566575491 /nfs/dbraw/zinc/57/54/91/566575491.db2.gz RIHAZIVITGNMGY-OAHLLOKOSA-N 2 1 376.298 3.298 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2cc(Br)ccc2F)[C@H](C)C1 ZINC000449596718 566578740 /nfs/dbraw/zinc/57/87/40/566578740.db2.gz CFXMEQNLNMKVNM-GLJUWKHASA-N 2 1 387.337 3.059 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2cc(Br)ccc2F)[C@@H](C)C1 ZINC000449596717 566579074 /nfs/dbraw/zinc/57/90/74/566579074.db2.gz CFXMEQNLNMKVNM-DEYYWGMASA-N 2 1 387.337 3.059 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2ccc(C)c(Br)c2)[C@@H](C)C1 ZINC000449599169 566580324 /nfs/dbraw/zinc/58/03/24/566580324.db2.gz KDBPTNQEQPNNID-IEZWGBDMSA-N 2 1 383.374 3.228 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1Br ZINC000449599467 566580753 /nfs/dbraw/zinc/58/07/53/566580753.db2.gz LASMTYSNJYIACB-OKZBNKHCSA-N 2 1 381.358 3.125 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2ccc(C)c(Br)c2)[C@H](C)C1 ZINC000449599168 566580856 /nfs/dbraw/zinc/58/08/56/566580856.db2.gz KDBPTNQEQPNNID-AYBZRNKSSA-N 2 1 383.374 3.228 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+]Cc1c[nH+]ccc1N(C)C ZINC000449681517 566591295 /nfs/dbraw/zinc/59/12/95/566591295.db2.gz JJWYGSCOJHDDER-HNNXBMFYSA-N 2 1 392.341 3.159 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2cccc(Br)c2C)[C@@H](C)C1 ZINC000449686744 566592747 /nfs/dbraw/zinc/59/27/47/566592747.db2.gz XZXVMODQRFUWTL-QOKNQOGYSA-N 2 1 383.374 3.228 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](CCOc3ccccc3Br)C2)C1 ZINC000652349175 566602755 /nfs/dbraw/zinc/60/27/55/566602755.db2.gz DUILNJOYBQQDST-IIDMSEBBSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](CC(=O)Nc3cccc(Cl)c3Cl)C2)C1 ZINC000652345755 566603006 /nfs/dbraw/zinc/60/30/06/566603006.db2.gz LCURQVWBZDVJMU-WOSRLPQWSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](CC(=O)Nc3cccc(Cl)c3Cl)C2)C1 ZINC000652345755 566603011 /nfs/dbraw/zinc/60/30/11/566603011.db2.gz LCURQVWBZDVJMU-WOSRLPQWSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](CCOc3ccc(Br)cc3)C2)C1 ZINC000652345981 566603774 /nfs/dbraw/zinc/60/37/74/566603774.db2.gz QKMNAKALSVENQR-LESCRADOSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](CC(=O)Nc3cc(Cl)ccc3Cl)C2)C1 ZINC000652346156 566603876 /nfs/dbraw/zinc/60/38/76/566603876.db2.gz UYOJLRQIGSEZRG-DXCKQFNASA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](CC(=O)Nc3cc(Cl)ccc3Cl)C2)C1 ZINC000652346156 566603878 /nfs/dbraw/zinc/60/38/78/566603878.db2.gz UYOJLRQIGSEZRG-DXCKQFNASA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3cc(Br)cc(F)c3F)C2)C1 ZINC000652350225 566605484 /nfs/dbraw/zinc/60/54/84/566605484.db2.gz MSBRBHUXOUWASD-SGIREYDYSA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](Cc3cc(Br)cc(F)c3F)C2)C1 ZINC000652350225 566605489 /nfs/dbraw/zinc/60/54/89/566605489.db2.gz MSBRBHUXOUWASD-SGIREYDYSA-N 2 1 389.284 3.446 20 0 GGADMP C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)[C@@H]1CC[NH3+] ZINC000652353992 566605683 /nfs/dbraw/zinc/60/56/83/566605683.db2.gz KARKIISMXPDGRG-BLLLJJGKSA-N 2 1 386.309 3.366 20 0 GGADMP Cc1ccc(C[N@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)c(Br)c1 ZINC000539862981 566608041 /nfs/dbraw/zinc/60/80/41/566608041.db2.gz QZKAQXXRFLUOBP-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP Cc1ccc(C[N@@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)c(Br)c1 ZINC000539862981 566608048 /nfs/dbraw/zinc/60/80/48/566608048.db2.gz QZKAQXXRFLUOBP-SFHVURJKSA-N 2 1 380.374 3.358 20 0 GGADMP COc1ccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1Br ZINC000513818764 566627250 /nfs/dbraw/zinc/62/72/50/566627250.db2.gz JTXMWZSASUKEIU-UHFFFAOYSA-N 2 1 397.357 3.392 20 0 GGADMP C[C@@H]1C[N@H+](C)C[C@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487013161 566643693 /nfs/dbraw/zinc/64/36/93/566643693.db2.gz LGBYQCHWTJQERE-FZKQIMNGSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487013161 566643697 /nfs/dbraw/zinc/64/36/97/566643697.db2.gz LGBYQCHWTJQERE-FZKQIMNGSA-N 2 1 384.351 3.272 20 0 GGADMP Clc1cc(Cl)cc(-c2nc(C[N@@H+]3CC[C@H](N4CC[NH2+]CC4)C3)co2)c1 ZINC000629539445 566664459 /nfs/dbraw/zinc/66/44/59/566664459.db2.gz XXFBGQKRNOTWQV-KRWDZBQOSA-N 2 1 381.307 3.128 20 0 GGADMP Clc1cc(Cl)cc(-c2nc(C[N@H+]3CC[C@H](N4CC[NH2+]CC4)C3)co2)c1 ZINC000629539445 566664464 /nfs/dbraw/zinc/66/44/64/566664464.db2.gz XXFBGQKRNOTWQV-KRWDZBQOSA-N 2 1 381.307 3.128 20 0 GGADMP CCSc1ccc(C[N@@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)c(Br)c1 ZINC000629539079 566664473 /nfs/dbraw/zinc/66/44/73/566664473.db2.gz VEJWYSYGYQDKCH-OAHLLOKOSA-N 2 1 384.387 3.041 20 0 GGADMP CCSc1ccc(C[N@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)c(Br)c1 ZINC000629539079 566664479 /nfs/dbraw/zinc/66/44/79/566664479.db2.gz VEJWYSYGYQDKCH-OAHLLOKOSA-N 2 1 384.387 3.041 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCc2cccc(Br)c2C1 ZINC000580087759 566664539 /nfs/dbraw/zinc/66/45/39/566664539.db2.gz ABOUXRJYOMVQSP-IAGOWNOFSA-N 2 1 381.358 3.133 20 0 GGADMP O=C1Nc2ccc(Br)cc2CC[C@@H]1[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000629533131 566664821 /nfs/dbraw/zinc/66/48/21/566664821.db2.gz ITYGZQYMNVTZNB-MPGHIAIKSA-N 2 1 392.341 3.024 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@H]1CCc2cccc(Br)c2C1 ZINC000580087760 566665170 /nfs/dbraw/zinc/66/51/70/566665170.db2.gz ABOUXRJYOMVQSP-IRXDYDNUSA-N 2 1 381.358 3.133 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](CCOc2ccc(Br)cc2)CC[C@@H]1C(F)(F)F ZINC000629568157 566666409 /nfs/dbraw/zinc/66/64/09/566666409.db2.gz RUEBHZDREAMORG-FZMZJTMJSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCOc2ccc(Br)cc2)CC[C@@H]1C(F)(F)F ZINC000629568157 566666410 /nfs/dbraw/zinc/66/64/10/566666410.db2.gz RUEBHZDREAMORG-FZMZJTMJSA-N 2 1 381.236 3.287 20 0 GGADMP CSc1ccccc1NC(=O)CC[N@H+]1CC[C@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629567686 566666466 /nfs/dbraw/zinc/66/64/66/566666466.db2.gz PYXWAAPQTBSQIV-OLZOCXBDSA-N 2 1 375.460 3.196 20 0 GGADMP C[C@H](C(=O)Nc1cccc(Cl)c1Cl)[N@@H+](C)CCCN(C)CC[NH+](C)C ZINC000580121544 566666788 /nfs/dbraw/zinc/66/67/88/566666788.db2.gz QWWZFHYOKHCJQT-CQSZACIVSA-N 2 1 389.371 3.136 20 0 GGADMP COc1c(Br)cc(C[NH2+]C[C@H]([NH3+])C(C)C)cc1Br ZINC000560961409 566667263 /nfs/dbraw/zinc/66/72/63/566667263.db2.gz NBCMZCPGKVNYEI-LBPRGKRZSA-N 2 1 380.124 3.293 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[C@H]1CCCCC[NH2+]1 ZINC000580201311 566672956 /nfs/dbraw/zinc/67/29/56/566672956.db2.gz HKIBXXJCLCVYKB-GOSISDBHSA-N 2 1 394.357 3.062 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)CC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000580259424 566677973 /nfs/dbraw/zinc/67/79/73/566677973.db2.gz HRFLNHYBMMKMKK-UHFFFAOYSA-N 2 1 384.351 3.339 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](C[NH2+]C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000514932703 566680432 /nfs/dbraw/zinc/68/04/32/566680432.db2.gz KNKJBKNUZZYGIO-GOEBONIOSA-N 2 1 375.340 3.301 20 0 GGADMP Brc1cc2c(cc1C[N@H+]1CCC[C@@H]([C@H]3CC[NH2+]C3)C1)OCCO2 ZINC000580312398 566682821 /nfs/dbraw/zinc/68/28/21/566682821.db2.gz MQBRBVCHPRUNOL-UONOGXRCSA-N 2 1 381.314 3.042 20 0 GGADMP Brc1cc2c(cc1C[N@H+]1CCC[C@@H]([C@@H]3CC[NH2+]C3)C1)OCCO2 ZINC000580312399 566683132 /nfs/dbraw/zinc/68/31/32/566683132.db2.gz MQBRBVCHPRUNOL-ZIAGYGMSSA-N 2 1 381.314 3.042 20 0 GGADMP Brc1ccc(-n2cc(C[N@H+]3CCC[C@H]([C@H]4CC[NH2+]C4)C3)cn2)cc1 ZINC000515061149 566689910 /nfs/dbraw/zinc/68/99/10/566689910.db2.gz TXHXVEFOWSQLPO-IRXDYDNUSA-N 2 1 389.341 3.456 20 0 GGADMP C[N@@H+](CC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1)C1CCC1 ZINC000629972157 566695402 /nfs/dbraw/zinc/69/54/02/566695402.db2.gz SUKVRDXTXGFEKP-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP C[N@@H+](CC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)C1CCC1 ZINC000629972157 566695419 /nfs/dbraw/zinc/69/54/19/566695419.db2.gz SUKVRDXTXGFEKP-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP Clc1cccc(-n2cc(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)nn2)c1Cl ZINC000580551150 566704413 /nfs/dbraw/zinc/70/44/13/566704413.db2.gz CBONUTBSFHFYRA-AWEZNQCLSA-N 2 1 380.323 3.396 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@@H]2CCCc3c(Br)cccc32)CC1 ZINC000541223565 566704565 /nfs/dbraw/zinc/70/45/65/566704565.db2.gz MLBJERZTENOTLX-LJQANCHMSA-N 2 1 380.374 3.444 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000580646597 566711548 /nfs/dbraw/zinc/71/15/48/566711548.db2.gz OBAMGVWUEGNACY-HRCADAONSA-N 2 1 394.357 3.406 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000580646597 566711553 /nfs/dbraw/zinc/71/15/53/566711553.db2.gz OBAMGVWUEGNACY-HRCADAONSA-N 2 1 394.357 3.406 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000580646599 566711633 /nfs/dbraw/zinc/71/16/33/566711633.db2.gz OBAMGVWUEGNACY-XHSDSOJGSA-N 2 1 394.357 3.406 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000580646599 566711634 /nfs/dbraw/zinc/71/16/34/566711634.db2.gz OBAMGVWUEGNACY-XHSDSOJGSA-N 2 1 394.357 3.406 20 0 GGADMP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000468619215 566715811 /nfs/dbraw/zinc/71/58/11/566715811.db2.gz LNTVZLOIMFTCKC-IBGZPJMESA-N 2 1 391.309 3.398 20 0 GGADMP C[N@H+]1CC[C@](O)(C[NH2+]Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000468619215 566715817 /nfs/dbraw/zinc/71/58/17/566715817.db2.gz LNTVZLOIMFTCKC-IBGZPJMESA-N 2 1 391.309 3.398 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@@H](C[NH3+])C2(C1)CCOCC2 ZINC000580774759 566721772 /nfs/dbraw/zinc/72/17/72/566721772.db2.gz MALUBYVFERJFKS-CHWSQXEVSA-N 2 1 386.323 3.008 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@@H](C[NH3+])C2(C1)CCOCC2 ZINC000580774759 566721778 /nfs/dbraw/zinc/72/17/78/566721778.db2.gz MALUBYVFERJFKS-CHWSQXEVSA-N 2 1 386.323 3.008 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cc4c(cc3Br)OCCCO4)C[C@H]21 ZINC000515649910 566725694 /nfs/dbraw/zinc/72/56/94/566725694.db2.gz PUSHSEROCNLSEC-JGGQBBKZSA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3cc4c(cc3Br)OCCCO4)C[C@H]21 ZINC000515649910 566725700 /nfs/dbraw/zinc/72/57/00/566725700.db2.gz PUSHSEROCNLSEC-JGGQBBKZSA-N 2 1 381.314 3.170 20 0 GGADMP CCC[N@@H+](C)CC(=O)N(Cc1ccccc1Br)C1CC[NH+](C)CC1 ZINC000426781113 566729531 /nfs/dbraw/zinc/72/95/31/566729531.db2.gz YLUZJTOOGRDELX-UHFFFAOYSA-N 2 1 396.373 3.214 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(F)cc3Br)CC2)CC1 ZINC000541663823 566741609 /nfs/dbraw/zinc/74/16/09/566741609.db2.gz BKRZHBAXDVWKHO-UHFFFAOYSA-N 2 1 398.364 3.438 20 0 GGADMP C[N@H+](C[C@@H](O)C[NH+]1CCC(C)(c2cccc(Br)c2)CC1)C1CC1 ZINC000562037923 566758861 /nfs/dbraw/zinc/75/88/61/566758861.db2.gz CDKLTZUMZSZGNY-GOSISDBHSA-N 2 1 381.358 3.258 20 0 GGADMP C[N@@H+](C[C@@H](O)C[NH+]1CCC(C)(c2cccc(Br)c2)CC1)C1CC1 ZINC000562037923 566758867 /nfs/dbraw/zinc/75/88/67/566758867.db2.gz CDKLTZUMZSZGNY-GOSISDBHSA-N 2 1 381.358 3.258 20 0 GGADMP Brc1cccc(-c2noc(C[N@H+]3CCC[C@H]([C@H]4CC[NH2+]C4)C3)n2)c1 ZINC000516469849 566764043 /nfs/dbraw/zinc/76/40/43/566764043.db2.gz XJNKBPBHYMDECN-GJZGRUSLSA-N 2 1 391.313 3.321 20 0 GGADMP C[N@@H+](Cc1cc(F)cc(Br)c1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000677801616 566764390 /nfs/dbraw/zinc/76/43/90/566764390.db2.gz XOWAZFMFCSJKIY-GOSISDBHSA-N 2 1 384.337 3.189 20 0 GGADMP Clc1ccc(-n2cc(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)nn2)c(Cl)c1 ZINC000516468509 566764921 /nfs/dbraw/zinc/76/49/21/566764921.db2.gz XBUYWEMRFYFWKT-AWEZNQCLSA-N 2 1 380.323 3.396 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C[C@H](O)COc2ccc(Br)cc2)C1 ZINC000581364944 566772075 /nfs/dbraw/zinc/77/20/75/566772075.db2.gz URZJNJLFKXJIGU-WMZOPIPTSA-N 2 1 399.373 3.291 20 0 GGADMP CCC[N@@H+](C)[C@H](CNC(=O)C[NH+](C)[C@@H]1CCSC1)c1ccc(Cl)cc1 ZINC000581445460 566778841 /nfs/dbraw/zinc/77/88/41/566778841.db2.gz BOEXFMNLCYETKJ-QZTJIDSGSA-N 2 1 383.989 3.276 20 0 GGADMP CCC[NH+](C)[C@H](CNC(=O)C[N@H+](C)[C@@H]1CCSC1)c1ccc(Cl)cc1 ZINC000581445460 566778845 /nfs/dbraw/zinc/77/88/45/566778845.db2.gz BOEXFMNLCYETKJ-QZTJIDSGSA-N 2 1 383.989 3.276 20 0 GGADMP CC[C@H](c1ccc(Br)cc1)N1CCC([N@H+]2CCC[C@H]2C(N)=O)CC1 ZINC000678079715 566780388 /nfs/dbraw/zinc/78/03/88/566780388.db2.gz AOULZSZLODITGE-MSOLQXFVSA-N 2 1 394.357 3.314 20 0 GGADMP C[NH+]1CCN(CCCC[NH2+]Cc2cc(Br)c(Cl)s2)CC1 ZINC000562313210 566780623 /nfs/dbraw/zinc/78/06/23/566780623.db2.gz GPTFVLGNYUPXQS-UHFFFAOYSA-N 2 1 380.783 3.281 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cnc2c(C)cc(Br)cn12 ZINC000542248763 566787468 /nfs/dbraw/zinc/78/74/68/566787468.db2.gz WKEZFDZOAGEZHP-LBPRGKRZSA-N 2 1 376.302 3.336 20 0 GGADMP COc1cc(C[N@@H+](C)CC(C)(C)C[NH3+])cc(Br)c1OC(F)F ZINC000469852666 566820647 /nfs/dbraw/zinc/82/06/47/566820647.db2.gz PRWGBRJLNJPZQT-UHFFFAOYSA-N 2 1 381.261 3.476 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000469877936 566823503 /nfs/dbraw/zinc/82/35/03/566823503.db2.gz IOLFPMIRZRHSAL-JCGIZDLHSA-N 2 1 397.357 3.424 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000469877936 566823512 /nfs/dbraw/zinc/82/35/12/566823512.db2.gz IOLFPMIRZRHSAL-JCGIZDLHSA-N 2 1 397.357 3.424 20 0 GGADMP CCOc1cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)cc(Br)c1OC ZINC000469871429 566823901 /nfs/dbraw/zinc/82/39/01/566823901.db2.gz GUHGMOSDSQXNRS-OFQRWUPVSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1cc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)cc(Br)c1OC ZINC000469871429 566823906 /nfs/dbraw/zinc/82/39/06/566823906.db2.gz GUHGMOSDSQXNRS-OFQRWUPVSA-N 2 1 383.330 3.416 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000469874319 566824092 /nfs/dbraw/zinc/82/40/92/566824092.db2.gz QCCLHHDHXVJHSC-VHSSKADRSA-N 2 1 375.314 3.112 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3cnn(-c4ccc(Br)cc4)c3)C[C@@H]21 ZINC000469891054 566824688 /nfs/dbraw/zinc/82/46/88/566824688.db2.gz VAMTURZWSWCTEX-JCGIZDLHSA-N 2 1 375.314 3.194 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[NH+]1CCC(C[NH2+]C)CC1 ZINC000470007470 566837299 /nfs/dbraw/zinc/83/72/99/566837299.db2.gz CZRXOIAWEQAAPG-UHFFFAOYSA-N 2 1 385.346 3.296 20 0 GGADMP Brc1cccc(C2(C[NH2+]C3CC[NH+]([C@H]4CCOC4)CC3)CC2)c1 ZINC000655715823 566838170 /nfs/dbraw/zinc/83/81/70/566838170.db2.gz OMVAYRIBNLANJW-SFHVURJKSA-N 2 1 379.342 3.324 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)Oc1ccc(Br)cc1 ZINC000655718709 566838241 /nfs/dbraw/zinc/83/82/41/566838241.db2.gz QFKNVJZCKHZMPL-BEFAXECRSA-N 2 1 397.357 3.449 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)Oc1ccc(Br)cc1 ZINC000655719330 566838277 /nfs/dbraw/zinc/83/82/77/566838277.db2.gz VDABOICLEJXXQI-RHSMWYFYSA-N 2 1 383.330 3.059 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)Oc1ccccc1Br ZINC000655719344 566838578 /nfs/dbraw/zinc/83/85/78/566838578.db2.gz RPYJEGGCRWHYNW-RDJZCZTQSA-N 2 1 397.357 3.449 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)Oc1ccccc1Br ZINC000655718503 566838781 /nfs/dbraw/zinc/83/87/81/566838781.db2.gz KXEGGVIXDWCRBI-ZBFHGGJFSA-N 2 1 383.330 3.059 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)Oc1cccc(Br)c1 ZINC000655719844 566838932 /nfs/dbraw/zinc/83/89/32/566838932.db2.gz YTIWKQUSYBITFB-DNVCBOLYSA-N 2 1 397.357 3.449 20 0 GGADMP Cc1cc(Br)ccc1C[N@H+](C)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000679218093 566842070 /nfs/dbraw/zinc/84/20/70/566842070.db2.gz JRVOWLUKUGZMOR-LJQANCHMSA-N 2 1 380.374 3.358 20 0 GGADMP Brc1cccc2[nH]cc(CC[NH2+]C3CC[NH+]([C@@H]4CCOC4)CC3)c21 ZINC000655767925 566847384 /nfs/dbraw/zinc/84/73/84/566847384.db2.gz NNTYGZUUQQWBQT-MRXNPFEDSA-N 2 1 392.341 3.316 20 0 GGADMP Clc1cccc(-n2cc(C[N@H+]3CCC[C@H]([C@@H]4CC[NH2+]C4)C3)nn2)c1Cl ZINC000563136286 566857827 /nfs/dbraw/zinc/85/78/27/566857827.db2.gz XEBGOCLXIYUVTO-KGLIPLIRSA-N 2 1 380.323 3.396 20 0 GGADMP O=C1[C@H]([N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)CCN1c1ccc(Cl)cc1Cl ZINC000563155022 566859490 /nfs/dbraw/zinc/85/94/90/566859490.db2.gz XYCKYNRIRKXCLJ-QWQRMKEZSA-N 2 1 382.335 3.420 20 0 GGADMP O=C1[C@H]([NH+]2CCC([C@H]3CC[NH2+]C3)CC2)CCN1c1ccc(Cl)cc1Cl ZINC000563149535 566860145 /nfs/dbraw/zinc/86/01/45/566860145.db2.gz BMKHDYKIKXSEHN-KBXCAEBGSA-N 2 1 382.335 3.420 20 0 GGADMP CC[NH2+]CCCNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000582476283 566865387 /nfs/dbraw/zinc/86/53/87/566865387.db2.gz QSLGCXPKTVIFNL-UHFFFAOYSA-N 2 1 387.355 3.257 20 0 GGADMP C[C@H]1C[N@H+](CCOc2cc(Cl)cc(Cl)c2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000490632674 566873026 /nfs/dbraw/zinc/87/30/26/566873026.db2.gz SXSGUEIPFWJIMG-HNAYVOBHSA-N 2 1 386.367 3.330 20 0 GGADMP C[C@H]1C[N@@H+](CCOc2cc(Cl)cc(Cl)c2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000490632674 566873028 /nfs/dbraw/zinc/87/30/28/566873028.db2.gz SXSGUEIPFWJIMG-HNAYVOBHSA-N 2 1 386.367 3.330 20 0 GGADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cn4ccc(Br)cc4n3)C2)CC1 ZINC000563325271 566876477 /nfs/dbraw/zinc/87/64/77/566876477.db2.gz RAZCQMACEICPIC-HNNXBMFYSA-N 2 1 377.330 3.261 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(F)cc(Br)c3)CC2)CC1 ZINC000543521946 566887341 /nfs/dbraw/zinc/88/73/41/566887341.db2.gz ISBOAETWIQVDOW-UHFFFAOYSA-N 2 1 398.364 3.438 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cncc(Br)c1 ZINC000518566016 566892100 /nfs/dbraw/zinc/89/21/00/566892100.db2.gz WLHJOUAYGYVIDD-IFXJQAMLSA-N 2 1 390.325 3.262 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000470958588 566919054 /nfs/dbraw/zinc/91/90/54/566919054.db2.gz LAQCUGHINVUINY-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000470958588 566919063 /nfs/dbraw/zinc/91/90/63/566919063.db2.gz LAQCUGHINVUINY-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000470958588 566919068 /nfs/dbraw/zinc/91/90/68/566919068.db2.gz LAQCUGHINVUINY-MRXNPFEDSA-N 2 1 394.357 3.441 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+][C@H]2CCCc3c(Br)cccc32)C1 ZINC000544010927 566927776 /nfs/dbraw/zinc/92/77/76/566927776.db2.gz IPPKNNGTCRVDDA-KSSFIOAISA-N 2 1 394.357 3.004 20 0 GGADMP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCc3sc(Br)cc32)CC1 ZINC000583217370 566930937 /nfs/dbraw/zinc/93/09/37/566930937.db2.gz XWJZJHLHEUDLFK-SOUVJXGZSA-N 2 1 385.371 3.465 20 0 GGADMP COc1cc(C[NH2+]CC2([NH3+])CCCC2)cc(Br)c1OC(F)F ZINC000656788486 566950145 /nfs/dbraw/zinc/95/01/45/566950145.db2.gz RMCMYBZPZNUPOC-UHFFFAOYSA-N 2 1 379.245 3.420 20 0 GGADMP COc1cc(Br)c(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)cc1O ZINC000656787048 566950398 /nfs/dbraw/zinc/95/03/98/566950398.db2.gz SDRXUNLRIXINLS-AWEZNQCLSA-N 2 1 383.330 3.375 20 0 GGADMP Cn1ccnc1[C@@H]1CC[N@H+](Cc2cn(-c3cccc(Cl)c3Cl)nn2)C1 ZINC000564318702 566963513 /nfs/dbraw/zinc/96/35/13/566963513.db2.gz FLTFGDKIGPMLEZ-GFCCVEGCSA-N 2 1 377.279 3.297 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000564329426 566965170 /nfs/dbraw/zinc/96/51/70/566965170.db2.gz GRAKBFILXRZJNI-UONOGXRCSA-N 2 1 398.320 3.238 20 0 GGADMP C[C@@]1(NC(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CC[NH2+]C1 ZINC000612905030 567004528 /nfs/dbraw/zinc/00/45/28/567004528.db2.gz ZRKJPXSXDVBOAI-GOSISDBHSA-N 2 1 385.339 3.009 20 0 GGADMP C[C@]1(NC(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CC[NH2+]C1 ZINC000612905031 567004913 /nfs/dbraw/zinc/00/49/13/567004913.db2.gz ZRKJPXSXDVBOAI-SFHVURJKSA-N 2 1 385.339 3.009 20 0 GGADMP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1nnc(C3CC[NH2+]CC3)[nH]1)CC2 ZINC000564840496 567012960 /nfs/dbraw/zinc/01/29/60/567012960.db2.gz IGWDDJKCZKKLKE-OAHLLOKOSA-N 2 1 390.329 3.120 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)[C@@](C)([NH3+])c1ccc(Br)cc1 ZINC000564892500 567018340 /nfs/dbraw/zinc/01/83/40/567018340.db2.gz YZTSKKVWVJCHLL-KSSFIOAISA-N 2 1 382.346 3.004 20 0 GGADMP C[C@@H]([NH3+])CC(=O)N1CC[NH+](Cc2ccc(-c3ccccc3Cl)s2)CC1 ZINC000430701071 567031448 /nfs/dbraw/zinc/03/14/48/567031448.db2.gz CTCJTKSJTKLZIO-CQSZACIVSA-N 2 1 377.941 3.450 20 0 GGADMP Cc1c(Br)cncc1C[NH2+]Cc1ccccc1C[NH+]1CCOCC1 ZINC000657293666 567044674 /nfs/dbraw/zinc/04/46/74/567044674.db2.gz RIRKCGLQBPPHBR-UHFFFAOYSA-N 2 1 390.325 3.275 20 0 GGADMP O=C(C[NH+]1CCC2(CC[NH2+]C2)CC1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000431042808 567049051 /nfs/dbraw/zinc/04/90/51/567049051.db2.gz LNFLPLZBJRXTQN-UHFFFAOYSA-N 2 1 375.822 3.373 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000453064666 567051584 /nfs/dbraw/zinc/05/15/84/567051584.db2.gz GFOBOFYOIHFYSX-IBGZPJMESA-N 2 1 381.358 3.471 20 0 GGADMP CCC[N@@H+](CCC(=O)Nc1ccc(Br)cc1F)C1CC[NH2+]CC1 ZINC000431075460 567052241 /nfs/dbraw/zinc/05/22/41/567052241.db2.gz FBZKKUKZGAEDOR-UHFFFAOYSA-N 2 1 386.309 3.381 20 0 GGADMP COC(=O)c1ccc(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c(Br)c1 ZINC000584557295 567053975 /nfs/dbraw/zinc/05/39/75/567053975.db2.gz RRPRSURLZVQTMY-INIZCTEOSA-N 2 1 395.341 3.399 20 0 GGADMP C[NH+](C)C1(C[NH2+][C@H](Cc2ccccc2Br)C2CC2)CCOCC1 ZINC000453129206 567056365 /nfs/dbraw/zinc/05/63/65/567056365.db2.gz VIIJDEXZPWDFPU-GOSISDBHSA-N 2 1 381.358 3.471 20 0 GGADMP C[NH+](C)C1(C[NH2+][C@@H](Cc2ccccc2Br)C2CC2)CCOCC1 ZINC000453129208 567056695 /nfs/dbraw/zinc/05/66/95/567056695.db2.gz VIIJDEXZPWDFPU-SFHVURJKSA-N 2 1 381.358 3.471 20 0 GGADMP Cc1ncc(CN[C@@H](C)c2ccc(Br)cc2OCCCO)n1C ZINC000657472274 567059999 /nfs/dbraw/zinc/05/99/99/567059999.db2.gz LGNTYUPRTHGSCE-LBPRGKRZSA-N 2 1 382.302 3.103 20 0 GGADMP Cc1c(Br)cncc1C[NH2+]Cc1ccncc1OCCC[NH+](C)C ZINC000657469902 567061306 /nfs/dbraw/zinc/06/13/06/567061306.db2.gz XOKVZHXGMHXQAE-UHFFFAOYSA-N 2 1 393.329 3.168 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000584721729 567064463 /nfs/dbraw/zinc/06/44/63/567064463.db2.gz WRIBSGILFALEPB-LSDHHAIUSA-N 2 1 380.330 3.018 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000584721729 567064470 /nfs/dbraw/zinc/06/44/70/567064470.db2.gz WRIBSGILFALEPB-LSDHHAIUSA-N 2 1 380.330 3.018 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@H](Cc2ccccc2Br)C2CC2)CC1(C)C ZINC000453226435 567064552 /nfs/dbraw/zinc/06/45/52/567064552.db2.gz VHARDIUNPNGPIG-LJQANCHMSA-N 2 1 394.401 3.386 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]1C1CC[NH+](Cc2cc(Br)c(Cl)s2)CC1 ZINC000584719439 567064739 /nfs/dbraw/zinc/06/47/39/567064739.db2.gz GMIHPKFCHYCVPH-OLZOCXBDSA-N 2 1 379.751 3.492 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000584721727 567065392 /nfs/dbraw/zinc/06/53/92/567065392.db2.gz WRIBSGILFALEPB-GJZGRUSLSA-N 2 1 380.330 3.018 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000584721727 567065400 /nfs/dbraw/zinc/06/54/00/567065400.db2.gz WRIBSGILFALEPB-GJZGRUSLSA-N 2 1 380.330 3.018 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]CCC(=O)Nc1cccc(Br)c1 ZINC000565594297 567081045 /nfs/dbraw/zinc/08/10/45/567081045.db2.gz SYCBPHPDFIUPQZ-CYBMUJFWSA-N 2 1 379.302 3.209 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@H]2C)cc1Br ZINC000453381580 567083347 /nfs/dbraw/zinc/08/33/47/567083347.db2.gz RMYBQBLCJIBDSJ-WXSAJPJJSA-N 2 1 383.374 3.227 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000565627027 567083975 /nfs/dbraw/zinc/08/39/75/567083975.db2.gz SRAYMQVXAPRMEV-CABCVRRESA-N 2 1 382.346 3.486 20 0 GGADMP Cc1cc(Br)cc(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)c1 ZINC000545914844 567087220 /nfs/dbraw/zinc/08/72/20/567087220.db2.gz YRPVCXSOYLZXDT-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP Brc1cccc2c(C[NH2+]C3CC[NH+]([C@H]4CCOC4)CC3)ccnc12 ZINC000657752775 567093034 /nfs/dbraw/zinc/09/30/34/567093034.db2.gz QYIZXHFVGSQZDT-INIZCTEOSA-N 2 1 390.325 3.340 20 0 GGADMP C[N@@H+](CCCC[NH2+]Cc1ccc(Br)cc1N1CCOCC1)C1CC1 ZINC000453603299 567096827 /nfs/dbraw/zinc/09/68/27/567096827.db2.gz XFJMSDGLLWQESE-UHFFFAOYSA-N 2 1 396.373 3.250 20 0 GGADMP CC[C@H](Cc1ccc(Br)cc1)[NH2+]CCCN1CCC[N@@H+](C)CC1 ZINC000657872545 567102419 /nfs/dbraw/zinc/10/24/19/567102419.db2.gz OAFMMCZEJKWTFF-LJQANCHMSA-N 2 1 382.390 3.387 20 0 GGADMP CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000565834276 567104475 /nfs/dbraw/zinc/10/44/75/567104475.db2.gz DTYKUCAZSXKNHS-CVEARBPZSA-N 2 1 384.351 3.273 20 0 GGADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000474011914 567124585 /nfs/dbraw/zinc/12/45/85/567124585.db2.gz RDICIVOASWVLKO-MRXNPFEDSA-N 2 1 396.373 3.107 20 0 GGADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000474011914 567124591 /nfs/dbraw/zinc/12/45/91/567124591.db2.gz RDICIVOASWVLKO-MRXNPFEDSA-N 2 1 396.373 3.107 20 0 GGADMP CC[C@H]([NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1)c1cccc(Br)c1 ZINC000566103739 567126185 /nfs/dbraw/zinc/12/61/85/567126185.db2.gz JCWNLVJAMPPONY-HNNXBMFYSA-N 2 1 378.318 3.275 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]CCc2cn3cc(Br)cc(C)c3n2)[C@H](C)C1 ZINC000546932653 567172037 /nfs/dbraw/zinc/17/20/37/567172037.db2.gz XMPGCCCAXSSLQE-PBHICJAKSA-N 2 1 379.346 3.268 20 0 GGADMP C[C@@H](Cc1ccc(F)cc1Br)[NH2+]CCN1CC[N@@H+](C)C(C)(C)C1 ZINC000566700638 567181763 /nfs/dbraw/zinc/18/17/63/567181763.db2.gz AISGTQBFKKMNBQ-AWEZNQCLSA-N 2 1 386.353 3.135 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)[NH+](C)C ZINC000454824330 567204738 /nfs/dbraw/zinc/20/47/38/567204738.db2.gz SZVSNTSGTFWOGW-ZDUSSCGKSA-N 2 1 387.355 3.207 20 0 GGADMP C[C@@H](CCc1ccc(I)cc1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000474881128 567206644 /nfs/dbraw/zinc/20/66/44/567206644.db2.gz PYYUHNAUQIKUDK-AWEZNQCLSA-N 2 1 384.305 3.464 20 0 GGADMP C[NH+](C)CC1CC[NH+](Cc2nc(-c3cccc(Br)c3)no2)CC1 ZINC000590125588 567209978 /nfs/dbraw/zinc/20/99/78/567209978.db2.gz AVXDAFWQTJHTBM-UHFFFAOYSA-N 2 1 379.302 3.273 20 0 GGADMP C[NH+](C)CC1CC[NH+](CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000590125766 567210205 /nfs/dbraw/zinc/21/02/05/567210205.db2.gz KOTPNRVXKUJZSV-UHFFFAOYSA-N 2 1 375.847 3.154 20 0 GGADMP C[NH+](C)CCOc1cnccc1C[NH2+]Cc1cc(Br)ccc1F ZINC000567078534 567215749 /nfs/dbraw/zinc/21/57/49/567215749.db2.gz DZBXNAHQQIZFMX-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP O[C@H](C[NH2+][C@H]1CCCc2c3cc(Br)ccc3[nH]c21)C[NH+]1CCCC1 ZINC000567307643 567234476 /nfs/dbraw/zinc/23/44/76/567234476.db2.gz OAMONHRGHVLORG-KDOFPFPSSA-N 2 1 392.341 3.354 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cnn3cc(Br)cnc23)C1 ZINC000638366387 567244254 /nfs/dbraw/zinc/24/42/54/567244254.db2.gz NWEBPHYJENKYEB-AWEZNQCLSA-N 2 1 380.334 3.094 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cnn3cc(Br)cnc23)C1 ZINC000638366390 567245213 /nfs/dbraw/zinc/24/52/13/567245213.db2.gz NWEBPHYJENKYEB-CQSZACIVSA-N 2 1 380.334 3.094 20 0 GGADMP C[NH2+][C@@H](C(=O)Nc1ccc2c(c1)OCC[NH2+]C2)c1cccc(Cl)c1Cl ZINC000638670125 567263762 /nfs/dbraw/zinc/26/37/62/567263762.db2.gz DHFNHLXVVXDELP-QGZVFWFLSA-N 2 1 380.275 3.375 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C[C@H](O)COc2cccc(Br)c2)C1 ZINC000567678078 567267431 /nfs/dbraw/zinc/26/74/31/567267431.db2.gz JJTHFIRGTOIYSK-WMZOPIPTSA-N 2 1 399.373 3.291 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000567678077 567267443 /nfs/dbraw/zinc/26/74/43/567267443.db2.gz JJTHFIRGTOIYSK-SJLPKXTDSA-N 2 1 399.373 3.291 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]C[C@H](O)COc2cccc(Br)c2)C1 ZINC000567688810 567267617 /nfs/dbraw/zinc/26/76/17/567267617.db2.gz ZSRZVURPJKLFIA-AEFFLSMTSA-N 2 1 399.373 3.146 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C[C@H](O)COc2cccc(Br)c2)C1 ZINC000567678075 567267916 /nfs/dbraw/zinc/26/79/16/567267916.db2.gz JJTHFIRGTOIYSK-AEFFLSMTSA-N 2 1 399.373 3.291 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)[C@@](C)([NH3+])c2ccc(Br)cc2)CC1 ZINC000567773858 567275559 /nfs/dbraw/zinc/27/55/59/567275559.db2.gz QDVPLCMNJWLMON-IBGZPJMESA-N 2 1 396.373 3.202 20 0 GGADMP C[C@H]1C[C@@H]1C[N@@H+](CCN1CC[NH+](C)CC1)Cc1ccc(Br)cc1F ZINC000685469243 567277850 /nfs/dbraw/zinc/27/78/50/567277850.db2.gz UBQVVNFLLKIONF-DOTOQJQBSA-N 2 1 398.364 3.294 20 0 GGADMP Brc1cc2c(cc1C[N@H+]1CCC[C@H]([C@@H]3CC[NH2+]C3)C1)OCCCO2 ZINC000567895556 567288563 /nfs/dbraw/zinc/28/85/63/567288563.db2.gz NUTLUCOOZKPXOL-CABCVRRESA-N 2 1 395.341 3.432 20 0 GGADMP CC(C)(O)C[NH+]1CCC([NH2+][C@@H](c2cncc(Br)c2)C2CC2)CC1 ZINC000639146146 567293083 /nfs/dbraw/zinc/29/30/83/567293083.db2.gz FCJRHYGTZFKKNR-QGZVFWFLSA-N 2 1 382.346 3.120 20 0 GGADMP C[C@H]([NH2+]CCCc1c[nH+]cn1C)c1ccc(Br)cc1OCCCO ZINC000568175726 567310885 /nfs/dbraw/zinc/31/08/85/567310885.db2.gz GHGQNTBBHQULFT-AWEZNQCLSA-N 2 1 396.329 3.227 20 0 GGADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCC(=O)Nc1ccc(Br)cc1)C2 ZINC000660655461 567317857 /nfs/dbraw/zinc/31/78/57/567317857.db2.gz NLKIWXCKXMKKPE-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCC(=O)Nc1ccc(Br)cc1)C2 ZINC000660655461 567317863 /nfs/dbraw/zinc/31/78/63/567317863.db2.gz NLKIWXCKXMKKPE-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCC(=O)Nc1ccc(Br)cc1)C2 ZINC000660655461 567317870 /nfs/dbraw/zinc/31/78/70/567317870.db2.gz NLKIWXCKXMKKPE-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](CCC(=O)Nc1ccc(Br)cc1)C2 ZINC000660655463 567317905 /nfs/dbraw/zinc/31/79/05/567317905.db2.gz NLKIWXCKXMKKPE-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](CCC(=O)Nc1ccc(Br)cc1)C2 ZINC000660655463 567317913 /nfs/dbraw/zinc/31/79/13/567317913.db2.gz NLKIWXCKXMKKPE-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCC(=O)Nc1ccc(Br)cc1)C2 ZINC000660655463 567317921 /nfs/dbraw/zinc/31/79/21/567317921.db2.gz NLKIWXCKXMKKPE-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](CCC(=O)Nc1ccccc1Br)C2 ZINC000660659907 567318100 /nfs/dbraw/zinc/31/81/00/567318100.db2.gz SGBRJOOMRDDDTF-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](CCC(=O)Nc1ccccc1Br)C2 ZINC000660659907 567318106 /nfs/dbraw/zinc/31/81/06/567318106.db2.gz SGBRJOOMRDDDTF-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCC(=O)Nc1ccccc1Br)C2 ZINC000660659907 567318109 /nfs/dbraw/zinc/31/81/09/567318109.db2.gz SGBRJOOMRDDDTF-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP O=C(C[N@@H+]1CC[C@H](n2cnc3c2CCCC3)C1)NCc1ccc(Cl)s1 ZINC000548664979 567340795 /nfs/dbraw/zinc/34/07/95/567340795.db2.gz ISQVPIHTAUEICT-ZDUSSCGKSA-N 2 1 378.929 3.040 20 0 GGADMP Clc1ccc(-n2cc(C[N@H+]3CCC[C@@H]([C@@H]4CC[NH2+]C4)C3)nn2)cc1Cl ZINC000568628684 567345460 /nfs/dbraw/zinc/34/54/60/567345460.db2.gz VFKLXGDSIFVCPG-ZIAGYGMSSA-N 2 1 380.323 3.396 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C[C@H]21 ZINC000435377388 567357626 /nfs/dbraw/zinc/35/76/26/567357626.db2.gz BAKQFSDJHVFRSQ-FVQBIDKESA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C[C@H]21 ZINC000435377388 567357629 /nfs/dbraw/zinc/35/76/29/567357629.db2.gz BAKQFSDJHVFRSQ-FVQBIDKESA-N 2 1 375.314 3.398 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000435383757 567359289 /nfs/dbraw/zinc/35/92/89/567359289.db2.gz JRBDFCTUDSICHS-JVPBZIDWSA-N 2 1 389.341 3.421 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3nc(-c4ccc(Br)cc4)c[nH]3)C[C@H]21 ZINC000435381096 567359802 /nfs/dbraw/zinc/35/98/02/567359802.db2.gz VHRRMQJPKKULEB-FVQBIDKESA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4ccc(Br)cc4)c[nH]3)C[C@H]21 ZINC000435381096 567359808 /nfs/dbraw/zinc/35/98/08/567359808.db2.gz VHRRMQJPKKULEB-FVQBIDKESA-N 2 1 375.314 3.398 20 0 GGADMP Cc1cc([C@@H]2CCC[N@H+]2CCC(=O)N2CC[NH+](C)CC2)ccc1Br ZINC000549164885 567376714 /nfs/dbraw/zinc/37/67/14/567376714.db2.gz FXBGVDFUMUDYJG-SFHVURJKSA-N 2 1 394.357 3.059 20 0 GGADMP Cc1cc([C@@H]2CCC[N@@H+]2CCC(=O)N2CC[NH+](C)CC2)ccc1Br ZINC000549164885 567376723 /nfs/dbraw/zinc/37/67/23/567376723.db2.gz FXBGVDFUMUDYJG-SFHVURJKSA-N 2 1 394.357 3.059 20 0 GGADMP C[C@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1cc(F)c(Br)cc1F ZINC000527859574 567379517 /nfs/dbraw/zinc/37/95/17/567379517.db2.gz QBJKGXSOWRDGRY-ZDUSSCGKSA-N 2 1 390.316 3.406 20 0 GGADMP COC(=O)CC[N@H+](CCCc1c[nH+]cn1C)Cc1cccc(Br)c1 ZINC000569375306 567401007 /nfs/dbraw/zinc/40/10/07/567401007.db2.gz MRUCUVUDJMCUHJ-UHFFFAOYSA-N 2 1 394.313 3.181 20 0 GGADMP COC(=O)CC[N@@H+](CCCc1c[nH+]cn1C)Cc1cccc(Br)c1 ZINC000569375306 567401014 /nfs/dbraw/zinc/40/10/14/567401014.db2.gz MRUCUVUDJMCUHJ-UHFFFAOYSA-N 2 1 394.313 3.181 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](CCC[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436235941 567416126 /nfs/dbraw/zinc/41/61/26/567416126.db2.gz CUJNFZUDVXKYEH-ZDUSSCGKSA-N 2 1 377.838 3.036 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436235941 567416132 /nfs/dbraw/zinc/41/61/32/567416132.db2.gz CUJNFZUDVXKYEH-ZDUSSCGKSA-N 2 1 377.838 3.036 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+](CCSc2cccc(Cl)c2)C1)[C@@H]1CCC[NH2+]1 ZINC000662263752 567421662 /nfs/dbraw/zinc/42/16/62/567421662.db2.gz DSNZEOXRMNVBMH-QAPCUYQASA-N 2 1 381.973 3.012 20 0 GGADMP OCC[N@H+](Cc1cc(Br)ccc1F)Cc1cccc2c1CC[NH2+]C2 ZINC000662256564 567422233 /nfs/dbraw/zinc/42/22/33/567422233.db2.gz JTCUPULEVQKKBM-UHFFFAOYSA-N 2 1 393.300 3.228 20 0 GGADMP OCC[N@@H+](Cc1cc(Br)ccc1F)Cc1cccc2c1CC[NH2+]C2 ZINC000662256564 567422238 /nfs/dbraw/zinc/42/22/38/567422238.db2.gz JTCUPULEVQKKBM-UHFFFAOYSA-N 2 1 393.300 3.228 20 0 GGADMP O=C(C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1)Nc1ccc(Br)cc1F ZINC000662290156 567424009 /nfs/dbraw/zinc/42/40/09/567424009.db2.gz LPRBVTDOIJZVNL-AWEZNQCLSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1)Nc1ccc(Br)cc1F ZINC000662290157 567424771 /nfs/dbraw/zinc/42/47/71/567424771.db2.gz LPRBVTDOIJZVNL-CQSZACIVSA-N 2 1 398.320 3.238 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662291505 567425323 /nfs/dbraw/zinc/42/53/23/567425323.db2.gz VMPARZFXRWOUIH-MRXNPFEDSA-N 2 1 394.357 3.408 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)c1cccc(F)c1 ZINC000662348671 567429076 /nfs/dbraw/zinc/42/90/76/567429076.db2.gz XKLZRFODGAQWGN-SJORKVTESA-N 2 1 394.288 3.007 20 0 GGADMP C[N@H+](CCCNC(=O)[C@@H]([NH3+])c1ccccc1Br)Cc1ccccc1 ZINC000662356745 567429117 /nfs/dbraw/zinc/42/91/17/567429117.db2.gz VTFMOYJRXJKYBW-SFHVURJKSA-N 2 1 390.325 3.087 20 0 GGADMP C[N@@H+](CCCNC(=O)[C@@H]([NH3+])c1ccccc1Br)Cc1ccccc1 ZINC000662356745 567429122 /nfs/dbraw/zinc/42/91/22/567429122.db2.gz VTFMOYJRXJKYBW-SFHVURJKSA-N 2 1 390.325 3.087 20 0 GGADMP C[C@H]1CCC[N@H+](CCCCNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662387142 567431369 /nfs/dbraw/zinc/43/13/69/567431369.db2.gz BUVXMDXIZHNGQO-WMLDXEAASA-N 2 1 382.346 3.077 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662387142 567431374 /nfs/dbraw/zinc/43/13/74/567431374.db2.gz BUVXMDXIZHNGQO-WMLDXEAASA-N 2 1 382.346 3.077 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662386261 567431638 /nfs/dbraw/zinc/43/16/38/567431638.db2.gz AGIIPWUVBBDTCC-IIDMSEBBSA-N 2 1 396.373 3.323 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)c1ccc(F)cc1 ZINC000662396438 567433030 /nfs/dbraw/zinc/43/30/30/567433030.db2.gz BDRDFTNEZRXPGL-IAGOWNOFSA-N 2 1 394.288 3.007 20 0 GGADMP C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662402368 567433205 /nfs/dbraw/zinc/43/32/05/567433205.db2.gz IJNGUJHZJKWBHC-BBRMVZONSA-N 2 1 382.346 3.076 20 0 GGADMP C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662402368 567433210 /nfs/dbraw/zinc/43/32/10/567433210.db2.gz IJNGUJHZJKWBHC-BBRMVZONSA-N 2 1 382.346 3.076 20 0 GGADMP [NH3+][C@H](C(=O)NCCCCC[NH+]1CCCCC1)c1ccccc1Br ZINC000662454372 567437734 /nfs/dbraw/zinc/43/77/34/567437734.db2.gz MXIAOCRSBYQRCA-KRWDZBQOSA-N 2 1 382.346 3.221 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)c2cc3c(s2)CC[NH2+]C3)[C@@H]1c1cccs1 ZINC000662474176 567439408 /nfs/dbraw/zinc/43/94/08/567439408.db2.gz UBOUFBWPEBGTDC-SCLBCKFNSA-N 2 1 375.563 3.268 20 0 GGADMP C[NH2+][C@@H](C(=O)N1CCC([C@H]2CCC[NH2+]C2)CC1)c1cccc(Cl)c1Cl ZINC000662586591 567451376 /nfs/dbraw/zinc/45/13/76/567451376.db2.gz LYYMKRAWXDPMEG-KBXCAEBGSA-N 2 1 384.351 3.492 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)C1CCCCC1 ZINC000662679956 567455958 /nfs/dbraw/zinc/45/59/58/567455958.db2.gz QISSOMAEMDUHOQ-SJORKVTESA-N 2 1 382.346 3.076 20 0 GGADMP C[C@@]([NH3+])(C(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1)c1ccc(Br)cc1 ZINC000662667677 567456321 /nfs/dbraw/zinc/45/63/21/567456321.db2.gz CIVLOFKBFMQORY-LPHOPBHVSA-N 2 1 394.357 3.146 20 0 GGADMP CC1(C)CC[NH2+][C@@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000662728256 567459623 /nfs/dbraw/zinc/45/96/23/567459623.db2.gz KYRGFFNMJSGUOY-QGZVFWFLSA-N 2 1 384.351 3.462 20 0 GGADMP CC1(C)CC[NH2+][C@@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000662797256 567462813 /nfs/dbraw/zinc/46/28/13/567462813.db2.gz XIPGYXTUFAZWJC-QGZVFWFLSA-N 2 1 384.351 3.462 20 0 GGADMP C[NH2+][C@H](C(=O)NCC1CC[NH+](CC2CC2)CC1)c1cccc(Cl)c1Cl ZINC000662977237 567471513 /nfs/dbraw/zinc/47/15/13/567471513.db2.gz HHUJISMIEIDRMZ-SFHVURJKSA-N 2 1 384.351 3.492 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccc(I)c(Cl)c1 ZINC000503900191 567510724 /nfs/dbraw/zinc/51/07/24/567510724.db2.gz DENQIBSUNAAYDM-IINYFYTJSA-N 2 1 378.685 3.374 20 0 GGADMP C[NH+](C)CCOCC[NH2+][C@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000551175079 567484093 /nfs/dbraw/zinc/48/40/93/567484093.db2.gz GZAJEPGZMQAKPG-KRWDZBQOSA-N 2 1 385.277 3.438 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)Nc1cccc(Br)c1 ZINC000643061758 567492209 /nfs/dbraw/zinc/49/22/09/567492209.db2.gz SPWAFXQMVGIWRR-IRXDYDNUSA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)Nc1cccc(Br)c1 ZINC000643061758 567492219 /nfs/dbraw/zinc/49/22/19/567492219.db2.gz SPWAFXQMVGIWRR-IRXDYDNUSA-N 2 1 380.330 3.384 20 0 GGADMP C[C@@H]1C[N@@H+](CCCNc2cc[nH+]c3ccc(Br)cc23)C[C@H](C)O1 ZINC000503568777 567495165 /nfs/dbraw/zinc/49/51/65/567495165.db2.gz JFYROZASNRXYOE-OKILXGFUSA-N 2 1 378.314 3.330 20 0 GGADMP C[C@@H]1C[N@H+](CCCNc2cc[nH+]c3ccc(Br)cc23)C[C@H](C)O1 ZINC000503568777 567495174 /nfs/dbraw/zinc/49/51/74/567495174.db2.gz JFYROZASNRXYOE-OKILXGFUSA-N 2 1 378.314 3.330 20 0 GGADMP CC(C)(N)c1noc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)n1 ZINC000570683947 567505146 /nfs/dbraw/zinc/50/51/46/567505146.db2.gz OMEGIFCCOQXZMT-VIFPVBQESA-N 2 1 375.420 3.118 20 0 GGADMP O[C@@H](C[NH2+][C@H]1CCCSc2ccc(Br)cc21)C[NH+]1CCCC1 ZINC000663438445 567508889 /nfs/dbraw/zinc/50/88/89/567508889.db2.gz ICIOPFNVQMKRIF-HOCLYGCPSA-N 2 1 385.371 3.422 20 0 GGADMP COC(=O)c1ccc(C[NH2+]C[C@H](C)Cn2cc[nH+]c2C)c(Br)c1 ZINC000551529973 567514377 /nfs/dbraw/zinc/51/43/77/567514377.db2.gz MJELYENZDHNLGC-LBPRGKRZSA-N 2 1 380.286 3.167 20 0 GGADMP Ic1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CC2 ZINC000595008520 567533882 /nfs/dbraw/zinc/53/38/82/567533882.db2.gz UTWRFRZZEJBLGD-SJCJKPOMSA-N 2 1 382.289 3.352 20 0 GGADMP CC(C)c1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000479962899 567571804 /nfs/dbraw/zinc/57/18/04/567571804.db2.gz SGJIHXLWPLKYEN-GASCZTMLSA-N 2 1 389.341 3.409 20 0 GGADMP CC(C)c1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000479962899 567571810 /nfs/dbraw/zinc/57/18/10/567571810.db2.gz SGJIHXLWPLKYEN-GASCZTMLSA-N 2 1 389.341 3.409 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+][C@H]1CCCOc2ccc(I)cc21 ZINC000530460335 567603910 /nfs/dbraw/zinc/60/39/10/567603910.db2.gz MLXUSIUDTGDYPH-HNNXBMFYSA-N 2 1 397.260 3.071 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000530513148 567608820 /nfs/dbraw/zinc/60/88/20/567608820.db2.gz KKJMSVZSPXGMGG-SFHVURJKSA-N 2 1 378.314 3.483 20 0 GGADMP CCN1CC[NH+]([C@@H]2CCN(Cc3cc(Cl)cc(Br)c3)C2)CC1 ZINC000459346977 567617303 /nfs/dbraw/zinc/61/73/03/567617303.db2.gz LBHJHUHRKNLPMW-QGZVFWFLSA-N 2 1 386.765 3.314 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](Cc2cccc(O)c2Br)CC1 ZINC000459363322 567618246 /nfs/dbraw/zinc/61/82/46/567618246.db2.gz USTLBHLVTMHKQI-UHFFFAOYSA-N 2 1 385.346 3.478 20 0 GGADMP C[N@@H+]1CCCC[C@@H]1C(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000665675779 567634537 /nfs/dbraw/zinc/63/45/37/567634537.db2.gz LCOWSMAXTPBKEN-GOSISDBHSA-N 2 1 394.357 3.014 20 0 GGADMP C[N@H+]1CCCC[C@@H]1C(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000665675779 567634538 /nfs/dbraw/zinc/63/45/38/567634538.db2.gz LCOWSMAXTPBKEN-GOSISDBHSA-N 2 1 394.357 3.014 20 0 GGADMP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](CC(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000572384423 567635296 /nfs/dbraw/zinc/63/52/96/567635296.db2.gz XIXSCVQRSWLXGJ-FUHWJXTLSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](CC(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000572384425 567635749 /nfs/dbraw/zinc/63/57/49/567635749.db2.gz XIXSCVQRSWLXGJ-WMZOPIPTSA-N 2 1 386.323 3.150 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000459568835 567637524 /nfs/dbraw/zinc/63/75/24/567637524.db2.gz KDNYRRPSIOSIAY-HNNXBMFYSA-N 2 1 381.358 3.125 20 0 GGADMP CN(CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)c1ncccc1Br ZINC000553446738 567655368 /nfs/dbraw/zinc/65/53/68/567655368.db2.gz PYSIQWSVOBCBKR-UHFFFAOYSA-N 2 1 395.389 3.477 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2CCOc1cccc(Br)c1 ZINC000441181885 567656271 /nfs/dbraw/zinc/65/62/71/567656271.db2.gz SURKODREDBXMGP-NXHRZFHOSA-N 2 1 383.330 3.011 20 0 GGADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000459737459 567656354 /nfs/dbraw/zinc/65/63/54/567656354.db2.gz RHQZLMBDRSATKD-OAHLLOKOSA-N 2 1 377.330 3.456 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2CCOc1cccc(Br)c1 ZINC000441181885 567656277 /nfs/dbraw/zinc/65/62/77/567656277.db2.gz SURKODREDBXMGP-NXHRZFHOSA-N 2 1 383.330 3.011 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459777235 567658611 /nfs/dbraw/zinc/65/86/11/567658611.db2.gz KIVPULNNHNFDLD-GJZGRUSLSA-N 2 1 382.346 3.488 20 0 GGADMP Cc1nc2c(s1)[C@H]([NH2+]C[C@H](c1cccs1)N1CC[NH+](C)CC1)CCC2 ZINC000531676932 567673257 /nfs/dbraw/zinc/67/32/57/567673257.db2.gz TVCQFDFMRKERNS-NVXWUHKLSA-N 2 1 376.595 3.469 20 0 GGADMP CC[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481668901 567694149 /nfs/dbraw/zinc/69/41/49/567694149.db2.gz JCLKNBKEODZSAG-ZOBUZTSGSA-N 2 1 387.977 3.162 20 0 GGADMP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481668900 567694382 /nfs/dbraw/zinc/69/43/82/567694382.db2.gz JCLKNBKEODZSAG-VYDXJSESSA-N 2 1 387.977 3.162 20 0 GGADMP [NH3+][C@@H](CC(F)F)C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000573367385 567708433 /nfs/dbraw/zinc/70/84/33/567708433.db2.gz WCLHEOHSLPZFDW-AWEZNQCLSA-N 2 1 380.266 3.057 20 0 GGADMP C[C@@H](Cc1ccc(Br)c(F)c1)[NH2+]CCN1CC[N@@H+](C)C(C)(C)C1 ZINC000442860497 567712917 /nfs/dbraw/zinc/71/29/17/567712917.db2.gz BSGPROICVFDZQL-AWEZNQCLSA-N 2 1 386.353 3.135 20 0 GGADMP C[N@H+]1CCN(CC[NH2+][C@H]2CCc3c2cc(Br)cc3F)CC1(C)C ZINC000442871139 567714640 /nfs/dbraw/zinc/71/46/40/567714640.db2.gz HFEZKNLHIITNMQ-KRWDZBQOSA-N 2 1 384.337 3.191 20 0 GGADMP [NH3+]CC[C@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000442925341 567717893 /nfs/dbraw/zinc/71/78/93/567717893.db2.gz VABDUGKASGAYET-CQSZACIVSA-N 2 1 388.293 3.121 20 0 GGADMP O=C(CC[C@H]1CC[NH2+]C1)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000646497106 567720745 /nfs/dbraw/zinc/72/07/45/567720745.db2.gz OJDFCHQFMGXBRR-AWEZNQCLSA-N 2 1 384.351 3.464 20 0 GGADMP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121226 567760394 /nfs/dbraw/zinc/76/03/94/567760394.db2.gz QFPJQJPQYNMWFY-LSDHHAIUSA-N 2 1 382.346 3.488 20 0 GGADMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000624123209 567761685 /nfs/dbraw/zinc/76/16/85/567761685.db2.gz ICOWEIYOXNVPBY-RHSMWYFYSA-N 2 1 387.977 3.021 20 0 GGADMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000624123209 567761687 /nfs/dbraw/zinc/76/16/87/567761687.db2.gz ICOWEIYOXNVPBY-RHSMWYFYSA-N 2 1 387.977 3.021 20 0 GGADMP CC[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000624123208 567761818 /nfs/dbraw/zinc/76/18/18/567761818.db2.gz ICOWEIYOXNVPBY-PBHICJAKSA-N 2 1 387.977 3.021 20 0 GGADMP CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000624123208 567761821 /nfs/dbraw/zinc/76/18/21/567761821.db2.gz ICOWEIYOXNVPBY-PBHICJAKSA-N 2 1 387.977 3.021 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CCC[C@@H](C[NH3+])C1 ZINC000574276965 567768531 /nfs/dbraw/zinc/76/85/31/567768531.db2.gz KUNFGEVLLGVVPD-HNNXBMFYSA-N 2 1 377.330 3.422 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](CCOc2ccccc2Br)C1 ZINC000508843602 567769026 /nfs/dbraw/zinc/76/90/26/567769026.db2.gz UVGAUKMYPDAHJN-MRXNPFEDSA-N 2 1 385.346 3.261 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](CCOc2ccccc2Br)C1 ZINC000508843602 567769032 /nfs/dbraw/zinc/76/90/32/567769032.db2.gz UVGAUKMYPDAHJN-MRXNPFEDSA-N 2 1 385.346 3.261 20 0 GGADMP C[N@H+](C[C@H](O)C[NH2+]CC1(c2ccc(Br)cc2Cl)CC1)C1CC1 ZINC000574445366 567778822 /nfs/dbraw/zinc/77/88/22/567778822.db2.gz ZSXBKWBCPIYTQM-CQSZACIVSA-N 2 1 387.749 3.179 20 0 GGADMP C[N@@H+](C[C@H](O)C[NH2+]CC1(c2ccc(Br)cc2Cl)CC1)C1CC1 ZINC000574445366 567778829 /nfs/dbraw/zinc/77/88/29/567778829.db2.gz ZSXBKWBCPIYTQM-CQSZACIVSA-N 2 1 387.749 3.179 20 0 GGADMP COc1c(Br)cc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1Br ZINC000574501308 567781699 /nfs/dbraw/zinc/78/16/99/567781699.db2.gz PMZNIHGXXWIOCZ-ONGXEEELSA-N 2 1 392.135 3.450 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c(OC)c1 ZINC000647545708 567790475 /nfs/dbraw/zinc/79/04/75/567790475.db2.gz HYJVUNGENHWELE-ZIAGYGMSSA-N 2 1 383.330 3.288 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c(OC)c1 ZINC000647545706 567790625 /nfs/dbraw/zinc/79/06/25/567790625.db2.gz HYJVUNGENHWELE-KGLIPLIRSA-N 2 1 383.330 3.288 20 0 GGADMP COc1cc(Br)c(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)c(OC)c1 ZINC000647542162 567790952 /nfs/dbraw/zinc/79/09/52/567790952.db2.gz GDDYJWYJKAEUGF-CQSZACIVSA-N 2 1 383.330 3.288 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1cncc(Br)c1C ZINC000668159868 567799459 /nfs/dbraw/zinc/79/94/59/567799459.db2.gz JJAUCDJIBIGHCB-QGZVFWFLSA-N 2 1 383.378 3.000 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(Br)c1 ZINC000647975203 567808780 /nfs/dbraw/zinc/80/87/80/567808780.db2.gz PZEUEULVLAUJQW-HOTGVXAUSA-N 2 1 394.357 3.408 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(Br)c1 ZINC000647975203 567808786 /nfs/dbraw/zinc/80/87/86/567808786.db2.gz PZEUEULVLAUJQW-HOTGVXAUSA-N 2 1 394.357 3.408 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(Br)c1 ZINC000647975205 567808834 /nfs/dbraw/zinc/80/88/34/567808834.db2.gz PZEUEULVLAUJQW-JKSUJKDBSA-N 2 1 394.357 3.408 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(Br)c1 ZINC000647975205 567808837 /nfs/dbraw/zinc/80/88/37/567808837.db2.gz PZEUEULVLAUJQW-JKSUJKDBSA-N 2 1 394.357 3.408 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647975755 567808969 /nfs/dbraw/zinc/80/89/69/567808969.db2.gz FOPWBBSQPRAVPY-HZPDHXFCSA-N 2 1 394.357 3.408 20 0 GGADMP O=C(C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000647975007 567809006 /nfs/dbraw/zinc/80/90/06/567809006.db2.gz GHTNPOULCSJZTF-ZIAGYGMSSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000647975007 567809011 /nfs/dbraw/zinc/80/90/11/567809011.db2.gz GHTNPOULCSJZTF-ZIAGYGMSSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000647975225 567809183 /nfs/dbraw/zinc/80/91/83/567809183.db2.gz RFHBYCGQIMLKBX-HUUCEWRRSA-N 2 1 380.330 3.099 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647975753 567809215 /nfs/dbraw/zinc/80/92/15/567809215.db2.gz FOPWBBSQPRAVPY-CVEARBPZSA-N 2 1 394.357 3.408 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1)c1ccc(Cl)cc1Cl ZINC000647987298 567810021 /nfs/dbraw/zinc/81/00/21/567810021.db2.gz GUOOLGAEIUZNMK-ZNMIVQPWSA-N 2 1 384.351 3.492 20 0 GGADMP C[NH+]1CCN([C@@H](C[NH2+]Cc2ccc(-n3ccnc3)cc2)c2cccs2)CC1 ZINC000022790075 570327860 /nfs/dbraw/zinc/32/78/60/570327860.db2.gz YZCSYDNHYJCWEF-FQEVSTJZSA-N 2 1 381.549 3.012 20 0 GGADMP CC(C)(CNC(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[NH+]1CCCCC1 ZINC000058179451 570717020 /nfs/dbraw/zinc/71/70/20/570717020.db2.gz GFAWXQCMADHDMW-OAQYLSRUSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOc2ccc(-c3nn[nH]n3)cc2)C1 ZINC000736265434 598870334 /nfs/dbraw/zinc/87/03/34/598870334.db2.gz APNOUBZHXJFHTE-MOPGFXCFSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCOc2ccc(-c3nn[nH]n3)cc2)C1 ZINC000736265434 598870337 /nfs/dbraw/zinc/87/03/37/598870337.db2.gz APNOUBZHXJFHTE-MOPGFXCFSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCOc2ccc(-c3nn[nH]n3)cc2)C1 ZINC000736265434 598870339 /nfs/dbraw/zinc/87/03/39/598870339.db2.gz APNOUBZHXJFHTE-MOPGFXCFSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCOc2ccc(-c3nn[nH]n3)cc2)C1 ZINC000736265434 598870341 /nfs/dbraw/zinc/87/03/41/598870341.db2.gz APNOUBZHXJFHTE-MOPGFXCFSA-N 2 1 398.555 3.222 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3cccc(-c4nn[nH]n4)c3)cc2)C1 ZINC000736268587 598491834 /nfs/dbraw/zinc/49/18/34/598491834.db2.gz YGQOSTAPKDNHDT-QGZVFWFLSA-N 2 1 376.508 3.388 20 0 GGADMP Cc1cc(C)c2[nH+]cc(-c3nn[nH]n3)c(N3CCC(C[NH+]4CCCC4)CC3)c2c1 ZINC000822195531 599480558 /nfs/dbraw/zinc/48/05/58/599480558.db2.gz UXYJRRIWJNIDCV-UHFFFAOYSA-N 2 1 391.523 3.344 20 0 GGADMP C[N@H+]1CCC[C@@H](CNCc2ccc(-c3nn[nH]n3)cc2F)[C@@H]1c1cccs1 ZINC000821623804 607483520 /nfs/dbraw/zinc/48/35/20/607483520.db2.gz SVYJIFVIJJUBAB-MAUKXSAKSA-N 2 1 386.500 3.240 20 0 GGADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@H](C(=O)[O-])c1ccc(F)cc1 ZINC000830923206 601156630 /nfs/dbraw/zinc/15/66/30/601156630.db2.gz AIDMKYPPEADDNK-NRFANRHFSA-N 2 1 391.531 3.080 20 0 GGADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@H](C(=O)[O-])c1ccc(F)cc1 ZINC000830923206 601156633 /nfs/dbraw/zinc/15/66/33/601156633.db2.gz AIDMKYPPEADDNK-NRFANRHFSA-N 2 1 391.531 3.080 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C1CC[NH+](CCCC(=O)[O-])CC1 ZINC000833614334 605219380 /nfs/dbraw/zinc/21/93/80/605219380.db2.gz GHKIILOAAFWDEK-IBGZPJMESA-N 2 1 387.568 3.480 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[nH+]1 ZINC000822192885 606200583 /nfs/dbraw/zinc/20/05/83/606200583.db2.gz DVXBTLLXPTXTOL-WMZOPIPTSA-N 2 1 377.496 3.344 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)[nH+]1 ZINC000822192885 606200584 /nfs/dbraw/zinc/20/05/84/606200584.db2.gz DVXBTLLXPTXTOL-WMZOPIPTSA-N 2 1 377.496 3.344 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)[nH+]1 ZINC000822192015 606878398 /nfs/dbraw/zinc/87/83/98/606878398.db2.gz WWFAXCSWITZATO-QGZVFWFLSA-N 2 1 383.544 3.359 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)[nH+]1 ZINC000822192015 606878399 /nfs/dbraw/zinc/87/83/99/606878399.db2.gz WWFAXCSWITZATO-QGZVFWFLSA-N 2 1 383.544 3.359 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cc(-c3nn[nH]n3)ccc2F)CC1 ZINC000820703742 606914799 /nfs/dbraw/zinc/91/47/99/606914799.db2.gz JYFOSKWZCQGEHG-INIZCTEOSA-N 2 1 386.519 3.482 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(F)cc2-c2nn[nH]n2)CC1 ZINC000820703134 606914893 /nfs/dbraw/zinc/91/48/93/606914893.db2.gz CZLKFUHSMXPLBZ-MRXNPFEDSA-N 2 1 386.519 3.482 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(-c2nn[nH]n2)cc1 ZINC000820411627 607012124 /nfs/dbraw/zinc/01/21/24/607012124.db2.gz IVPSFTDTEXABOJ-FIKGOQFSSA-N 2 1 376.508 3.428 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(-c2nn[nH]n2)cc1 ZINC000820411627 607012126 /nfs/dbraw/zinc/01/21/26/607012126.db2.gz IVPSFTDTEXABOJ-FIKGOQFSSA-N 2 1 376.508 3.428 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(-c2nn[nH]n2)c1 ZINC000820409890 607083797 /nfs/dbraw/zinc/08/37/97/607083797.db2.gz BLRQNXULUPUYBE-XGHQBKJUSA-N 2 1 376.508 3.428 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(-c2nn[nH]n2)c1 ZINC000820409890 607083799 /nfs/dbraw/zinc/08/37/99/607083799.db2.gz BLRQNXULUPUYBE-XGHQBKJUSA-N 2 1 376.508 3.428 20 0 GGADMP c1cc(-c2cccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)c2)sc1-c1nn[nH]n1 ZINC000826515744 607850794 /nfs/dbraw/zinc/85/07/94/607850794.db2.gz JHXJFGGOUIVSHT-SJORKVTESA-N 2 1 380.521 3.312 20 0 GGADMP Cc1cc(C)c(-c2nn[nH]n2)c(N(C)CCC2CCN(c3cc[nH+]cc3)CC2)[nH+]1 ZINC000826262802 608194151 /nfs/dbraw/zinc/19/41/51/608194151.db2.gz ZFLFZLTWUBGOMW-UHFFFAOYSA-N 2 1 392.511 3.016 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(-c2nn[nH]n2)cc1F ZINC000825918934 608207817 /nfs/dbraw/zinc/20/78/17/608207817.db2.gz PMXXJOGJPCUOGV-UHFFFAOYSA-N 2 1 395.486 3.139 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)cc1-c1nn[nH]n1 ZINC000826202568 608287019 /nfs/dbraw/zinc/28/70/19/608287019.db2.gz DSMBAEIOOCNWGJ-HNAYVOBHSA-N 2 1 384.528 3.008 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCOc2ccccc2-c2nn[nH]n2)cc1 ZINC000826331055 608580187 /nfs/dbraw/zinc/58/01/87/608580187.db2.gz RNUPODIRZCIVSB-OAHLLOKOSA-N 2 1 389.463 3.090 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCOc2ccccc2-c2nn[nH]n2)cc1 ZINC000826331054 608580458 /nfs/dbraw/zinc/58/04/58/608580458.db2.gz RNUPODIRZCIVSB-HNNXBMFYSA-N 2 1 389.463 3.090 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(-c2nn[nH]n2)cc1 ZINC000824530966 609418124 /nfs/dbraw/zinc/41/81/24/609418124.db2.gz NQCDZFGNAOJYBA-FIKGOQFSSA-N 2 1 376.508 3.428 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)CCc1ccccc1 ZINC000053048442 1406271669 /nfs/dbraw/zinc/27/16/69/1406271669.db2.gz IIUSNPWPDDNDMN-FQEVSTJZSA-N 2 1 379.548 3.330 20 0 GGADMP CC1(C)CC(NC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)CC(C)(C)[NH2+]1 ZINC000053954975 1406568795 /nfs/dbraw/zinc/56/87/95/1406568795.db2.gz ZEGXKFQGIMXSOP-UHFFFAOYSA-N 2 1 390.547 3.352 20 0 GGADMP CC1(C)CC(NC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)CC(C)(C)[NH2+]1 ZINC000053954975 1406568804 /nfs/dbraw/zinc/56/88/04/1406568804.db2.gz ZEGXKFQGIMXSOP-UHFFFAOYSA-N 2 1 390.547 3.352 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000054092844 1406614568 /nfs/dbraw/zinc/61/45/68/1406614568.db2.gz LZDCHUQRCQFHRC-UHFFFAOYSA-N 2 1 392.547 3.310 20 0 GGADMP Cc1cc(NC(=O)NCC[N@H+](C)Cc2ccccc2)ccc1N1CC[NH+](C)CC1 ZINC000054386436 1406711590 /nfs/dbraw/zinc/71/15/90/1406711590.db2.gz QSLWSXJGJHUXCH-UHFFFAOYSA-N 2 1 395.551 3.000 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)C1 ZINC000054511538 1406757205 /nfs/dbraw/zinc/75/72/05/1406757205.db2.gz XMWFWASRSKPACX-PMACEKPBSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000054511538 1406757212 /nfs/dbraw/zinc/75/72/12/1406757212.db2.gz XMWFWASRSKPACX-PMACEKPBSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000054511538 1406757219 /nfs/dbraw/zinc/75/72/19/1406757219.db2.gz XMWFWASRSKPACX-PMACEKPBSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)C1 ZINC000054511674 1406757246 /nfs/dbraw/zinc/75/72/46/1406757246.db2.gz MWYCOEUZXJHUOX-UGKGYDQZSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000054511674 1406757251 /nfs/dbraw/zinc/75/72/51/1406757251.db2.gz MWYCOEUZXJHUOX-UGKGYDQZSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000054511674 1406757257 /nfs/dbraw/zinc/75/72/57/1406757257.db2.gz MWYCOEUZXJHUOX-UGKGYDQZSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NCc1cccnc1-n1cc[nH+]c1C)CC(C)C ZINC000054606385 1406781481 /nfs/dbraw/zinc/78/14/81/1406781481.db2.gz NKJXOPGQYDLBDG-IBGZPJMESA-N 2 1 386.544 3.131 20 0 GGADMP CCC(CC)[C@H](CNC(=O)NCc1cccnc1-n1cc[nH+]c1C)[NH+]1CCCC1 ZINC000054606370 1406781627 /nfs/dbraw/zinc/78/16/27/1406781627.db2.gz NAIQNIJVMGEKPW-FQEVSTJZSA-N 2 1 398.555 3.276 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)NCc2ccc(C[NH+](C)C)cc2)C1 ZINC000054718015 1406812071 /nfs/dbraw/zinc/81/20/71/1406812071.db2.gz SIUFLPJPMPBPNY-GCJKJVERSA-N 2 1 380.536 3.383 20 0 GGADMP CCOc1cc(C[NH2+]CCC[NH+](C)C)ccc1OCC(=O)Nc1ccccc1 ZINC000022770910 1399500373 /nfs/dbraw/zinc/50/03/73/1399500373.db2.gz RFOCHOTYVGKPFB-UHFFFAOYSA-N 2 1 385.508 3.144 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+]2Cc3ccccc3[C@@H](c3ccccc3)C2)CC1 ZINC000026100182 1399859243 /nfs/dbraw/zinc/85/92/43/1399859243.db2.gz MLUZXDZDXGMIBP-HSZRJFAPSA-N 2 1 377.532 3.235 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NC[C@H](c3ccccc3)[NH+](C)C)cc2)C[C@H](C)O1 ZINC000028838799 1400202154 /nfs/dbraw/zinc/20/21/54/1400202154.db2.gz IGDWONFQPBINDW-SELNLUPBSA-N 2 1 395.547 3.329 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NC[C@H](c3ccccc3)[NH+](C)C)cc2)C[C@H](C)O1 ZINC000028838799 1400202163 /nfs/dbraw/zinc/20/21/63/1400202163.db2.gz IGDWONFQPBINDW-SELNLUPBSA-N 2 1 395.547 3.329 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NCc3ccccc3C[NH+](C)C)cc2)C[C@H](C)O1 ZINC000028896308 1400209316 /nfs/dbraw/zinc/20/93/16/1400209316.db2.gz HYPCCXKBFSVVSN-OALUTQOASA-N 2 1 395.547 3.287 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C[C@H](C)O1 ZINC000028937785 1400214819 /nfs/dbraw/zinc/21/48/19/1400214819.db2.gz HNFFVCWKQZUZJU-IRXDYDNUSA-N 2 1 387.568 3.335 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@@H+](C)[C@@H]3CCc4ccccc43)cc2)CC1 ZINC000029807512 1400356059 /nfs/dbraw/zinc/35/60/59/1400356059.db2.gz CNNXNWNNFHMPGJ-HSZRJFAPSA-N 2 1 392.547 3.386 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000056343125 1407305477 /nfs/dbraw/zinc/30/54/77/1407305477.db2.gz XDHRUISNIJRHHX-UHFFFAOYSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C(C)C)[NH+]2CCC(C)CC2)cn1 ZINC000056398918 1407319932 /nfs/dbraw/zinc/31/99/32/1407319932.db2.gz KERWOEOHBUZORE-HXUWFJFHSA-N 2 1 398.555 3.131 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CCC(=O)N2CCc3sccc3C2)CC1 ZINC000056495167 1407348128 /nfs/dbraw/zinc/34/81/28/1407348128.db2.gz YHCIUFKBXYALBP-UHFFFAOYSA-N 2 1 377.598 3.467 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000042929671 1403675477 /nfs/dbraw/zinc/67/54/77/1403675477.db2.gz NRFUSWKMUXVZEN-HXUWFJFHSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCCC[C@H]1C ZINC000043086023 1403703311 /nfs/dbraw/zinc/70/33/11/1403703311.db2.gz RVNHIYWKSZWHAV-WCIQWLHISA-N 2 1 387.568 3.289 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[NH+]1CCCC[C@H]1C ZINC000043086023 1403703318 /nfs/dbraw/zinc/70/33/18/1403703318.db2.gz RVNHIYWKSZWHAV-WCIQWLHISA-N 2 1 387.568 3.289 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1)[N@@H+]1CCCC[C@H]1C ZINC000043086023 1403703322 /nfs/dbraw/zinc/70/33/22/1403703322.db2.gz RVNHIYWKSZWHAV-WCIQWLHISA-N 2 1 387.568 3.289 20 0 GGADMP C[C@@H](CNC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1)[N@H+]1CCCC[C@H]1C ZINC000043086023 1403703329 /nfs/dbraw/zinc/70/33/29/1403703329.db2.gz RVNHIYWKSZWHAV-WCIQWLHISA-N 2 1 387.568 3.289 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)c1cccs1 ZINC000043145596 1403718581 /nfs/dbraw/zinc/71/85/81/1403718581.db2.gz ZVQOXSBTYFVKIQ-IBGZPJMESA-N 2 1 386.565 3.268 20 0 GGADMP O[C@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)C[NH+]1CCCC1 ZINC000044344848 1403922905 /nfs/dbraw/zinc/92/29/05/1403922905.db2.gz AFKFCLFGKXXUQR-JOCHJYFZSA-N 2 1 394.494 3.225 20 0 GGADMP CC(C)c1ccc(C[NH+]2CCN(C(=O)NC3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000045410473 1404116598 /nfs/dbraw/zinc/11/65/98/1404116598.db2.gz RLYZHGQWRNZGAT-UHFFFAOYSA-N 2 1 384.568 3.264 20 0 GGADMP O=C(NC1CC[NH+](C2CC2)CC1)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000045409452 1404117022 /nfs/dbraw/zinc/11/70/22/1404117022.db2.gz YDGMQDMYTZSWMI-UHFFFAOYSA-N 2 1 390.959 3.184 20 0 GGADMP O=C(NC1CC[NH+](C2CC2)CC1)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000045409452 1404117029 /nfs/dbraw/zinc/11/70/29/1404117029.db2.gz YDGMQDMYTZSWMI-UHFFFAOYSA-N 2 1 390.959 3.184 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[N@H+]1CCc2ccccc2C1 ZINC000045543524 1404143558 /nfs/dbraw/zinc/14/35/58/1404143558.db2.gz JCRAURDAVWSHRN-APWZRJJASA-N 2 1 386.565 3.097 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[N@H+]1CCc2ccccc2C1 ZINC000045543521 1404144174 /nfs/dbraw/zinc/14/41/74/1404144174.db2.gz JCRAURDAVWSHRN-LPHOPBHVSA-N 2 1 386.565 3.097 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)CC1 ZINC000045757665 1404196695 /nfs/dbraw/zinc/19/66/95/1404196695.db2.gz SMWGDBVWFWXIII-ICSRJNTNSA-N 2 1 386.584 3.379 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000045975946 1404258070 /nfs/dbraw/zinc/25/80/70/1404258070.db2.gz URRLNWFKAFCRRM-OALUTQOASA-N 2 1 387.572 3.131 20 0 GGADMP C[N@H+](CC(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cc1)C1CC1 ZINC000046060610 1404286230 /nfs/dbraw/zinc/28/62/30/1404286230.db2.gz JTPQFZSEOWJPEE-UHFFFAOYSA-N 2 1 378.520 3.042 20 0 GGADMP C[N@@H+](CC(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cc1)C1CC1 ZINC000046060610 1404286241 /nfs/dbraw/zinc/28/62/41/1404286241.db2.gz JTPQFZSEOWJPEE-UHFFFAOYSA-N 2 1 378.520 3.042 20 0 GGADMP COc1ccccc1CN(C)C(=O)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000046065114 1404287103 /nfs/dbraw/zinc/28/71/03/1404287103.db2.gz BICDNHYWMQUAML-UHFFFAOYSA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)cc1 ZINC000046672892 1404545184 /nfs/dbraw/zinc/54/51/84/1404545184.db2.gz ABEIPNJIIGPHAG-UHFFFAOYSA-N 2 1 387.568 3.293 20 0 GGADMP C[C@H](CNC(=O)Nc1cccc(C[NH+](C)C)c1)[NH+]1CCN(c2ccccc2)CC1 ZINC000046853057 1404614041 /nfs/dbraw/zinc/61/40/41/1404614041.db2.gz XLVYXJOUAFYHMA-LJQANCHMSA-N 2 1 395.551 3.080 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NCCC[N@H+]1CCc2ccccc2C1)c1cccs1 ZINC000046893251 1404625376 /nfs/dbraw/zinc/62/53/76/1404625376.db2.gz TZFVOJFDFSHARO-IBGZPJMESA-N 2 1 386.565 3.098 20 0 GGADMP O=C(N[C@@H]1CC[NH+]2CCCC[C@H]12)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000047103547 1404707462 /nfs/dbraw/zinc/70/74/62/1404707462.db2.gz IZHUWVJMGNRAGJ-WOJBJXKFSA-N 2 1 390.959 3.184 20 0 GGADMP O=C(N[C@@H]1CC[NH+]2CCCC[C@H]12)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000047103547 1404707469 /nfs/dbraw/zinc/70/74/69/1404707469.db2.gz IZHUWVJMGNRAGJ-WOJBJXKFSA-N 2 1 390.959 3.184 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+]2CCCC[C@H]12)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000047103547 1404707478 /nfs/dbraw/zinc/70/74/78/1404707478.db2.gz IZHUWVJMGNRAGJ-WOJBJXKFSA-N 2 1 390.959 3.184 20 0 GGADMP O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000047103547 1404707484 /nfs/dbraw/zinc/70/74/84/1404707484.db2.gz IZHUWVJMGNRAGJ-WOJBJXKFSA-N 2 1 390.959 3.184 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000047935792 1405002579 /nfs/dbraw/zinc/00/25/79/1405002579.db2.gz JZRPGFXICNSMGR-NHCUHLMSSA-N 2 1 384.499 3.002 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000047935794 1405003116 /nfs/dbraw/zinc/00/31/16/1405003116.db2.gz JZRPGFXICNSMGR-LEWJYISDSA-N 2 1 384.499 3.002 20 0 GGADMP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047950583 1405008700 /nfs/dbraw/zinc/00/87/00/1405008700.db2.gz BFEGPPSERFRGJE-UXHICEINSA-N 2 1 398.576 3.459 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047964778 1405012724 /nfs/dbraw/zinc/01/27/24/1405012724.db2.gz FRRHNAIRKLSBHY-HSZRJFAPSA-N 2 1 392.547 3.356 20 0 GGADMP CC[NH+](CC)CC1CC[NH+](Cc2nc(-c3ccc(OC)cc3OC)no2)CC1 ZINC000047978232 1405014842 /nfs/dbraw/zinc/01/48/42/1405014842.db2.gz NKWYBTQTLAPJPS-UHFFFAOYSA-N 2 1 388.512 3.308 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCC(C)(C)[NH+]3CCCCC3)cc2)C[C@@H](C)O1 ZINC000048178242 1405087828 /nfs/dbraw/zinc/08/78/28/1405087828.db2.gz LDYLTLMDNYGTEV-RTBURBONSA-N 2 1 387.568 3.290 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)NC2CC[NH+](C3CC3)CC2)C1 ZINC000048394820 1405177136 /nfs/dbraw/zinc/17/71/36/1405177136.db2.gz RZQFSDUAGYSFJA-SFHVURJKSA-N 2 1 384.568 3.345 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)N1CCc2sccc2C1 ZINC000048563612 1405225865 /nfs/dbraw/zinc/22/58/65/1405225865.db2.gz AHSMUVDSFDQDIU-UHFFFAOYSA-N 2 1 375.582 3.221 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]Cc2ccc(Cl)s2)c1 ZINC000048778155 1405288980 /nfs/dbraw/zinc/28/89/80/1405288980.db2.gz GUKUKJOJWJETAK-UHFFFAOYSA-N 2 1 393.940 3.352 20 0 GGADMP CSc1ccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)cc1 ZINC000048778050 1405289408 /nfs/dbraw/zinc/28/94/08/1405289408.db2.gz JXHUKZLEJMYABY-UHFFFAOYSA-N 2 1 399.560 3.359 20 0 GGADMP CC[C@H](CNC(=O)NCc1cccc(C[NH+](C)C)c1)[N@H+]1CCc2ccccc2C1 ZINC000049164752 1405347600 /nfs/dbraw/zinc/34/76/00/1405347600.db2.gz LGOBCNGCRVSLIM-HSZRJFAPSA-N 2 1 394.563 3.384 20 0 GGADMP C[NH+](C)C1(CNC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CCCC1 ZINC000050137173 1405496776 /nfs/dbraw/zinc/49/67/76/1405496776.db2.gz MRJYSCLUPIFHBW-KRWDZBQOSA-N 2 1 378.586 3.134 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]2CCc3ccccc3C2)CC1 ZINC000051113858 1405726125 /nfs/dbraw/zinc/72/61/25/1405726125.db2.gz WDNJXQZQZMNHEX-UHFFFAOYSA-N 2 1 377.532 3.134 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2CCc3ccccc3C2)CC1 ZINC000051113858 1405726136 /nfs/dbraw/zinc/72/61/36/1405726136.db2.gz WDNJXQZQZMNHEX-UHFFFAOYSA-N 2 1 377.532 3.134 20 0 GGADMP O[C@H](C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1)C[NH+]1CCCC1 ZINC000051187979 1405740008 /nfs/dbraw/zinc/74/00/08/1405740008.db2.gz MIPOBLVBGCCVHU-HSZRJFAPSA-N 2 1 390.531 3.145 20 0 GGADMP O[C@@H](C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1)C[NH+]1CCCC1 ZINC000051187978 1405740241 /nfs/dbraw/zinc/74/02/41/1405740241.db2.gz MIPOBLVBGCCVHU-QHCPKHFHSA-N 2 1 390.531 3.145 20 0 GGADMP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]C[C@H](O)C[NH+]1CCCC1 ZINC000051188006 1405740767 /nfs/dbraw/zinc/74/07/67/1405740767.db2.gz XBKKHKQBHGRTJW-QFIPXVFZSA-N 2 1 390.531 3.394 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959721 1405889833 /nfs/dbraw/zinc/88/98/33/1405889833.db2.gz TYSQSISZUBZDDC-HNNXBMFYSA-N 2 1 399.457 3.077 20 0 GGADMP Cc1nn(-c2ccccc2)c(Cl)c1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051958087 1405890092 /nfs/dbraw/zinc/89/00/92/1405890092.db2.gz YCNLVRDUSGMDDP-UHFFFAOYSA-N 2 1 388.943 3.378 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000052290391 1406008656 /nfs/dbraw/zinc/00/86/56/1406008656.db2.gz RPEMRVXQBWDKRC-QZTJIDSGSA-N 2 1 383.540 3.169 20 0 GGADMP CCCOc1ccc(Cl)cc1C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000176289659 1428223491 /nfs/dbraw/zinc/22/34/91/1428223491.db2.gz TZVVUYGXZGHTHW-UHFFFAOYSA-N 2 1 393.959 3.417 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000056788353 1407433391 /nfs/dbraw/zinc/43/33/91/1407433391.db2.gz USUHZAOFXMDFOV-ZWKOTPCHSA-N 2 1 390.547 3.210 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000056937358 1407479114 /nfs/dbraw/zinc/47/91/14/1407479114.db2.gz ARGIADUDBIXIJS-QFIPXVFZSA-N 2 1 398.526 3.346 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000056950315 1407482655 /nfs/dbraw/zinc/48/26/55/1407482655.db2.gz PLYMIBBMECSCOU-NHCUHLMSSA-N 2 1 384.499 3.002 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCC[N@H+]2CCCC[C@H]2C)cn1 ZINC000057127254 1407530310 /nfs/dbraw/zinc/53/03/10/1407530310.db2.gz GWGMBOGGXQQLAB-QGZVFWFLSA-N 2 1 384.528 3.030 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)cn1 ZINC000057127254 1407530316 /nfs/dbraw/zinc/53/03/16/1407530316.db2.gz GWGMBOGGXQQLAB-QGZVFWFLSA-N 2 1 384.528 3.030 20 0 GGADMP COc1cccc([C@H](CNC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)[NH+](C)C)c1 ZINC000057127925 1407530594 /nfs/dbraw/zinc/53/05/94/1407530594.db2.gz IOCYEWHRXJFQQZ-GMAHTHKFSA-N 2 1 395.547 3.326 20 0 GGADMP C#CC[NH+]1CCC(C(=O)NCc2ccc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cc2)CC1 ZINC000057172647 1407544436 /nfs/dbraw/zinc/54/44/36/1407544436.db2.gz MKBWZHIASPYNKI-BGYRXZFFSA-N 2 1 381.564 3.126 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000057173194 1407544501 /nfs/dbraw/zinc/54/45/01/1407544501.db2.gz ODQFHDMVMWWTFH-IBGZPJMESA-N 2 1 375.476 3.426 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000057173194 1407544505 /nfs/dbraw/zinc/54/45/05/1407544505.db2.gz ODQFHDMVMWWTFH-IBGZPJMESA-N 2 1 375.476 3.426 20 0 GGADMP C[NH+](C)CCOc1cccc(CNC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000057174358 1407545370 /nfs/dbraw/zinc/54/53/70/1407545370.db2.gz ULUZWAKMNOFOQK-JOCHJYFZSA-N 2 1 395.547 3.155 20 0 GGADMP C[N@H+]1CCCN(c2ccc(NC(=O)[C@@H]3CCC[NH+]3Cc3ccccc3)cc2)CC1 ZINC000057175304 1407545916 /nfs/dbraw/zinc/54/59/16/1407545916.db2.gz VNQMTZKIBHXMDW-QHCPKHFHSA-N 2 1 392.547 3.432 20 0 GGADMP C[NH+]1CCCN(c2ccc(NC(=O)[C@@H]3CCC[N@@H+]3Cc3ccccc3)cc2)CC1 ZINC000057175304 1407545922 /nfs/dbraw/zinc/54/59/22/1407545922.db2.gz VNQMTZKIBHXMDW-QHCPKHFHSA-N 2 1 392.547 3.432 20 0 GGADMP C[NH+]1CCCN(c2ccc(NC(=O)[C@@H]3CCC[N@H+]3Cc3ccccc3)cc2)CC1 ZINC000057175304 1407545928 /nfs/dbraw/zinc/54/59/28/1407545928.db2.gz VNQMTZKIBHXMDW-QHCPKHFHSA-N 2 1 392.547 3.432 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NC[C@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC000057631351 1407671481 /nfs/dbraw/zinc/67/14/81/1407671481.db2.gz KPUONSDMYWAEKG-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000057631351 1407671491 /nfs/dbraw/zinc/67/14/91/1407671491.db2.gz KPUONSDMYWAEKG-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000057631351 1407671501 /nfs/dbraw/zinc/67/15/01/1407671501.db2.gz KPUONSDMYWAEKG-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP CCN1CCc2nc3ccccc3c(C(=O)NC[C@H]3CC[N@@H+](CC(C)C)C3)c2C1 ZINC000176342183 1428257519 /nfs/dbraw/zinc/25/75/19/1428257519.db2.gz IVTKOZQNMOKNOT-GOSISDBHSA-N 2 1 394.563 3.321 20 0 GGADMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NC2CC[NH+](CCOC(C)C)CC2)C1 ZINC000176349674 1428262545 /nfs/dbraw/zinc/26/25/45/1428262545.db2.gz XSKHCPBXQKSVTL-LJQANCHMSA-N 2 1 396.620 3.076 20 0 GGADMP CC(C)CC[N@H+](CN1C(=O)N[C@]2(CCC[NH+](Cc3ccccc3)C2)C1=O)C1CC1 ZINC000058205519 1407797997 /nfs/dbraw/zinc/79/79/97/1407797997.db2.gz JHOSJYKLNAWENK-QHCPKHFHSA-N 2 1 398.551 3.041 20 0 GGADMP CC(C)CC[N@@H+](CN1C(=O)N[C@]2(CCC[NH+](Cc3ccccc3)C2)C1=O)C1CC1 ZINC000058205519 1407798001 /nfs/dbraw/zinc/79/80/01/1407798001.db2.gz JHOSJYKLNAWENK-QHCPKHFHSA-N 2 1 398.551 3.041 20 0 GGADMP CC(C)CC[NH+](CN1C(=O)N[C@]2(CCC[N@H+](Cc3ccccc3)C2)C1=O)C1CC1 ZINC000058205519 1407798004 /nfs/dbraw/zinc/79/80/04/1407798004.db2.gz JHOSJYKLNAWENK-QHCPKHFHSA-N 2 1 398.551 3.041 20 0 GGADMP CC(C)CC[NH+](CN1C(=O)N[C@]2(CCC[N@@H+](Cc3ccccc3)C2)C1=O)C1CC1 ZINC000058205519 1407798005 /nfs/dbraw/zinc/79/80/05/1407798005.db2.gz JHOSJYKLNAWENK-QHCPKHFHSA-N 2 1 398.551 3.041 20 0 GGADMP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000058436559 1407827803 /nfs/dbraw/zinc/82/78/03/1407827803.db2.gz KGAUIIUENNZFLU-FQEVSTJZSA-N 2 1 398.576 3.412 20 0 GGADMP Cc1cccc(C)c1NC(=O)[C@H](C)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368444 1407962457 /nfs/dbraw/zinc/96/24/57/1407962457.db2.gz XJFHUCCAIONZNF-ZCNNSNEGSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1cccc(C)c1NC(=O)[C@H](C)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368444 1407962465 /nfs/dbraw/zinc/96/24/65/1407962465.db2.gz XJFHUCCAIONZNF-ZCNNSNEGSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1ccc(-c2nnc(C[NH+]3CCC(C[NH+]4C[C@@H](C)O[C@H](C)C4)CC3)o2)cc1 ZINC000060368528 1407962963 /nfs/dbraw/zinc/96/29/63/1407962963.db2.gz CGUCZUMNOGDLTI-QZTJIDSGSA-N 2 1 384.524 3.366 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NCC1([NH+]2CCCCC2)CCCCC1)c1ccco1 ZINC000061024809 1408067385 /nfs/dbraw/zinc/06/73/85/1408067385.db2.gz MBYCYPHKJYRVSF-GOSISDBHSA-N 2 1 376.545 3.370 20 0 GGADMP CC(C)[NH+]1CCN(c2ccc(C(=O)NC[C@@H](C)[N@H+]3CCCC[C@H]3C)cc2)CC1 ZINC000061159894 1408085110 /nfs/dbraw/zinc/08/51/10/1408085110.db2.gz HZDBTGVUNGKCRC-WOJBJXKFSA-N 2 1 386.584 3.210 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000176387411 1428291728 /nfs/dbraw/zinc/29/17/28/1428291728.db2.gz RAAXISSXAAZCTK-YADHBBJMSA-N 2 1 384.568 3.228 20 0 GGADMP C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000061788219 1408175970 /nfs/dbraw/zinc/17/59/70/1408175970.db2.gz ZOZMBRINATUNOF-QZTJIDSGSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000061788219 1408175982 /nfs/dbraw/zinc/17/59/82/1408175982.db2.gz ZOZMBRINATUNOF-QZTJIDSGSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](CC2CCCCC2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000062528530 1408274388 /nfs/dbraw/zinc/27/43/88/1408274388.db2.gz UOLAWRQNSFXFSE-RBUKOAKNSA-N 2 1 378.605 3.451 20 0 GGADMP C[NH+](C)[C@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000063143961 1408307458 /nfs/dbraw/zinc/30/74/58/1408307458.db2.gz SMQNJRMXDPSRIY-LJQANCHMSA-N 2 1 386.565 3.011 20 0 GGADMP C[N@@H+](CCCNC(=O)NC1CC[NH+](CC2CCCC2)CC1)Cc1ccccc1 ZINC000063332056 1408338974 /nfs/dbraw/zinc/33/89/74/1408338974.db2.gz JWGLDEHVYMISLV-UHFFFAOYSA-N 2 1 386.584 3.462 20 0 GGADMP COc1ccc(C[NH+]2CCC(CNC(=O)[C@@H](c3ccccc3)[NH+](C)C)CC2)cc1 ZINC000063341483 1408341166 /nfs/dbraw/zinc/34/11/66/1408341166.db2.gz BQZCIWMLWLOMML-HSZRJFAPSA-N 2 1 395.547 3.326 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000063463955 1408358620 /nfs/dbraw/zinc/35/86/20/1408358620.db2.gz XRUDRHKJFCACGN-OAQYLSRUSA-N 2 1 386.584 3.318 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000063710809 1408394740 /nfs/dbraw/zinc/39/47/40/1408394740.db2.gz XKMVKCYGBWNWNX-WOJBJXKFSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)C1 ZINC000063710809 1408394743 /nfs/dbraw/zinc/39/47/43/1408394743.db2.gz XKMVKCYGBWNWNX-WOJBJXKFSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000063710809 1408394749 /nfs/dbraw/zinc/39/47/49/1408394749.db2.gz XKMVKCYGBWNWNX-WOJBJXKFSA-N 2 1 375.532 3.274 20 0 GGADMP CCC[N@@H+](C)CC(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000063755710 1408402999 /nfs/dbraw/zinc/40/29/99/1408402999.db2.gz MTMVBAJANKPQJW-UHFFFAOYSA-N 2 1 380.536 3.289 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000176452949 1428324442 /nfs/dbraw/zinc/32/44/42/1428324442.db2.gz CZLLBGQQSNRNKJ-YADHBBJMSA-N 2 1 384.568 3.167 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)c1 ZINC000064225561 1408514096 /nfs/dbraw/zinc/51/40/96/1408514096.db2.gz YLMSLSSLJJYNHV-UHFFFAOYSA-N 2 1 392.507 3.027 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)c1 ZINC000064225561 1408514101 /nfs/dbraw/zinc/51/41/01/1408514101.db2.gz YLMSLSSLJJYNHV-UHFFFAOYSA-N 2 1 392.507 3.027 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000064229724 1408515752 /nfs/dbraw/zinc/51/57/52/1408515752.db2.gz UATMGYQUVNBOJJ-UHFFFAOYSA-N 2 1 380.536 3.166 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000064229724 1408515773 /nfs/dbraw/zinc/51/57/73/1408515773.db2.gz UATMGYQUVNBOJJ-UHFFFAOYSA-N 2 1 380.536 3.166 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+](C)C1CCCC1 ZINC000176478512 1428333483 /nfs/dbraw/zinc/33/34/83/1428333483.db2.gz JZFQNKHQIKXZGS-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@H+](C)C1CCCC1 ZINC000176478512 1428333489 /nfs/dbraw/zinc/33/34/89/1428333489.db2.gz JZFQNKHQIKXZGS-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@@H+](C)C1CCCC1 ZINC000176478512 1428333498 /nfs/dbraw/zinc/33/34/98/1428333498.db2.gz JZFQNKHQIKXZGS-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)[N@@H+]1CC[C@H](CNC(=O)N2CCC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000065441785 1408670210 /nfs/dbraw/zinc/67/02/10/1408670210.db2.gz SJKHBJAHLQVFJQ-LJQANCHMSA-N 2 1 392.975 3.288 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)N2CCC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000065441785 1408670215 /nfs/dbraw/zinc/67/02/15/1408670215.db2.gz SJKHBJAHLQVFJQ-LJQANCHMSA-N 2 1 392.975 3.288 20 0 GGADMP CC(C)[NH+]1CC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000065441785 1408670220 /nfs/dbraw/zinc/67/02/20/1408670220.db2.gz SJKHBJAHLQVFJQ-LJQANCHMSA-N 2 1 392.975 3.288 20 0 GGADMP CC(C)[NH+]1CC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000065441785 1408670222 /nfs/dbraw/zinc/67/02/22/1408670222.db2.gz SJKHBJAHLQVFJQ-LJQANCHMSA-N 2 1 392.975 3.288 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)N2CC[NH+](CC3CCCCC3)CC2)C1 ZINC000065448386 1408671100 /nfs/dbraw/zinc/67/11/00/1408671100.db2.gz XTWWHJCXATXJFG-HXUWFJFHSA-N 2 1 378.605 3.406 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000065518405 1408682930 /nfs/dbraw/zinc/68/29/30/1408682930.db2.gz RFEQGHRJOIMFAH-URVUXULASA-N 2 1 386.584 3.318 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000065518405 1408682932 /nfs/dbraw/zinc/68/29/32/1408682932.db2.gz RFEQGHRJOIMFAH-URVUXULASA-N 2 1 386.584 3.318 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000065518405 1408682936 /nfs/dbraw/zinc/68/29/36/1408682936.db2.gz RFEQGHRJOIMFAH-URVUXULASA-N 2 1 386.584 3.318 20 0 GGADMP C[N@@H+](CCNC(=O)NCC(C)(C)[NH+]1CCc2ccccc2C1)Cc1ccccc1 ZINC000065542673 1408686256 /nfs/dbraw/zinc/68/62/56/1408686256.db2.gz LIKKOHZBVRXARU-UHFFFAOYSA-N 2 1 394.563 3.255 20 0 GGADMP C[NH+](CCNC(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1)Cc1ccccc1 ZINC000065542673 1408686260 /nfs/dbraw/zinc/68/62/60/1408686260.db2.gz LIKKOHZBVRXARU-UHFFFAOYSA-N 2 1 394.563 3.255 20 0 GGADMP C[NH+](CCNC(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1)Cc1ccccc1 ZINC000065542673 1408686263 /nfs/dbraw/zinc/68/62/63/1408686263.db2.gz LIKKOHZBVRXARU-UHFFFAOYSA-N 2 1 394.563 3.255 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)Nc2ccccc2N2CC[NH+](C)CC2)c1 ZINC000065819812 1408735197 /nfs/dbraw/zinc/73/51/97/1408735197.db2.gz MJRGBJQJZYUQLU-UHFFFAOYSA-N 2 1 395.551 3.212 20 0 GGADMP CC1CC[NH+](CCCNC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000065858193 1408743120 /nfs/dbraw/zinc/74/31/20/1408743120.db2.gz YRUNZISJUCFODA-HXUWFJFHSA-N 2 1 375.532 3.276 20 0 GGADMP CC(C)[C@H](CNC(=O)[C@@H](c1ccccc1)[NH+](C)C)[N@@H+]1CCc2ccccc2C1 ZINC000066044885 1408778118 /nfs/dbraw/zinc/77/81/18/1408778118.db2.gz MUFIGLBLGFPOAV-XZOQPEGZSA-N 2 1 379.548 3.488 20 0 GGADMP CC(C)[C@H](CNC(=O)[C@@H](c1ccccc1)[NH+](C)C)[N@H+]1CCc2ccccc2C1 ZINC000066044885 1408778120 /nfs/dbraw/zinc/77/81/20/1408778120.db2.gz MUFIGLBLGFPOAV-XZOQPEGZSA-N 2 1 379.548 3.488 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N2CC[C@H]([NH+]3CCCC3)C2)C1 ZINC000066178616 1408787619 /nfs/dbraw/zinc/78/76/19/1408787619.db2.gz IDYKZMZFZZAPSN-KNQAVFIVSA-N 2 1 384.568 3.298 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)N2CC[C@H]([NH+]3CCCC3)C2)cc1 ZINC000066178600 1408787677 /nfs/dbraw/zinc/78/76/77/1408787677.db2.gz QZZMNAKNFAWIPX-KNQAVFIVSA-N 2 1 384.568 3.441 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@@H](c2ccc(OC)cc2)[NH+]2CCCC2)cc1 ZINC000066242519 1408794704 /nfs/dbraw/zinc/79/47/04/1408794704.db2.gz GIGOCQAURLULIC-QFIPXVFZSA-N 2 1 396.535 3.197 20 0 GGADMP CC[NH+](CC)C1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000066394906 1408829775 /nfs/dbraw/zinc/82/97/75/1408829775.db2.gz DVHMHGSHPXPGGZ-LJQANCHMSA-N 2 1 375.532 3.371 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cc(-c4ccccc4)no3)CC2)CC1 ZINC000066568537 1408859214 /nfs/dbraw/zinc/85/92/14/1408859214.db2.gz IWAYALOUUAYTEG-UHFFFAOYSA-N 2 1 396.535 3.108 20 0 GGADMP CCOC(=O)c1cn(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)nc1C ZINC000066793766 1408916093 /nfs/dbraw/zinc/91/60/93/1408916093.db2.gz JZYMDYZXENDQEA-UHFFFAOYSA-N 2 1 384.524 3.170 20 0 GGADMP CCOC(=O)c1cn(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)nc1C ZINC000066793766 1408916103 /nfs/dbraw/zinc/91/61/03/1408916103.db2.gz JZYMDYZXENDQEA-UHFFFAOYSA-N 2 1 384.524 3.170 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)Nc1cccc(NC(=O)CC[NH+]2CCCCC2)c1 ZINC000066840412 1408925722 /nfs/dbraw/zinc/92/57/22/1408925722.db2.gz VNRKAUPKZALRRH-HXUWFJFHSA-N 2 1 386.540 3.314 20 0 GGADMP CC(C)[C@@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066914743 1408950256 /nfs/dbraw/zinc/95/02/56/1408950256.db2.gz ULEIKGJILBUAPR-JQVVWYNYSA-N 2 1 387.568 3.032 20 0 GGADMP CC(C)[C@@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066914743 1408950263 /nfs/dbraw/zinc/95/02/63/1408950263.db2.gz ULEIKGJILBUAPR-JQVVWYNYSA-N 2 1 387.568 3.032 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N(C)Cc2ccc(OC)cc2)CC1 ZINC000066960852 1408963503 /nfs/dbraw/zinc/96/35/03/1408963503.db2.gz URBOKEBCJNESFJ-UHFFFAOYSA-N 2 1 375.557 3.098 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)NCCc2ccc(F)cc2)CC1 ZINC000066960599 1408963916 /nfs/dbraw/zinc/96/39/16/1408963916.db2.gz PEGFXNXHBLDOFU-SFHVURJKSA-N 2 1 377.548 3.317 20 0 GGADMP CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1 ZINC000067122403 1409013308 /nfs/dbraw/zinc/01/33/08/1409013308.db2.gz FIHAXZWLPHYTQN-SFHVURJKSA-N 2 1 396.457 3.074 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000067222666 1409046617 /nfs/dbraw/zinc/04/66/17/1409046617.db2.gz FMUOVSMZICLRGN-KRWDZBQOSA-N 2 1 384.524 3.070 20 0 GGADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000067449299 1409122027 /nfs/dbraw/zinc/12/20/27/1409122027.db2.gz QFHLZFWAZMBSPY-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000067449299 1409122036 /nfs/dbraw/zinc/12/20/36/1409122036.db2.gz QFHLZFWAZMBSPY-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1 ZINC000176604375 1428377512 /nfs/dbraw/zinc/37/75/12/1428377512.db2.gz KCEMIARGGBNCRE-FGZHOGPDSA-N 2 1 386.584 3.413 20 0 GGADMP CN(C)C(=O)COc1ccccc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000067507083 1409139719 /nfs/dbraw/zinc/13/97/19/1409139719.db2.gz MBWMOCASTODXQY-NRFANRHFSA-N 2 1 395.547 3.155 20 0 GGADMP CN(C)C(=O)COc1ccccc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000067507083 1409139725 /nfs/dbraw/zinc/13/97/25/1409139725.db2.gz MBWMOCASTODXQY-NRFANRHFSA-N 2 1 395.547 3.155 20 0 GGADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000067507198 1409140209 /nfs/dbraw/zinc/14/02/09/1409140209.db2.gz XXAGOLKDRYJPPN-QGZVFWFLSA-N 2 1 384.524 3.068 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC2CC[NH+](CC(C)C)CC2)cc1F ZINC000067646243 1409196081 /nfs/dbraw/zinc/19/60/81/1409196081.db2.gz BTYDFURNZGHMTB-UHFFFAOYSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)cc1F ZINC000067646525 1409196184 /nfs/dbraw/zinc/19/61/84/1409196184.db2.gz ZPPBIHKAXSJECQ-JKSUJKDBSA-N 2 1 387.503 3.382 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1F ZINC000067646525 1409196189 /nfs/dbraw/zinc/19/61/89/1409196189.db2.gz ZPPBIHKAXSJECQ-JKSUJKDBSA-N 2 1 387.503 3.382 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000067658387 1409199424 /nfs/dbraw/zinc/19/94/24/1409199424.db2.gz ZRPOMNSQALIKGD-QHCPKHFHSA-N 2 1 392.547 3.350 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)C1 ZINC000067683792 1409206460 /nfs/dbraw/zinc/20/64/60/1409206460.db2.gz YVGSHISVXPARFL-PMACEKPBSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000067683792 1409206468 /nfs/dbraw/zinc/20/64/68/1409206468.db2.gz YVGSHISVXPARFL-PMACEKPBSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000067683792 1409206473 /nfs/dbraw/zinc/20/64/73/1409206473.db2.gz YVGSHISVXPARFL-PMACEKPBSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)C1 ZINC000067684342 1409206536 /nfs/dbraw/zinc/20/65/36/1409206536.db2.gz RUQQKJIAEONATQ-UGKGYDQZSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000067684342 1409206541 /nfs/dbraw/zinc/20/65/41/1409206541.db2.gz RUQQKJIAEONATQ-UGKGYDQZSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000067684342 1409206547 /nfs/dbraw/zinc/20/65/47/1409206547.db2.gz RUQQKJIAEONATQ-UGKGYDQZSA-N 2 1 386.584 3.448 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](C2CCCC2)CC1 ZINC000067734556 1409217384 /nfs/dbraw/zinc/21/73/84/1409217384.db2.gz RGBBJRIICMHQPQ-NRFANRHFSA-N 2 1 384.568 3.168 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H]1CCCC[NH+]1CC ZINC000176628491 1428384148 /nfs/dbraw/zinc/38/41/48/1428384148.db2.gz BGAHIBQDHQARIK-FGZHOGPDSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@H]1CCCC[N@@H+]1CC ZINC000176628491 1428384154 /nfs/dbraw/zinc/38/41/54/1428384154.db2.gz BGAHIBQDHQARIK-FGZHOGPDSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@H]1CCCC[N@H+]1CC ZINC000176628491 1428384162 /nfs/dbraw/zinc/38/41/62/1428384162.db2.gz BGAHIBQDHQARIK-FGZHOGPDSA-N 2 1 386.584 3.414 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000067772750 1409227114 /nfs/dbraw/zinc/22/71/14/1409227114.db2.gz KHUTYGSSBROXAS-FQEVSTJZSA-N 2 1 384.524 3.094 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc(-n4cccn4)cc3)c2)CCO1 ZINC000067976554 1409267480 /nfs/dbraw/zinc/26/74/80/1409267480.db2.gz UXCLQZTXOMKJJQ-IBGZPJMESA-N 2 1 376.504 3.383 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(-n4cccn4)cc3)c2)CCO1 ZINC000067976554 1409267483 /nfs/dbraw/zinc/26/74/83/1409267483.db2.gz UXCLQZTXOMKJJQ-IBGZPJMESA-N 2 1 376.504 3.383 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N(C)CC[N@H+](C)C3CCCCC3)CC2)cs1 ZINC000068309553 1409360201 /nfs/dbraw/zinc/36/02/01/1409360201.db2.gz SQBMSDGBTQNKDI-UHFFFAOYSA-N 2 1 392.613 3.386 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N(C)CC[N@@H+](C)C3CCCCC3)CC2)cs1 ZINC000068309553 1409360204 /nfs/dbraw/zinc/36/02/04/1409360204.db2.gz SQBMSDGBTQNKDI-UHFFFAOYSA-N 2 1 392.613 3.386 20 0 GGADMP CCCC[N@@H+]1CCCC[C@H]1CNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000068325385 1409367017 /nfs/dbraw/zinc/36/70/17/1409367017.db2.gz BFTAAOSZWNLQKZ-FQEVSTJZSA-N 2 1 392.613 3.434 20 0 GGADMP CCCC[N@H+]1CCCC[C@H]1CNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000068325385 1409367024 /nfs/dbraw/zinc/36/70/24/1409367024.db2.gz BFTAAOSZWNLQKZ-FQEVSTJZSA-N 2 1 392.613 3.434 20 0 GGADMP O=C(NCC[NH+]1Cc2ccccc2C1)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000068406695 1409393454 /nfs/dbraw/zinc/39/34/54/1409393454.db2.gz WORVQOHUQJSOHO-UHFFFAOYSA-N 2 1 392.547 3.009 20 0 GGADMP CC[NH+](CC)Cc1ccccc1CNC(=O)NCC[NH+]1Cc2ccccc2C1 ZINC000068406773 1409393644 /nfs/dbraw/zinc/39/36/44/1409393644.db2.gz LMTOLHLBTYDAFF-UHFFFAOYSA-N 2 1 380.536 3.343 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N(CC[NH+](C)C)c3ccccc3)CC2)cs1 ZINC000068422667 1409397685 /nfs/dbraw/zinc/39/76/85/1409397685.db2.gz HDCLMSIMWHGZEQ-UHFFFAOYSA-N 2 1 386.565 3.258 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000068442987 1409404355 /nfs/dbraw/zinc/40/43/55/1409404355.db2.gz JCFQJBBGBMXXMA-OALUTQOASA-N 2 1 387.568 3.290 20 0 GGADMP CC[NH+](CC)CC(=O)N1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000068444103 1409404407 /nfs/dbraw/zinc/40/44/07/1409404407.db2.gz HLSQOVVYENDJBE-UHFFFAOYSA-N 2 1 385.474 3.470 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000068449855 1409405784 /nfs/dbraw/zinc/40/57/84/1409405784.db2.gz CLBCSHNWUMIKOT-IBGZPJMESA-N 2 1 375.532 3.418 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)C2CC[NH+](Cc3csc(C)n3)CC2)CC1 ZINC000068450119 1409406554 /nfs/dbraw/zinc/40/65/54/1409406554.db2.gz RTJSDSBJGILSIC-UHFFFAOYSA-N 2 1 378.586 3.044 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)C1 ZINC000068581852 1409444705 /nfs/dbraw/zinc/44/47/05/1409444705.db2.gz IPKNEGGPDPIKSA-LJQANCHMSA-N 2 1 392.563 3.411 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)C1 ZINC000068581858 1409444733 /nfs/dbraw/zinc/44/47/33/1409444733.db2.gz IPKNEGGPDPIKSA-IBGZPJMESA-N 2 1 392.563 3.411 20 0 GGADMP O=C(NCC[NH+]1Cc2ccccc2C1)NCc1ccccc1C[NH+]1CCCC1 ZINC000068639910 1409453511 /nfs/dbraw/zinc/45/35/11/1409453511.db2.gz PIRCZNIIZSRXLK-UHFFFAOYSA-N 2 1 378.520 3.097 20 0 GGADMP C[C@@H]1C[NH+](CC2CC[NH+](CC(=O)N[C@@H](c3ccccc3)C3CC3)CC2)C[C@@H](C)O1 ZINC000069017145 1409544267 /nfs/dbraw/zinc/54/42/67/1409544267.db2.gz IDFAIAKNKBGLIN-IECBHUPTSA-N 2 1 399.579 3.075 20 0 GGADMP Cc1cc(C)c(NC(=O)C[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c(C)c1 ZINC000069017210 1409544938 /nfs/dbraw/zinc/54/49/38/1409544938.db2.gz XEZCHWKDYJCZOM-WOJBJXKFSA-N 2 1 387.568 3.372 20 0 GGADMP Cc1cc(Cl)ccc1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069029064 1409546659 /nfs/dbraw/zinc/54/66/59/1409546659.db2.gz BVEDDIVCJCZXJB-INIZCTEOSA-N 2 1 379.932 3.020 20 0 GGADMP O=C(Nc1ccccc1)[C@@H](c1ccccc1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069029399 1409547510 /nfs/dbraw/zinc/54/75/10/1409547510.db2.gz AOZBFJMKEYLNGZ-HSZRJFAPSA-N 2 1 393.531 3.411 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@@H+](C(C)(C)C)CC3)cc2)C[C@@H](C)O1 ZINC000069047430 1409553361 /nfs/dbraw/zinc/55/33/61/1409553361.db2.gz LMZZTQKZCXSQQX-RTBURBONSA-N 2 1 387.568 3.242 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@H+](C(C)(C)C)CC3)cc2)C[C@@H](C)O1 ZINC000069047430 1409553364 /nfs/dbraw/zinc/55/33/64/1409553364.db2.gz LMZZTQKZCXSQQX-RTBURBONSA-N 2 1 387.568 3.242 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2C[NH2+]Cc2ccc3c(c2)OCCO3)C[C@H](C)O1 ZINC000069833274 1409711702 /nfs/dbraw/zinc/71/17/02/1409711702.db2.gz HCCOYCVPZKKTHX-HDICACEKSA-N 2 1 382.504 3.357 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)CC2([NH+]3CCOCC3)CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000176720306 1428433373 /nfs/dbraw/zinc/43/33/73/1428433373.db2.gz WAMHKOVIGILPIM-UNMCSNQZSA-N 2 1 399.579 3.191 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000072025992 1409838244 /nfs/dbraw/zinc/83/82/44/1409838244.db2.gz FGQIGYXLQXHLCC-KURKYZTESA-N 2 1 378.586 3.305 20 0 GGADMP O=C(NCC1([NH+]2CCSCC2)CCCC1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000072027849 1409838788 /nfs/dbraw/zinc/83/87/88/1409838788.db2.gz WRFSBJDAQYXMQT-FQEVSTJZSA-N 2 1 387.593 3.129 20 0 GGADMP c1ccc(CN2CCO[C@H](C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)C2)cc1 ZINC000072725915 1409853026 /nfs/dbraw/zinc/85/30/26/1409853026.db2.gz KBBZDZOOONJOEJ-XMMPIXPASA-N 2 1 379.548 3.142 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000073495256 1409861659 /nfs/dbraw/zinc/86/16/59/1409861659.db2.gz DPLCQEHPWSOWGI-KRWDZBQOSA-N 2 1 375.542 3.170 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000073620355 1409863331 /nfs/dbraw/zinc/86/33/31/1409863331.db2.gz UCJOCYKBFWHSHW-YADHBBJMSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CCC[NH+]2Cc2ccccn2)C1 ZINC000073670469 1409864090 /nfs/dbraw/zinc/86/40/90/1409864090.db2.gz ATXXFMUFHGDTLT-URVUXULASA-N 2 1 384.568 3.159 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CCC[NH+]2Cc2ccccn2)C1 ZINC000073670469 1409864094 /nfs/dbraw/zinc/86/40/94/1409864094.db2.gz ATXXFMUFHGDTLT-URVUXULASA-N 2 1 384.568 3.159 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(C(=O)[C@@H]2CCC[N@@H+]2Cc2ccccn2)C1 ZINC000073670469 1409864095 /nfs/dbraw/zinc/86/40/95/1409864095.db2.gz ATXXFMUFHGDTLT-URVUXULASA-N 2 1 384.568 3.159 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(C(=O)[C@@H]2CCC[N@H+]2Cc2ccccn2)C1 ZINC000073670469 1409864096 /nfs/dbraw/zinc/86/40/96/1409864096.db2.gz ATXXFMUFHGDTLT-URVUXULASA-N 2 1 384.568 3.159 20 0 GGADMP C[C@H](CNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[N@@H+]1CCc2sccc2C1 ZINC000073679458 1409864216 /nfs/dbraw/zinc/86/42/16/1409864216.db2.gz JACJYCNQPZWUGU-CQSZACIVSA-N 2 1 378.586 3.103 20 0 GGADMP C[C@H](CNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[N@H+]1CCc2sccc2C1 ZINC000073679458 1409864218 /nfs/dbraw/zinc/86/42/18/1409864218.db2.gz JACJYCNQPZWUGU-CQSZACIVSA-N 2 1 378.586 3.103 20 0 GGADMP C[C@@H](CNC(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C)[NH+]1CCc2sccc2C1 ZINC000073725377 1409864869 /nfs/dbraw/zinc/86/48/69/1409864869.db2.gz HTYHSMWMOCQRKM-WMZOPIPTSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C)[NH+]1CCc2sccc2C1 ZINC000073725377 1409864873 /nfs/dbraw/zinc/86/48/73/1409864873.db2.gz HTYHSMWMOCQRKM-WMZOPIPTSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(C)CC[C@@H]1CCCC[NH+]1C)[N@@H+]1CCc2sccc2C1 ZINC000073725377 1409864874 /nfs/dbraw/zinc/86/48/74/1409864874.db2.gz HTYHSMWMOCQRKM-WMZOPIPTSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(C)CC[C@@H]1CCCC[NH+]1C)[N@H+]1CCc2sccc2C1 ZINC000073725377 1409864876 /nfs/dbraw/zinc/86/48/76/1409864876.db2.gz HTYHSMWMOCQRKM-WMZOPIPTSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C[NH+]1CCCCC1 ZINC000073788441 1409865502 /nfs/dbraw/zinc/86/55/02/1409865502.db2.gz PCKODLNPXHAYAN-RBBKRZOGSA-N 2 1 386.584 3.272 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C[NH+]1CCCCC1 ZINC000073788438 1409865512 /nfs/dbraw/zinc/86/55/12/1409865512.db2.gz PCKODLNPXHAYAN-IRLDBZIGSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000073874629 1409866393 /nfs/dbraw/zinc/86/63/93/1409866393.db2.gz SQPIPSSPKHLPRV-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(C)CC1 ZINC000073897634 1409866638 /nfs/dbraw/zinc/86/66/38/1409866638.db2.gz YTJXAELURZGHEF-RBBKRZOGSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](CNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(C)CC1 ZINC000073897632 1409866830 /nfs/dbraw/zinc/86/68/30/1409866830.db2.gz YTJXAELURZGHEF-IRLDBZIGSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)CC1 ZINC000074008402 1409868592 /nfs/dbraw/zinc/86/85/92/1409868592.db2.gz GVJSKQOQIYWALT-UXHICEINSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CC[C@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000074103604 1409869540 /nfs/dbraw/zinc/86/95/40/1409869540.db2.gz ZSEVEIKWXIPEFS-UNMCSNQZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000074103604 1409869542 /nfs/dbraw/zinc/86/95/42/1409869542.db2.gz ZSEVEIKWXIPEFS-UNMCSNQZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)C1 ZINC000074103604 1409869543 /nfs/dbraw/zinc/86/95/43/1409869543.db2.gz ZSEVEIKWXIPEFS-UNMCSNQZSA-N 2 1 386.584 3.413 20 0 GGADMP CC[NH+](CC)CCSCC(=O)N1CC[C@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC000074193517 1409870379 /nfs/dbraw/zinc/87/03/79/1409870379.db2.gz CNJVCVQZSFIEOE-IBGZPJMESA-N 2 1 377.598 3.184 20 0 GGADMP CCc1ccc([C@@H](CNC(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)[NH+](C)C)cc1 ZINC000074833175 1409877149 /nfs/dbraw/zinc/87/71/49/1409877149.db2.gz GMTJJQWYKGQYOL-RBBKRZOGSA-N 2 1 386.584 3.225 20 0 GGADMP CC(C)[C@@H](CNC(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1)[NH+]1CCC(C)CC1 ZINC000074850592 1409877552 /nfs/dbraw/zinc/87/75/52/1409877552.db2.gz LBZMHKBRHFCGHD-LEWJYISDSA-N 2 1 378.605 3.116 20 0 GGADMP C[C@@H]([NH2+]C(C)(C)CNC(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1)c1ccccc1 ZINC000074891290 1409878691 /nfs/dbraw/zinc/87/86/91/1409878691.db2.gz JEPAYFNYGPWJCX-QUCCMNQESA-N 2 1 386.584 3.489 20 0 GGADMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@H](C[NH+](C)CC3CC3)C2)C1 ZINC000074879574 1409878796 /nfs/dbraw/zinc/87/87/96/1409878796.db2.gz HUBGGQBCHBIUMN-AZUAARDMSA-N 2 1 378.605 3.260 20 0 GGADMP CC[C@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)C1 ZINC000074879574 1409878797 /nfs/dbraw/zinc/87/87/97/1409878797.db2.gz HUBGGQBCHBIUMN-AZUAARDMSA-N 2 1 378.605 3.260 20 0 GGADMP CC[C@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)C1 ZINC000074879574 1409878800 /nfs/dbraw/zinc/87/88/00/1409878800.db2.gz HUBGGQBCHBIUMN-AZUAARDMSA-N 2 1 378.605 3.260 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(C)cc2C)CC1 ZINC000075007487 1409879953 /nfs/dbraw/zinc/87/99/53/1409879953.db2.gz SUPHUJPTFDENOC-IBGZPJMESA-N 2 1 375.557 3.453 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(C)c(F)c2)CC1 ZINC000075007555 1409880038 /nfs/dbraw/zinc/88/00/38/1409880038.db2.gz VDIFPYUPEMHXBP-KRWDZBQOSA-N 2 1 379.520 3.284 20 0 GGADMP CCc1cccc(C)c1NC(=O)C[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000075007642 1409880096 /nfs/dbraw/zinc/88/00/96/1409880096.db2.gz RCWIIDBIEVAGIQ-UHFFFAOYSA-N 2 1 375.557 3.319 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)C(=O)Nc2cccc(C)c2C)CC1 ZINC000075007733 1409880206 /nfs/dbraw/zinc/88/02/06/1409880206.db2.gz FSMKUBUEIBCNGP-LJQANCHMSA-N 2 1 375.557 3.453 20 0 GGADMP C[C@H](c1c(F)cccc1F)[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000076324911 1409887569 /nfs/dbraw/zinc/88/75/69/1409887569.db2.gz PZJBEAKKRUUJNE-OAHLLOKOSA-N 2 1 381.511 3.442 20 0 GGADMP C[C@@H](c1c(F)cccc1F)[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000076324907 1409887688 /nfs/dbraw/zinc/88/76/88/1409887688.db2.gz PZJBEAKKRUUJNE-HNNXBMFYSA-N 2 1 381.511 3.442 20 0 GGADMP CN1CC[NH+](Cc2cccc(C[NH2+]Cc3ccc(OC(F)F)cc3)c2)CC1 ZINC000076400241 1409888472 /nfs/dbraw/zinc/88/84/72/1409888472.db2.gz KOHIMRFXEVSSNL-UHFFFAOYSA-N 2 1 375.463 3.325 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CCC(=O)Nc2ccc3c(c2)OCO3)CC1 ZINC000076776604 1409891318 /nfs/dbraw/zinc/89/13/18/1409891318.db2.gz QPBITIUPZZFMJH-UHFFFAOYSA-N 2 1 375.513 3.188 20 0 GGADMP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000076763090 1409891477 /nfs/dbraw/zinc/89/14/77/1409891477.db2.gz OEKZVSQGQSUWRI-OAQYLSRUSA-N 2 1 382.552 3.139 20 0 GGADMP Cc1nc(N2CCCCC2)sc1C[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000076763119 1409891563 /nfs/dbraw/zinc/89/15/63/1409891563.db2.gz RNKMWPPKPJKVCW-QGZVFWFLSA-N 2 1 378.586 3.032 20 0 GGADMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH+]2CCC[C@@H]2c2ccc[nH]2)CC1 ZINC000077171290 1409893857 /nfs/dbraw/zinc/89/38/57/1409893857.db2.gz CWSKORAWZPMJTH-JOCHJYFZSA-N 2 1 380.536 3.195 20 0 GGADMP Cc1ccccc1C[N@H+]1CCCN(C(=O)C[NH+]2CCC[C@@H]2c2ccc[nH]2)CC1 ZINC000077171290 1409893858 /nfs/dbraw/zinc/89/38/58/1409893858.db2.gz CWSKORAWZPMJTH-JOCHJYFZSA-N 2 1 380.536 3.195 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)CC1 ZINC000077171290 1409893861 /nfs/dbraw/zinc/89/38/61/1409893861.db2.gz CWSKORAWZPMJTH-JOCHJYFZSA-N 2 1 380.536 3.195 20 0 GGADMP Cc1ccccc1C[NH+]1CCCN(C(=O)C[N@H+]2CCC[C@@H]2c2ccc[nH]2)CC1 ZINC000077171290 1409893863 /nfs/dbraw/zinc/89/38/63/1409893863.db2.gz CWSKORAWZPMJTH-JOCHJYFZSA-N 2 1 380.536 3.195 20 0 GGADMP CCCC[N@@H+](C)CCNC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000077695211 1409898912 /nfs/dbraw/zinc/89/89/12/1409898912.db2.gz DHQRPDOPGOYFJK-UHFFFAOYSA-N 2 1 378.586 3.131 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000077712092 1409898972 /nfs/dbraw/zinc/89/89/72/1409898972.db2.gz KYIPNYMGSMSQHN-QFIPXVFZSA-N 2 1 380.536 3.212 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)N1CCC[NH+]2CCC[C@@H]2C1 ZINC000077763979 1409899703 /nfs/dbraw/zinc/89/97/03/1409899703.db2.gz VFXOBUFWHLWUMP-DENIHFKCSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N1CCC[N@@H+]2CCC[C@@H]2C1 ZINC000077763979 1409899704 /nfs/dbraw/zinc/89/97/04/1409899704.db2.gz VFXOBUFWHLWUMP-DENIHFKCSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000077763979 1409899706 /nfs/dbraw/zinc/89/97/06/1409899706.db2.gz VFXOBUFWHLWUMP-DENIHFKCSA-N 2 1 384.568 3.441 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CCC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000077763954 1409899903 /nfs/dbraw/zinc/89/99/03/1409899903.db2.gz HNLZXCYPEDTBIQ-JOCHJYFZSA-N 2 1 384.568 3.298 20 0 GGADMP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000077799926 1409901828 /nfs/dbraw/zinc/90/18/28/1409901828.db2.gz KYDRYHBVXPNHBB-QFIPXVFZSA-N 2 1 384.568 3.442 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000077811151 1409901971 /nfs/dbraw/zinc/90/19/71/1409901971.db2.gz UNAPDHMOCNOJBK-UNMCSNQZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000077811151 1409901980 /nfs/dbraw/zinc/90/19/80/1409901980.db2.gz UNAPDHMOCNOJBK-UNMCSNQZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000077811151 1409901990 /nfs/dbraw/zinc/90/19/90/1409901990.db2.gz UNAPDHMOCNOJBK-UNMCSNQZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000078522877 1409924042 /nfs/dbraw/zinc/92/40/42/1409924042.db2.gz BREFJFJZYVWGHK-MSOLQXFVSA-N 2 1 378.586 3.305 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@H+]1CCCC[C@H]1C ZINC000078668227 1409932006 /nfs/dbraw/zinc/93/20/06/1409932006.db2.gz MWVWRDDXABDLKU-UXHICEINSA-N 2 1 386.584 3.256 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CCC([NH+]2CCCCC2)CC1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000079640838 1409984709 /nfs/dbraw/zinc/98/47/09/1409984709.db2.gz VXQGYHXVXUGUJM-SNPVATIESA-N 2 1 379.589 3.034 20 0 GGADMP O=C(NC1CCC([NH+]2CCCCC2)CC1)[C@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC000079991721 1409996297 /nfs/dbraw/zinc/99/62/97/1409996297.db2.gz POLKOPPLGWGNJQ-LZBANZJXSA-N 2 1 384.568 3.349 20 0 GGADMP O=C(NC1CCC([NH+]2CCCCC2)CC1)[C@H]1CCCC[N@H+]1Cc1cccnc1 ZINC000079991721 1409996303 /nfs/dbraw/zinc/99/63/03/1409996303.db2.gz POLKOPPLGWGNJQ-LZBANZJXSA-N 2 1 384.568 3.349 20 0 GGADMP O=C(NC1CCC([NH+]2CCCCC2)CC1)[C@@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC000079991723 1409996881 /nfs/dbraw/zinc/99/68/81/1409996881.db2.gz POLKOPPLGWGNJQ-HRTMPFAESA-N 2 1 384.568 3.349 20 0 GGADMP O=C(NC1CCC([NH+]2CCCCC2)CC1)[C@@H]1CCCC[N@H+]1Cc1cccnc1 ZINC000079991723 1409996892 /nfs/dbraw/zinc/99/68/92/1409996892.db2.gz POLKOPPLGWGNJQ-HRTMPFAESA-N 2 1 384.568 3.349 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000080064803 1409999678 /nfs/dbraw/zinc/99/96/78/1409999678.db2.gz JLEHVGQXXOWNEX-UGKGYDQZSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CC[C@H]([NH+]3CCCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000080164987 1410001742 /nfs/dbraw/zinc/00/17/42/1410001742.db2.gz CANVQDIMRGSKLC-HJNYFJLDSA-N 2 1 384.568 3.309 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)NC1CCC([NH+]2CCCCC2)CC1 ZINC000080157095 1410001836 /nfs/dbraw/zinc/00/18/36/1410001836.db2.gz PWFYZKOUMHMBFT-NYLDSWQDSA-N 2 1 376.589 3.347 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)N2CC[NH+](C3CCCC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000080165726 1410002145 /nfs/dbraw/zinc/00/21/45/1410002145.db2.gz SZOUCCJXDPNBQM-FPOVZHCZSA-N 2 1 384.568 3.309 20 0 GGADMP CC(C)CC[NH+]1CCC(CNC(=O)N2CCC[N@H+](C3CCCC3)CC2)CC1 ZINC000080218853 1410003638 /nfs/dbraw/zinc/00/36/38/1410003638.db2.gz MJFHNQZMWIXBCN-UHFFFAOYSA-N 2 1 378.605 3.404 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000080553156 1410007530 /nfs/dbraw/zinc/00/75/30/1410007530.db2.gz ONUFKBFIBJWHQY-OAQYLSRUSA-N 2 1 375.532 3.418 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000080553156 1410007541 /nfs/dbraw/zinc/00/75/41/1410007541.db2.gz ONUFKBFIBJWHQY-OAQYLSRUSA-N 2 1 375.532 3.418 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(C)c(C)c2)CC1 ZINC000080650287 1410009310 /nfs/dbraw/zinc/00/93/10/1410009310.db2.gz IAASRJSEENGGDL-IBGZPJMESA-N 2 1 375.557 3.453 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000080655926 1410009485 /nfs/dbraw/zinc/00/94/85/1410009485.db2.gz VORUVWAIFZHOOV-OAQYLSRUSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000080655926 1410009492 /nfs/dbraw/zinc/00/94/92/1410009492.db2.gz VORUVWAIFZHOOV-OAQYLSRUSA-N 2 1 375.532 3.417 20 0 GGADMP CC1CC[NH+](C[C@H]2CCCN(C(=O)[C@H]3CCC[N@@H+]3Cc3ccccn3)C2)CC1 ZINC000081023366 1410013871 /nfs/dbraw/zinc/01/38/71/1410013871.db2.gz HEPWJVBWANQNEU-IFMALSPDSA-N 2 1 384.568 3.017 20 0 GGADMP CC1CC[NH+](C[C@H]2CCCN(C(=O)[C@H]3CCC[N@H+]3Cc3ccccn3)C2)CC1 ZINC000081023366 1410013881 /nfs/dbraw/zinc/01/38/81/1410013881.db2.gz HEPWJVBWANQNEU-IFMALSPDSA-N 2 1 384.568 3.017 20 0 GGADMP CC[NH+](CC)C[C@H]1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000081333734 1410018042 /nfs/dbraw/zinc/01/80/42/1410018042.db2.gz AHSHVLMUEYJLDV-WOJBJXKFSA-N 2 1 375.532 3.228 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(N3CC[NH+](C(C)C)CC3)cc2)C1 ZINC000081361705 1410018547 /nfs/dbraw/zinc/01/85/47/1410018547.db2.gz URGGJSWYLZYNIF-FQEVSTJZSA-N 2 1 386.584 3.021 20 0 GGADMP CC(C)c1[nH+]ccn1CCC(=O)NCC1([NH+]2CCSCC2)CCCCC1 ZINC000081386517 1410019466 /nfs/dbraw/zinc/01/94/66/1410019466.db2.gz GVDOCYASBSLXAX-UHFFFAOYSA-N 2 1 378.586 3.265 20 0 GGADMP CC(C)[N@H+](C)CC1CCN(C(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)CC1 ZINC000081592295 1410022369 /nfs/dbraw/zinc/02/23/69/1410022369.db2.gz JIXYLUBZLKJVJI-NRFANRHFSA-N 2 1 375.532 3.369 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)CC1 ZINC000081592295 1410022377 /nfs/dbraw/zinc/02/23/77/1410022377.db2.gz JIXYLUBZLKJVJI-NRFANRHFSA-N 2 1 375.532 3.369 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000081592295 1410022386 /nfs/dbraw/zinc/02/23/86/1410022386.db2.gz JIXYLUBZLKJVJI-NRFANRHFSA-N 2 1 375.532 3.369 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000081592295 1410022398 /nfs/dbraw/zinc/02/23/98/1410022398.db2.gz JIXYLUBZLKJVJI-NRFANRHFSA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+](C)CCN(Cc1cccs1)C(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000084442091 1410036581 /nfs/dbraw/zinc/03/65/81/1410036581.db2.gz SVCZNCKZYHUDOZ-GOSISDBHSA-N 2 1 378.586 3.086 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N(C)[C@@H]3CC[N@@H+](C)C[C@@H]3C)cc2)CC1 ZINC000085389926 1410040593 /nfs/dbraw/zinc/04/05/93/1410040593.db2.gz WGMAYKYXMSYYRR-SIKLNZKXSA-N 2 1 386.584 3.400 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CN(Cc4ccccc4)C[C@@H]3C)CC2)nc(C)[nH+]1 ZINC000088740733 1410050914 /nfs/dbraw/zinc/05/09/14/1410050914.db2.gz UOSATOYXWPFNGL-HTAPYJJXSA-N 2 1 379.552 3.172 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H]3CCN([C@@H](C)c4ccccc4)C3)CC2)nc(C)[nH+]1 ZINC000088740727 1410050982 /nfs/dbraw/zinc/05/09/82/1410050982.db2.gz HJXJLJGZLBBGGC-AVRDEDQJSA-N 2 1 379.552 3.487 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(F)cc1)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000089594877 1410055671 /nfs/dbraw/zinc/05/56/71/1410055671.db2.gz BOHYAOHMNDTOAW-QGZVFWFLSA-N 2 1 377.504 3.168 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(F)cc1)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000089594876 1410056051 /nfs/dbraw/zinc/05/60/51/1410056051.db2.gz BOHYAOHMNDTOAW-KRWDZBQOSA-N 2 1 377.504 3.168 20 0 GGADMP CC(C)[C@H]([NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C(=O)N1CCCC1 ZINC000089722964 1410056440 /nfs/dbraw/zinc/05/64/40/1410056440.db2.gz HJFOLWPCYPJQFT-NRFANRHFSA-N 2 1 375.532 3.069 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H](C)[C@@H](OC2CCOCC2)c2ccccc2)CC1 ZINC000090605069 1410065607 /nfs/dbraw/zinc/06/56/07/1410065607.db2.gz NRUBBSOKCRLFSL-XMSQKQJNSA-N 2 1 376.541 3.012 20 0 GGADMP COCC[NH+]1CCC([NH2+][C@H](C)[C@H](OC2CCOCC2)c2ccccc2)CC1 ZINC000090605066 1410066107 /nfs/dbraw/zinc/06/61/07/1410066107.db2.gz NRUBBSOKCRLFSL-GCJKJVERSA-N 2 1 376.541 3.012 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@@H+]3C[C@@H]4CCCC[C@@]43c3ccccc3)cn2)CC1 ZINC000091963556 1410095310 /nfs/dbraw/zinc/09/53/10/1410095310.db2.gz ZOFJEPUSTYSVHD-JTHBVZDNSA-N 2 1 377.536 3.130 20 0 GGADMP C[NH+]1CCN(c2ncc(C[N@H+]3C[C@@H]4CCCC[C@@]43c3ccccc3)cn2)CC1 ZINC000091963556 1410095315 /nfs/dbraw/zinc/09/53/15/1410095315.db2.gz ZOFJEPUSTYSVHD-JTHBVZDNSA-N 2 1 377.536 3.130 20 0 GGADMP C#Cc1cccc(NC(=O)C[N@@H+](C)Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000092143931 1410111284 /nfs/dbraw/zinc/11/12/84/1410111284.db2.gz LYSVJBWPKQIUOY-UHFFFAOYSA-N 2 1 391.515 3.213 20 0 GGADMP C#Cc1cccc(NC(=O)C[N@H+](C)Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000092143931 1410111290 /nfs/dbraw/zinc/11/12/90/1410111290.db2.gz LYSVJBWPKQIUOY-UHFFFAOYSA-N 2 1 391.515 3.213 20 0 GGADMP CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000092400058 1410150311 /nfs/dbraw/zinc/15/03/11/1410150311.db2.gz QHSSCPYOIXFYIG-AZUAARDMSA-N 2 1 375.557 3.144 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2cccc(Cl)c2F)CC1 ZINC000092427057 1410157300 /nfs/dbraw/zinc/15/73/00/1410157300.db2.gz VMZXIKQIICLIOP-UHFFFAOYSA-N 2 1 383.939 3.395 20 0 GGADMP CC[C@H](C)[N@@H+](C)CCNC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092488851 1410162565 /nfs/dbraw/zinc/16/25/65/1410162565.db2.gz HZYPBDVHRGZDND-SFHVURJKSA-N 2 1 375.561 3.060 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NC[C@@H](C3CCCCC3)[NH+](C)C)CC2)[nH+]c1 ZINC000176787650 1428461605 /nfs/dbraw/zinc/46/16/05/1428461605.db2.gz JQEXLHMEOFRPLO-FQEVSTJZSA-N 2 1 387.572 3.169 20 0 GGADMP CC[C@@H](c1ccccc1)[C@@H]1CCC[N@@H+]1Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092644320 1410180825 /nfs/dbraw/zinc/18/08/25/1410180825.db2.gz FDFNHZXGCIWLTM-VXKWHMMOSA-N 2 1 379.552 3.387 20 0 GGADMP CC[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000092644320 1410180835 /nfs/dbraw/zinc/18/08/35/1410180835.db2.gz FDFNHZXGCIWLTM-VXKWHMMOSA-N 2 1 379.552 3.387 20 0 GGADMP Cc1cccc(-c2n[nH]cc2C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000092665283 1410184992 /nfs/dbraw/zinc/18/49/92/1410184992.db2.gz CYZRWMLQJATUDP-BGYRXZFFSA-N 2 1 381.568 3.376 20 0 GGADMP Cc1cccc(-c2n[nH]cc2C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000092665283 1410185002 /nfs/dbraw/zinc/18/50/02/1410185002.db2.gz CYZRWMLQJATUDP-BGYRXZFFSA-N 2 1 381.568 3.376 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](Cc2ccc(OCC(F)F)cc2)CC1 ZINC000092664806 1410185215 /nfs/dbraw/zinc/18/52/15/1410185215.db2.gz QVLYLOLCRLUIGH-HDICACEKSA-N 2 1 381.511 3.321 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](Cc2ccc(OCC(F)F)cc2)CC1 ZINC000092664806 1410185222 /nfs/dbraw/zinc/18/52/22/1410185222.db2.gz QVLYLOLCRLUIGH-HDICACEKSA-N 2 1 381.511 3.321 20 0 GGADMP C[C@@H]1CC[C@@H](C)[NH+]1CCN1CC[NH+](Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000092666100 1410186690 /nfs/dbraw/zinc/18/66/90/1410186690.db2.gz GKUAVMYWZFIVLH-WOJBJXKFSA-N 2 1 395.551 3.259 20 0 GGADMP Cc1ccc(CNC(=O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000092821129 1410203986 /nfs/dbraw/zinc/20/39/86/1410203986.db2.gz LBXFENLHVDSRKE-UHFFFAOYSA-N 2 1 380.536 3.245 20 0 GGADMP CN(Cc1ccccc1)C(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092821061 1410204116 /nfs/dbraw/zinc/20/41/16/1410204116.db2.gz KPFUZIWJJMCIKH-UHFFFAOYSA-N 2 1 380.536 3.279 20 0 GGADMP C[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cccc(-c4ccncc4)c3)CC2)CC1 ZINC000093142736 1410226286 /nfs/dbraw/zinc/22/62/86/1410226286.db2.gz AXOIEWJGKFURKL-UHFFFAOYSA-N 2 1 392.547 3.125 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cccc4c3OC(C)(C)C4)CC2)CC1 ZINC000093141623 1410226757 /nfs/dbraw/zinc/22/67/57/1410226757.db2.gz JZPUOADUSBCRLL-UHFFFAOYSA-N 2 1 399.579 3.166 20 0 GGADMP Cn1cc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000093336824 1410235326 /nfs/dbraw/zinc/23/53/26/1410235326.db2.gz CHBRDACZSBYJCA-FQEVSTJZSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000093336824 1410235330 /nfs/dbraw/zinc/23/53/30/1410235330.db2.gz CHBRDACZSBYJCA-FQEVSTJZSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000093336824 1410235333 /nfs/dbraw/zinc/23/53/33/1410235333.db2.gz CHBRDACZSBYJCA-FQEVSTJZSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000093336824 1410235335 /nfs/dbraw/zinc/23/53/35/1410235335.db2.gz CHBRDACZSBYJCA-FQEVSTJZSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000093336982 1410235391 /nfs/dbraw/zinc/23/53/91/1410235391.db2.gz LNUXQQCPQQVFLR-FQEVSTJZSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000093336982 1410235393 /nfs/dbraw/zinc/23/53/93/1410235393.db2.gz LNUXQQCPQQVFLR-FQEVSTJZSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000093336982 1410235397 /nfs/dbraw/zinc/23/53/97/1410235397.db2.gz LNUXQQCPQQVFLR-FQEVSTJZSA-N 2 1 375.520 3.436 20 0 GGADMP Cn1cc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000093336982 1410235400 /nfs/dbraw/zinc/23/54/00/1410235400.db2.gz LNUXQQCPQQVFLR-FQEVSTJZSA-N 2 1 375.520 3.436 20 0 GGADMP COc1ccc([C@H](CO)[N@@H+](C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000093415602 1410244729 /nfs/dbraw/zinc/24/47/29/1410244729.db2.gz JVVUHOVUJUQKNX-DEOSSOPVSA-N 2 1 397.563 3.391 20 0 GGADMP Cn1ccnc1[C@H](O)C1CC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000093454838 1410246930 /nfs/dbraw/zinc/24/69/30/1410246930.db2.gz GQLVRACOMGEOGR-OAQYLSRUSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@@H](O)C1CC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000093454837 1410247051 /nfs/dbraw/zinc/24/70/51/1410247051.db2.gz GQLVRACOMGEOGR-NRFANRHFSA-N 2 1 384.568 3.324 20 0 GGADMP O=C(COc1ccccc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)NCC1CC1 ZINC000093563969 1410253699 /nfs/dbraw/zinc/25/36/99/1410253699.db2.gz URBDPALKEGOVLF-OAQYLSRUSA-N 2 1 385.552 3.042 20 0 GGADMP O=C(COc1ccccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)NCC1CC1 ZINC000093563969 1410253703 /nfs/dbraw/zinc/25/37/03/1410253703.db2.gz URBDPALKEGOVLF-OAQYLSRUSA-N 2 1 385.552 3.042 20 0 GGADMP O=C(COc1ccccc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)N1CCCC1 ZINC000093564067 1410253803 /nfs/dbraw/zinc/25/38/03/1410253803.db2.gz ZKUHVSOHPSAHJM-OAQYLSRUSA-N 2 1 385.552 3.138 20 0 GGADMP O=C(COc1ccccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)N1CCCC1 ZINC000093564067 1410253808 /nfs/dbraw/zinc/25/38/08/1410253808.db2.gz ZKUHVSOHPSAHJM-OAQYLSRUSA-N 2 1 385.552 3.138 20 0 GGADMP O=C(COc1ccccc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)NCC1CC1 ZINC000093563968 1410253894 /nfs/dbraw/zinc/25/38/94/1410253894.db2.gz URBDPALKEGOVLF-NRFANRHFSA-N 2 1 385.552 3.042 20 0 GGADMP O=C(COc1ccccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)NCC1CC1 ZINC000093563968 1410253895 /nfs/dbraw/zinc/25/38/95/1410253895.db2.gz URBDPALKEGOVLF-NRFANRHFSA-N 2 1 385.552 3.042 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3cn(C)nc3-c3ccncc3)CC2)C[C@H](C)O1 ZINC000093844418 1410274571 /nfs/dbraw/zinc/27/45/71/1410274571.db2.gz XEFANQODLGVPBT-KDURUIRLSA-N 2 1 397.567 3.193 20 0 GGADMP COc1cccc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1OC ZINC000093844328 1410274855 /nfs/dbraw/zinc/27/48/55/1410274855.db2.gz KXLBWFFRTCBLAI-HDICACEKSA-N 2 1 376.541 3.415 20 0 GGADMP CN(c1ccccc1C[N@@H+](C)[C@@H]1CCCc2c1cnn2C)C1CC[NH+](C)CC1 ZINC000093864099 1410275515 /nfs/dbraw/zinc/27/55/15/1410275515.db2.gz YJUSWKKGWBGPLQ-JOCHJYFZSA-N 2 1 381.568 3.460 20 0 GGADMP CC1(C)CC(NC(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC(C)(C)[NH2+]1 ZINC000096626719 1410335466 /nfs/dbraw/zinc/33/54/66/1410335466.db2.gz AILCVMKVUDUFOE-KRWDZBQOSA-N 2 1 375.532 3.463 20 0 GGADMP CC1CC[NH+](CC(=O)N2CCC[N@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000097056420 1410349449 /nfs/dbraw/zinc/34/94/49/1410349449.db2.gz HCVINCWNUHASCY-UHFFFAOYSA-N 2 1 397.485 3.472 20 0 GGADMP CC1CC[NH+](CC(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000097056420 1410349455 /nfs/dbraw/zinc/34/94/55/1410349455.db2.gz HCVINCWNUHASCY-UHFFFAOYSA-N 2 1 397.485 3.472 20 0 GGADMP C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N(Cc2ccco2)C2CC[NH+](C)CC2)C1 ZINC000097257191 1410360772 /nfs/dbraw/zinc/36/07/72/1410360772.db2.gz ULSWTHAHDZLNBG-SFHVURJKSA-N 2 1 390.572 3.396 20 0 GGADMP C[C@H](CNC(=O)N(CC[NH+](C)C)C1CCCC1)[N@@H+]1CCc2sccc2C1 ZINC000176814510 1428477382 /nfs/dbraw/zinc/47/73/82/1428477382.db2.gz XXOMZHBUDJJNHD-MRXNPFEDSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@H](CNC(=O)N(CC[NH+](C)C)C1CCCC1)[N@H+]1CCc2sccc2C1 ZINC000176814510 1428477393 /nfs/dbraw/zinc/47/73/93/1428477393.db2.gz XXOMZHBUDJJNHD-MRXNPFEDSA-N 2 1 378.586 3.011 20 0 GGADMP COc1cccc([C@H](CNC(=O)NCCC[N@@H+](C)C2CCCCC2)[NH+](C)C)c1 ZINC000097357808 1410366154 /nfs/dbraw/zinc/36/61/54/1410366154.db2.gz CSQQMONNKNYXTR-NRFANRHFSA-N 2 1 390.572 3.252 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CCC[NH+]1Cc1ccccc1 ZINC000097549245 1410375570 /nfs/dbraw/zinc/37/55/70/1410375570.db2.gz RIAYQESQFDWBOL-ZEQRLZLVSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000097549245 1410375576 /nfs/dbraw/zinc/37/55/76/1410375576.db2.gz RIAYQESQFDWBOL-ZEQRLZLVSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000097549245 1410375582 /nfs/dbraw/zinc/37/55/82/1410375582.db2.gz RIAYQESQFDWBOL-ZEQRLZLVSA-N 2 1 391.559 3.332 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000176827688 1428488994 /nfs/dbraw/zinc/48/89/94/1428488994.db2.gz WYYODGNVGHFBEV-GOSISDBHSA-N 2 1 383.540 3.497 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000101993445 1410538723 /nfs/dbraw/zinc/53/87/23/1410538723.db2.gz IPFURKDJHMLBQS-QZTJIDSGSA-N 2 1 392.613 3.380 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000101993448 1410538853 /nfs/dbraw/zinc/53/88/53/1410538853.db2.gz IPFURKDJHMLBQS-ZWKOTPCHSA-N 2 1 392.613 3.380 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)CC1 ZINC000101999352 1410541010 /nfs/dbraw/zinc/54/10/10/1410541010.db2.gz ZMPKOJUTGYOUBA-UHFFFAOYSA-N 2 1 387.503 3.384 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCC(C)CC1 ZINC000102005824 1410542017 /nfs/dbraw/zinc/54/20/17/1410542017.db2.gz PEYXQLQRBTWMKX-OALUTQOASA-N 2 1 392.613 3.380 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)NC[C@@H](c1ccccc1Cl)[NH+](C)C ZINC000176866986 1428506046 /nfs/dbraw/zinc/50/60/46/1428506046.db2.gz MBNNDCGSYJRRIA-IBGZPJMESA-N 2 1 392.931 3.309 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C ZINC000176867006 1428506103 /nfs/dbraw/zinc/50/61/03/1428506103.db2.gz MBNNDCGSYJRRIA-LJQANCHMSA-N 2 1 392.931 3.309 20 0 GGADMP C[NH+](C)CCCOc1ccc(CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000103125605 1410829841 /nfs/dbraw/zinc/82/98/41/1410829841.db2.gz WURGMSJADLZVDF-QHCPKHFHSA-N 2 1 395.547 3.298 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000103143078 1410831488 /nfs/dbraw/zinc/83/14/88/1410831488.db2.gz GYZGGXBUGNQXFZ-IBGZPJMESA-N 2 1 397.567 3.208 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@H](C)[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000103143078 1410831490 /nfs/dbraw/zinc/83/14/90/1410831490.db2.gz GYZGGXBUGNQXFZ-IBGZPJMESA-N 2 1 397.567 3.208 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000103143076 1410831600 /nfs/dbraw/zinc/83/16/00/1410831600.db2.gz GYZGGXBUGNQXFZ-LJQANCHMSA-N 2 1 397.567 3.208 20 0 GGADMP Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000103143076 1410831601 /nfs/dbraw/zinc/83/16/01/1410831601.db2.gz GYZGGXBUGNQXFZ-LJQANCHMSA-N 2 1 397.567 3.208 20 0 GGADMP COc1cc(OC)c(OC)cc1C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000103173959 1410834719 /nfs/dbraw/zinc/83/47/19/1410834719.db2.gz CHXMFNZOOUKXCD-LJQANCHMSA-N 2 1 384.520 3.367 20 0 GGADMP COc1cc(OC)c(OC)cc1C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000103173959 1410834722 /nfs/dbraw/zinc/83/47/22/1410834722.db2.gz CHXMFNZOOUKXCD-LJQANCHMSA-N 2 1 384.520 3.367 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1)c1ccccc1 ZINC000103191829 1410836427 /nfs/dbraw/zinc/83/64/27/1410836427.db2.gz JOPYRRUWDHRENY-XXBNENTESA-N 2 1 395.547 3.217 20 0 GGADMP CCN(C)[C@H](C(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1)c1ccccc1 ZINC000103191829 1410836429 /nfs/dbraw/zinc/83/64/29/1410836429.db2.gz JOPYRRUWDHRENY-XXBNENTESA-N 2 1 395.547 3.217 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1)c1ccccc1 ZINC000103205133 1410837257 /nfs/dbraw/zinc/83/72/57/1410837257.db2.gz DKSMWZIZTGSMAE-JTHBVZDNSA-N 2 1 379.548 3.360 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000103205133 1410837261 /nfs/dbraw/zinc/83/72/61/1410837261.db2.gz DKSMWZIZTGSMAE-JTHBVZDNSA-N 2 1 379.548 3.360 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000103205133 1410837262 /nfs/dbraw/zinc/83/72/62/1410837262.db2.gz DKSMWZIZTGSMAE-JTHBVZDNSA-N 2 1 379.548 3.360 20 0 GGADMP C[C@@H](C(=O)Nc1cc(C[NH+](C)C)ccn1)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000176901501 1428516367 /nfs/dbraw/zinc/51/63/67/1428516367.db2.gz JXLDTQXTSPGWOO-SFHVURJKSA-N 2 1 380.536 3.425 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)Nc1ccc2c(c1)OCO2 ZINC000103229204 1410838600 /nfs/dbraw/zinc/83/86/00/1410838600.db2.gz YNHVMPHWJGJXNM-SFHVURJKSA-N 2 1 387.524 3.332 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000103268273 1410842165 /nfs/dbraw/zinc/84/21/65/1410842165.db2.gz IZPKHEWTEVHCCO-QHCPKHFHSA-N 2 1 394.563 3.112 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccco1 ZINC000103297795 1410844025 /nfs/dbraw/zinc/84/40/25/1410844025.db2.gz WUCRANQOLJKBKT-OALUTQOASA-N 2 1 376.545 3.180 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000176906698 1428517296 /nfs/dbraw/zinc/51/72/96/1428517296.db2.gz SHJDARIVAHMROK-UHFFFAOYSA-N 2 1 398.551 3.190 20 0 GGADMP C[N@@H+](CCOc1cccc(CNC(=[NH2+])Nc2ccccc2)c1)C1CCOCC1 ZINC000103338721 1410849774 /nfs/dbraw/zinc/84/97/74/1410849774.db2.gz VGAQFLPUVMXKEP-UHFFFAOYSA-N 2 1 382.508 3.313 20 0 GGADMP CC[NH+](Cc1cnn(C)c1)Cc1ccc(C[N@@H+](CC)Cc2cnn(C)c2)cc1 ZINC000103474577 1410861634 /nfs/dbraw/zinc/86/16/34/1410861634.db2.gz VVGHACREGDSRAU-UHFFFAOYSA-N 2 1 380.540 3.198 20 0 GGADMP CC[NH+](Cc1cnn(C)c1)Cc1ccccc1C[N@@H+](CC)Cc1cnn(C)c1 ZINC000103474253 1410861694 /nfs/dbraw/zinc/86/16/94/1410861694.db2.gz KWOCIQCXYJMRPR-UHFFFAOYSA-N 2 1 380.540 3.198 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N(C)CC2CC[NH+](C)CC2)C1 ZINC000103510203 1410865184 /nfs/dbraw/zinc/86/51/84/1410865184.db2.gz VGEULNWNBJVVAJ-IBGZPJMESA-N 2 1 386.584 3.402 20 0 GGADMP CC[N@H+]1CCCC[C@H]1C(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCC2)cc1 ZINC000104272924 1410890040 /nfs/dbraw/zinc/89/00/40/1410890040.db2.gz ZYCKNDFJDOOWGW-FQEVSTJZSA-N 2 1 386.540 3.314 20 0 GGADMP CC[N@H+]1CCC[C@H](CNC(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)C1 ZINC000105113286 1411029899 /nfs/dbraw/zinc/02/98/99/1411029899.db2.gz RINKLGKQVMTAIE-SIKLNZKXSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+]1CCC[C@H](CNC(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000105113286 1411029906 /nfs/dbraw/zinc/02/99/06/1411029906.db2.gz RINKLGKQVMTAIE-SIKLNZKXSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+]1CCC[C@H](CNC(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000105113286 1411029914 /nfs/dbraw/zinc/02/99/14/1411029914.db2.gz RINKLGKQVMTAIE-SIKLNZKXSA-N 2 1 386.584 3.450 20 0 GGADMP CC[N@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)C1 ZINC000105113367 1411030079 /nfs/dbraw/zinc/03/00/79/1411030079.db2.gz PAHGYPFSZKMLDN-PMACEKPBSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+]1CCC[C@@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000105113367 1411030087 /nfs/dbraw/zinc/03/00/87/1411030087.db2.gz PAHGYPFSZKMLDN-PMACEKPBSA-N 2 1 386.584 3.450 20 0 GGADMP CC[NH+]1CCC[C@@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000105113367 1411030098 /nfs/dbraw/zinc/03/00/98/1411030098.db2.gz PAHGYPFSZKMLDN-PMACEKPBSA-N 2 1 386.584 3.450 20 0 GGADMP CC[N@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000105112913 1411030328 /nfs/dbraw/zinc/03/03/28/1411030328.db2.gz CELVBEMRYTXMPT-FQEVSTJZSA-N 2 1 386.584 3.450 20 0 GGADMP CC[C@H](CNC(=O)NC[C@H]1CCC[N@H+](C(C)C)C1)[NH+]1CCc2ccccc2C1 ZINC000105126191 1411032054 /nfs/dbraw/zinc/03/20/54/1411032054.db2.gz WBARUAPVIRULDL-DENIHFKCSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@H](CNC(=O)NC[C@H]1CCC[NH+](C(C)C)C1)[N@@H+]1CCc2ccccc2C1 ZINC000105126191 1411032062 /nfs/dbraw/zinc/03/20/62/1411032062.db2.gz WBARUAPVIRULDL-DENIHFKCSA-N 2 1 386.584 3.243 20 0 GGADMP CC[C@H](CNC(=O)NC[C@H]1CCC[NH+](C(C)C)C1)[N@H+]1CCc2ccccc2C1 ZINC000105126191 1411032069 /nfs/dbraw/zinc/03/20/69/1411032069.db2.gz WBARUAPVIRULDL-DENIHFKCSA-N 2 1 386.584 3.243 20 0 GGADMP C[C@H](NC(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1)c1cccc(OC(F)F)c1 ZINC000105131625 1411032655 /nfs/dbraw/zinc/03/26/55/1411032655.db2.gz BWOQFEUDCGEUSS-HNNXBMFYSA-N 2 1 398.498 3.016 20 0 GGADMP C[C@@H](NC(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1)c1ccc(OC(F)F)cc1 ZINC000105131817 1411032715 /nfs/dbraw/zinc/03/27/15/1411032715.db2.gz ZBUMRNXIEZQNSE-OAHLLOKOSA-N 2 1 398.498 3.016 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1)[N@@H+]1CCc2sccc2C1 ZINC000105150390 1411035078 /nfs/dbraw/zinc/03/50/78/1411035078.db2.gz UYXCDRFBKQZAKG-PKOBYXMFSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1)[N@H+]1CCc2sccc2C1 ZINC000105150390 1411035085 /nfs/dbraw/zinc/03/50/85/1411035085.db2.gz UYXCDRFBKQZAKG-PKOBYXMFSA-N 2 1 390.597 3.155 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NC[C@@H](C)[N@@H+](C)C1CC1)[NH+]1CCCCC1 ZINC000105165735 1411037412 /nfs/dbraw/zinc/03/74/12/1411037412.db2.gz PGPDXNQSVYDVJJ-XLIONFOSSA-N 2 1 388.556 3.004 20 0 GGADMP CC[N@H+]1CCC[C@H](CNC(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000105241559 1411046962 /nfs/dbraw/zinc/04/69/62/1411046962.db2.gz QPWRJDBPRBGVSE-JOCHJYFZSA-N 2 1 386.584 3.450 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCC(C)(C)[N@@H+]3CCC[C@H](C)C3)CC2)cs1 ZINC000105339314 1411055691 /nfs/dbraw/zinc/05/56/91/1411055691.db2.gz IAUASPGKSUVLTL-INIZCTEOSA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCC(C)(C)[N@H+]3CCC[C@H](C)C3)CC2)cs1 ZINC000105339314 1411055699 /nfs/dbraw/zinc/05/56/99/1411055699.db2.gz IAUASPGKSUVLTL-INIZCTEOSA-N 2 1 392.613 3.290 20 0 GGADMP Cn1cc(C[NH2+]CC2CCN(CC[NH+](C)C)CC2)c(-c2cc3ccccc3o2)n1 ZINC000105450811 1411067670 /nfs/dbraw/zinc/06/76/70/1411067670.db2.gz XMFBBHBABLJXTQ-UHFFFAOYSA-N 2 1 395.551 3.197 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000105451347 1411067746 /nfs/dbraw/zinc/06/77/46/1411067746.db2.gz IKRUMBAXWSOJRL-UHFFFAOYSA-N 2 1 375.948 3.093 20 0 GGADMP CCN(C(=O)C[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1)c1cccc2ccccc21 ZINC000106126305 1411172718 /nfs/dbraw/zinc/17/27/18/1411172718.db2.gz YSQSMXVWFFZWFB-IBGZPJMESA-N 2 1 397.563 3.217 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000176994834 1428545152 /nfs/dbraw/zinc/54/51/52/1428545152.db2.gz ZFWBRQYGWPIVMV-RTBURBONSA-N 2 1 388.556 3.275 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000176994834 1428545154 /nfs/dbraw/zinc/54/51/54/1428545154.db2.gz ZFWBRQYGWPIVMV-RTBURBONSA-N 2 1 388.556 3.275 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N[C@@H]1CC[NH+](C2CCCC2)C1 ZINC000106550358 1411243023 /nfs/dbraw/zinc/24/30/23/1411243023.db2.gz KDLARSPVZPCXHA-QZTJIDSGSA-N 2 1 390.597 3.276 20 0 GGADMP O=C(NC[C@H]1CCC[NH+](Cc2cccs2)C1)N[C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC000106550358 1411243035 /nfs/dbraw/zinc/24/30/35/1411243035.db2.gz KDLARSPVZPCXHA-QZTJIDSGSA-N 2 1 390.597 3.276 20 0 GGADMP O=C(NC[C@H]1CCC[NH+](Cc2cccs2)C1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106550358 1411243045 /nfs/dbraw/zinc/24/30/45/1411243045.db2.gz KDLARSPVZPCXHA-QZTJIDSGSA-N 2 1 390.597 3.276 20 0 GGADMP CCC[NH+]1CCC(NC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000107334183 1411361568 /nfs/dbraw/zinc/36/15/68/1411361568.db2.gz RUFRTLADWZZWKH-QGZVFWFLSA-N 2 1 378.586 3.134 20 0 GGADMP CCC[NH+]1CCC(NC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000107334181 1411361844 /nfs/dbraw/zinc/36/18/44/1411361844.db2.gz RUFRTLADWZZWKH-KRWDZBQOSA-N 2 1 378.586 3.134 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](CCCOc3cccc(C(F)(F)F)c3)C2)CC1 ZINC000107368277 1411366195 /nfs/dbraw/zinc/36/61/95/1411366195.db2.gz PXQMLXSLSZRTSV-SFHVURJKSA-N 2 1 385.474 3.186 20 0 GGADMP C[NH+](C)CCCOc1ccc(NC(=O)NCC[N@H+]2CCc3ccccc3C2)cc1 ZINC000107385839 1411369172 /nfs/dbraw/zinc/36/91/72/1411369172.db2.gz XPXBPTLVWUEVFN-UHFFFAOYSA-N 2 1 396.535 3.197 20 0 GGADMP CCCOc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000108420753 1411495721 /nfs/dbraw/zinc/49/57/21/1411495721.db2.gz XZXXNGGCFDWJPN-QFIPXVFZSA-N 2 1 395.547 3.463 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc4ccccc4o3)c2)C1 ZINC000108420678 1411495873 /nfs/dbraw/zinc/49/58/73/1411495873.db2.gz XHGKPMDMILTFIT-HXUWFJFHSA-N 2 1 377.488 3.420 20 0 GGADMP CCCOc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000108420755 1411496313 /nfs/dbraw/zinc/49/63/13/1411496313.db2.gz XZXXNGGCFDWJPN-JOCHJYFZSA-N 2 1 395.547 3.463 20 0 GGADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000108429119 1411499438 /nfs/dbraw/zinc/49/94/38/1411499438.db2.gz VVKJTOSQMNGQFH-FQEVSTJZSA-N 2 1 375.520 3.425 20 0 GGADMP O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000108544942 1411534503 /nfs/dbraw/zinc/53/45/03/1411534503.db2.gz CYXMHMDFNBDLDE-HXUWFJFHSA-N 2 1 390.959 3.088 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)NC[C@@H]2CCC[NH+](C)C2)C1 ZINC000108551664 1411536739 /nfs/dbraw/zinc/53/67/39/1411536739.db2.gz XDFKEFGJDTUSDQ-ZCNNSNEGSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CCC[N@H+](C)C2)C1 ZINC000108551664 1411536754 /nfs/dbraw/zinc/53/67/54/1411536754.db2.gz XDFKEFGJDTUSDQ-ZCNNSNEGSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CCC[N@@H+](C)C2)C1 ZINC000108551664 1411536771 /nfs/dbraw/zinc/53/67/71/1411536771.db2.gz XDFKEFGJDTUSDQ-ZCNNSNEGSA-N 2 1 386.584 3.306 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000108551975 1411537018 /nfs/dbraw/zinc/53/70/18/1411537018.db2.gz WCWMRTRTRGIDJR-APWZRJJASA-N 2 1 378.948 3.118 20 0 GGADMP C[N@H+]1CCC[C@@H](CNC(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000108576499 1411544049 /nfs/dbraw/zinc/54/40/49/1411544049.db2.gz IYRIAAJPWMNECR-SFHVURJKSA-N 2 1 392.975 3.193 20 0 GGADMP O=C(N[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000109014902 1411660965 /nfs/dbraw/zinc/66/09/65/1411660965.db2.gz XJUXHTDWBKZYLH-GGAORHGYSA-N 2 1 395.522 3.428 20 0 GGADMP C[N@@H+](CCNC(=O)[C@@H]1CCC[NH+](Cc2cccc(F)c2)C1)Cc1ccccc1 ZINC000109343989 1411745496 /nfs/dbraw/zinc/74/54/96/1411745496.db2.gz CQJDYNJHBOQNAT-OAQYLSRUSA-N 2 1 383.511 3.286 20 0 GGADMP C[NH+](CCNC(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)Cc1ccccc1 ZINC000109343989 1411745501 /nfs/dbraw/zinc/74/55/01/1411745501.db2.gz CQJDYNJHBOQNAT-OAQYLSRUSA-N 2 1 383.511 3.286 20 0 GGADMP C[NH+](CCNC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)Cc1ccccc1 ZINC000109343989 1411745503 /nfs/dbraw/zinc/74/55/03/1411745503.db2.gz CQJDYNJHBOQNAT-OAQYLSRUSA-N 2 1 383.511 3.286 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC[N@H+](C(C)(C)C)CC1)[NH+]1CCc2ccccc2C1 ZINC000109481149 1411771294 /nfs/dbraw/zinc/77/12/94/1411771294.db2.gz WZNZKFZYBFGBQG-NRFANRHFSA-N 2 1 386.584 3.339 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC[NH+](C(C)(C)C)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000109481149 1411771310 /nfs/dbraw/zinc/77/13/10/1411771310.db2.gz WZNZKFZYBFGBQG-NRFANRHFSA-N 2 1 386.584 3.339 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC[NH+](C(C)(C)C)CC1)[N@H+]1CCc2ccccc2C1 ZINC000109481149 1411771320 /nfs/dbraw/zinc/77/13/20/1411771320.db2.gz WZNZKFZYBFGBQG-NRFANRHFSA-N 2 1 386.584 3.339 20 0 GGADMP CC(C)C[NH+]1CCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000110164278 1411835187 /nfs/dbraw/zinc/83/51/87/1411835187.db2.gz UDXFSLSCPXVVNU-FQEVSTJZSA-N 2 1 397.485 3.241 20 0 GGADMP CCc1cccc(C)c1NC(=O)C[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110432609 1411850692 /nfs/dbraw/zinc/85/06/92/1411850692.db2.gz CGXCOSUWFDQUIL-RTBURBONSA-N 2 1 387.568 3.317 20 0 GGADMP CC[NH+](CC)[C@H](C(=O)NC[C@@H](c1ccccc1OC)[NH+](C)C)c1ccccc1 ZINC000111034645 1411883074 /nfs/dbraw/zinc/88/30/74/1411883074.db2.gz PHFCWWSUPNLWRN-UNMCSNQZSA-N 2 1 383.536 3.497 20 0 GGADMP CC[NH+](CC)[C@@H](C(=O)NC[C@@H](c1ccccc1OC)[NH+](C)C)c1ccccc1 ZINC000111034646 1411883394 /nfs/dbraw/zinc/88/33/94/1411883394.db2.gz PHFCWWSUPNLWRN-RBBKRZOGSA-N 2 1 383.536 3.497 20 0 GGADMP O=C(NCC1([NH+]2CCCCC2)CCOCC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000111102335 1411887347 /nfs/dbraw/zinc/88/73/47/1411887347.db2.gz MHLXDHPEVCKROU-QFIPXVFZSA-N 2 1 399.579 3.050 20 0 GGADMP O=C(C[NH2+]C1(c2nccs2)CCCC1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000177165420 1428608152 /nfs/dbraw/zinc/60/81/52/1428608152.db2.gz WMYKDGHGUILPMH-UHFFFAOYSA-N 2 1 398.576 3.414 20 0 GGADMP C[C@H](CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[N@@H+](C)Cc1ccccc1 ZINC000111433735 1411954070 /nfs/dbraw/zinc/95/40/70/1411954070.db2.gz TUJRDFNYEQWINL-UYAOXDASSA-N 2 1 384.524 3.236 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000111482165 1411978049 /nfs/dbraw/zinc/97/80/49/1411978049.db2.gz GCPHQVODBKHFAV-GOSISDBHSA-N 2 1 378.586 3.134 20 0 GGADMP C[N@@H+](CCC(=O)Nc1cc(N)ccc1F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000177174412 1428614010 /nfs/dbraw/zinc/61/40/10/1428614010.db2.gz KSHXVXRTMODTAR-GOSISDBHSA-N 2 1 384.499 3.190 20 0 GGADMP C[NH+](CCC(=O)Nc1cc(N)ccc1F)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000177174412 1428614016 /nfs/dbraw/zinc/61/40/16/1428614016.db2.gz KSHXVXRTMODTAR-GOSISDBHSA-N 2 1 384.499 3.190 20 0 GGADMP C[NH+](CCC(=O)Nc1cc(N)ccc1F)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000177174412 1428614021 /nfs/dbraw/zinc/61/40/21/1428614021.db2.gz KSHXVXRTMODTAR-GOSISDBHSA-N 2 1 384.499 3.190 20 0 GGADMP C[C@@H](C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000111607635 1412001766 /nfs/dbraw/zinc/00/17/66/1412001766.db2.gz LEGVUUFWYRBUDI-RBBKRZOGSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@@H](C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000111607635 1412001772 /nfs/dbraw/zinc/00/17/72/1412001772.db2.gz LEGVUUFWYRBUDI-RBBKRZOGSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@@H](C(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000111607635 1412001778 /nfs/dbraw/zinc/00/17/78/1412001778.db2.gz LEGVUUFWYRBUDI-RBBKRZOGSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@@H](C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000111607635 1412001784 /nfs/dbraw/zinc/00/17/84/1412001784.db2.gz LEGVUUFWYRBUDI-RBBKRZOGSA-N 2 1 391.559 3.114 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1ccc(F)cc1 ZINC000112532798 1412163834 /nfs/dbraw/zinc/16/38/34/1412163834.db2.gz VIOYTQXRXFQISS-KRWDZBQOSA-N 2 1 385.483 3.337 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1cccc(Oc2ccncc2)c1 ZINC000112633151 1412182327 /nfs/dbraw/zinc/18/23/27/1412182327.db2.gz JJMATECTZFRWGB-HXUWFJFHSA-N 2 1 396.535 3.362 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CCc3nc(-c4ccccc4)no3)CC2)C[C@H](C)O1 ZINC000112631656 1412182663 /nfs/dbraw/zinc/18/26/63/1412182663.db2.gz WVUGYDLBGNIDRB-HDICACEKSA-N 2 1 384.524 3.100 20 0 GGADMP C[C@@H]1CC[C@@H](C)[NH+]1CCN1CC[NH+](CCCc2nc(-c3ccccc3)no2)CC1 ZINC000112649194 1412186586 /nfs/dbraw/zinc/18/65/86/1412186586.db2.gz MMJHZPMPYXIYEX-WOJBJXKFSA-N 2 1 397.567 3.160 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2c(Cl)cccc2OC(F)F)CC1 ZINC000112710200 1412200831 /nfs/dbraw/zinc/20/08/31/1412200831.db2.gz ITEZEHKPVGIUJZ-UHFFFAOYSA-N 2 1 375.891 3.305 20 0 GGADMP C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000112979628 1412250594 /nfs/dbraw/zinc/25/05/94/1412250594.db2.gz XYUBDAGQKXYSAS-ZACQAIPSSA-N 2 1 385.512 3.014 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177220592 1428638216 /nfs/dbraw/zinc/63/82/16/1428638216.db2.gz QFRRFQLFUUEDHE-MSOLQXFVSA-N 2 1 381.586 3.100 20 0 GGADMP C[C@@H]([NH2+]C1(CNC(=O)[C@H](c2ccccc2)[NH+](C)C)CCOCC1)c1ccccc1 ZINC000113236234 1412280476 /nfs/dbraw/zinc/28/04/76/1412280476.db2.gz CPBXMWXIWMQHTN-KNQAVFIVSA-N 2 1 395.547 3.306 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CN2C[C@@H](c3ccccn3)CC2=O)CC1 ZINC000113244382 1412281827 /nfs/dbraw/zinc/28/18/27/1412281827.db2.gz VGABIUFYTSRTJL-QFIPXVFZSA-N 2 1 392.547 3.199 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CN2C[C@@H](c3ccccn3)CC2=O)CC1 ZINC000113244382 1412281833 /nfs/dbraw/zinc/28/18/33/1412281833.db2.gz VGABIUFYTSRTJL-QFIPXVFZSA-N 2 1 392.547 3.199 20 0 GGADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CN2C[C@H](c3ccccn3)CC2=O)CC1 ZINC000113244380 1412282485 /nfs/dbraw/zinc/28/24/85/1412282485.db2.gz VGABIUFYTSRTJL-JOCHJYFZSA-N 2 1 392.547 3.199 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CN2C[C@H](c3ccccn3)CC2=O)CC1 ZINC000113244380 1412282489 /nfs/dbraw/zinc/28/24/89/1412282489.db2.gz VGABIUFYTSRTJL-JOCHJYFZSA-N 2 1 392.547 3.199 20 0 GGADMP Cc1ccccc1[C@H](OC[C@H](O)C[N@@H+]1CC[C@H](C[NH+](C)C)C1)c1ccccc1 ZINC000113514808 1412311548 /nfs/dbraw/zinc/31/15/48/1412311548.db2.gz HLPNEIIPIRRSJZ-KIFXHHALSA-N 2 1 382.548 3.345 20 0 GGADMP C[C@@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000113591531 1412318804 /nfs/dbraw/zinc/31/88/04/1412318804.db2.gz BGWDQQGIQUBZKQ-PMACEKPBSA-N 2 1 386.584 3.413 20 0 GGADMP CN(C(=O)NCC[N@@H+](C)Cc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000113601841 1412320473 /nfs/dbraw/zinc/32/04/73/1412320473.db2.gz LHMZLBBWHWOXQB-UHFFFAOYSA-N 2 1 394.563 3.424 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000113602236 1412320503 /nfs/dbraw/zinc/32/05/03/1412320503.db2.gz RRJAXXSVUIZNAD-VQTJNVASSA-N 2 1 386.584 3.413 20 0 GGADMP COc1cccc([C@H](C)[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)c1 ZINC000177231879 1428642675 /nfs/dbraw/zinc/64/26/75/1428642675.db2.gz QHEGADCQGCDGLM-SFHVURJKSA-N 2 1 397.519 3.207 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)[nH+]c1 ZINC000114020511 1412369643 /nfs/dbraw/zinc/36/96/43/1412369643.db2.gz WRLWKDQJNVAKRJ-VQTJNVASSA-N 2 1 387.572 3.488 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)[nH+]c1 ZINC000114020511 1412369649 /nfs/dbraw/zinc/36/96/49/1412369649.db2.gz WRLWKDQJNVAKRJ-VQTJNVASSA-N 2 1 387.572 3.488 20 0 GGADMP COc1ccc(C[N@@H+](CC(=O)NC2CC[NH+](C(C)C)CC2)[C@@H](C)C2CC2)cc1 ZINC000114455616 1412436825 /nfs/dbraw/zinc/43/68/25/1412436825.db2.gz LZBAGAPOIJWYPS-SFHVURJKSA-N 2 1 387.568 3.285 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)NCCc2c(F)cccc2F)CC1 ZINC000114475597 1412441083 /nfs/dbraw/zinc/44/10/83/1412441083.db2.gz MITKYJWPWIRFDM-UHFFFAOYSA-N 2 1 381.511 3.067 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(OC)c(OC)c2)CC1 ZINC000114475773 1412441450 /nfs/dbraw/zinc/44/14/50/1412441450.db2.gz YOECJBRTGBVLET-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(OC)c(OC)c2)CC1 ZINC000114475773 1412441458 /nfs/dbraw/zinc/44/14/58/1412441458.db2.gz YOECJBRTGBVLET-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)N2CCc3sccc3C2)CC1 ZINC000114475807 1412441976 /nfs/dbraw/zinc/44/19/76/1412441976.db2.gz JOXZDFZKGCLYLY-QGZVFWFLSA-N 2 1 377.598 3.465 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)N2CCc3sccc3C2)CC1 ZINC000114475805 1412442212 /nfs/dbraw/zinc/44/22/12/1412442212.db2.gz JOXZDFZKGCLYLY-KRWDZBQOSA-N 2 1 377.598 3.465 20 0 GGADMP CN(CC[NH+]1CCCC1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000114604243 1412473422 /nfs/dbraw/zinc/47/34/22/1412473422.db2.gz OVGXEYNVCIXSAP-GOSISDBHSA-N 2 1 398.473 3.017 20 0 GGADMP Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000114752850 1412519383 /nfs/dbraw/zinc/51/93/83/1412519383.db2.gz NCSONGFYZMKRQQ-DOTOQJQBSA-N 2 1 384.524 3.111 20 0 GGADMP C[NH+](C)Cc1cccc(CNC(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC000114783430 1412523014 /nfs/dbraw/zinc/52/30/14/1412523014.db2.gz KTZBNTZKXLWUGB-QFIPXVFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1)c1cccc(OC)c1 ZINC000115790475 1412789497 /nfs/dbraw/zinc/78/94/97/1412789497.db2.gz KJAJVPCMJUDMAU-RXVVDRJESA-N 2 1 390.572 3.061 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000115794840 1412791053 /nfs/dbraw/zinc/79/10/53/1412791053.db2.gz ATDDZMBDHKZETF-HXUWFJFHSA-N 2 1 386.584 3.402 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c2ccccc2)CC1 ZINC000115806805 1412794804 /nfs/dbraw/zinc/79/48/04/1412794804.db2.gz PEIYDXJBFUYBPF-IFMALSPDSA-N 2 1 386.584 3.443 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1 ZINC000177298211 1428677313 /nfs/dbraw/zinc/67/73/13/1428677313.db2.gz OEAGTHIJXJAXLN-QGZVFWFLSA-N 2 1 389.565 3.239 20 0 GGADMP C[NH+](C)CC[C@@H](NC(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)C(C)(C)C ZINC000116489947 1412867405 /nfs/dbraw/zinc/86/74/05/1412867405.db2.gz FPBLYDIFFGXZLI-HXUWFJFHSA-N 2 1 390.572 3.049 20 0 GGADMP C[N@@H+](CCCNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)Cc1ccccc1 ZINC000116530898 1412873091 /nfs/dbraw/zinc/87/30/91/1412873091.db2.gz ADRQMAOMTTYLQI-UHFFFAOYSA-N 2 1 397.588 3.487 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000116535880 1412873869 /nfs/dbraw/zinc/87/38/69/1412873869.db2.gz NVYPSRFKXOTYGO-SFHVURJKSA-N 2 1 375.582 3.230 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)C[N@H+](C)Cc2ccccc2)cc1Cl ZINC000116817230 1412930334 /nfs/dbraw/zinc/93/03/34/1412930334.db2.gz BVXJMTGDZUQARU-UHFFFAOYSA-N 2 1 375.900 3.351 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)C[N@@H+](C)Cc2ccccc2)cc1Cl ZINC000116817230 1412930351 /nfs/dbraw/zinc/93/03/51/1412930351.db2.gz BVXJMTGDZUQARU-UHFFFAOYSA-N 2 1 375.900 3.351 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177327429 1428691153 /nfs/dbraw/zinc/69/11/53/1428691153.db2.gz ZNYHPVBRDQZZCX-UHFFFAOYSA-N 2 1 384.568 3.141 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000177334554 1428695743 /nfs/dbraw/zinc/69/57/43/1428695743.db2.gz SBSJGMGEQIXYCM-UHFFFAOYSA-N 2 1 380.536 3.056 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](CCSc3ccccc3)CC2)CC1 ZINC000117881740 1413086111 /nfs/dbraw/zinc/08/61/11/1413086111.db2.gz LOFBFMUNJJRNEP-UHFFFAOYSA-N 2 1 375.582 3.045 20 0 GGADMP C[C@H](c1ccc(NC(=O)NC[C@H](C)C[NH+]2CCCCC2)cc1)[NH+]1CCOCC1 ZINC000118029545 1413098569 /nfs/dbraw/zinc/09/85/69/1413098569.db2.gz AYWUPKFJLZRSSN-RBUKOAKNSA-N 2 1 388.556 3.323 20 0 GGADMP C[C@H](CNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1)C[NH+]1CCCCC1 ZINC000118029547 1413098838 /nfs/dbraw/zinc/09/88/38/1413098838.db2.gz AYWUPKFJLZRSSN-RTBURBONSA-N 2 1 388.556 3.323 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCc2cccc(C[NH+](C)C)c2)cc1)[NH+]1CCOCC1 ZINC000118029158 1413098949 /nfs/dbraw/zinc/09/89/49/1413098949.db2.gz ZQJIDCQCPNJZRT-GOSISDBHSA-N 2 1 396.535 3.463 20 0 GGADMP CC[C@@H]1CCCC[N@@H+]1CCNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000118030286 1413099590 /nfs/dbraw/zinc/09/95/90/1413099590.db2.gz XIHRSFRTEXHVBD-WIYYLYMNSA-N 2 1 388.556 3.466 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000118030286 1413099595 /nfs/dbraw/zinc/09/95/95/1413099595.db2.gz XIHRSFRTEXHVBD-WIYYLYMNSA-N 2 1 388.556 3.466 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)CC1 ZINC000118421211 1413159180 /nfs/dbraw/zinc/15/91/80/1413159180.db2.gz ZCLJVDAEPCSJQS-DYESRHJHSA-N 2 1 375.582 3.154 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)CC1 ZINC000118421211 1413159189 /nfs/dbraw/zinc/15/91/89/1413159189.db2.gz ZCLJVDAEPCSJQS-DYESRHJHSA-N 2 1 375.582 3.154 20 0 GGADMP CN(C[C@H]1CCC[N@H+](C)C1)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000118813952 1413230874 /nfs/dbraw/zinc/23/08/74/1413230874.db2.gz PTEVGXMYURNJNH-KRWDZBQOSA-N 2 1 376.570 3.041 20 0 GGADMP CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000118813952 1413230887 /nfs/dbraw/zinc/23/08/87/1413230887.db2.gz PTEVGXMYURNJNH-KRWDZBQOSA-N 2 1 376.570 3.041 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3c(-c4ccccc4)nc4ccccn43)C2)CC1 ZINC000118834680 1413237847 /nfs/dbraw/zinc/23/78/47/1413237847.db2.gz GCFVUENMYRPQIA-NRFANRHFSA-N 2 1 389.547 3.213 20 0 GGADMP C[NH+](C)CCC1CC[NH+](CC(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)CC1 ZINC000118868632 1413255287 /nfs/dbraw/zinc/25/52/87/1413255287.db2.gz HBOCQXOYVTXWEN-UHFFFAOYSA-N 2 1 387.524 3.330 20 0 GGADMP Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000118868301 1413255887 /nfs/dbraw/zinc/25/58/87/1413255887.db2.gz KPMGVQKAFBIXQM-UHFFFAOYSA-N 2 1 397.567 3.400 20 0 GGADMP Cc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cnn1-c1cc[nH+]cc1 ZINC000118942814 1413267770 /nfs/dbraw/zinc/26/77/70/1413267770.db2.gz QAZQSCCTIVEYKZ-JTSKRJEESA-N 2 1 389.503 3.216 20 0 GGADMP Cc1c(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cnn1-c1cc[nH+]cc1 ZINC000118942814 1413267778 /nfs/dbraw/zinc/26/77/78/1413267778.db2.gz QAZQSCCTIVEYKZ-JTSKRJEESA-N 2 1 389.503 3.216 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)c2cnn(-c3cc[nH+]cc3)c2C)cc1 ZINC000118961607 1413276148 /nfs/dbraw/zinc/27/61/48/1413276148.db2.gz VSSHQPUDUADYII-UHFFFAOYSA-N 2 1 377.492 3.348 20 0 GGADMP CCc1ccc([C@H](CNC(=O)c2cnn(-c3cc[nH+]cc3)c2C)[NH+](C)C)cc1 ZINC000119000226 1413299906 /nfs/dbraw/zinc/29/99/06/1413299906.db2.gz VYJLCFWBGCVAPX-NRFANRHFSA-N 2 1 377.492 3.171 20 0 GGADMP Cc1c(C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)cnn1-c1cc[nH+]cc1 ZINC000119004679 1413301386 /nfs/dbraw/zinc/30/13/86/1413301386.db2.gz ZXQSHJIJVKEAMZ-SFHVURJKSA-N 2 1 381.505 3.204 20 0 GGADMP Cc1c(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cnn1-c1cc[nH+]cc1 ZINC000119012210 1413303472 /nfs/dbraw/zinc/30/34/72/1413303472.db2.gz HGBVJFAMCHVLAK-XLIONFOSSA-N 2 1 389.503 3.359 20 0 GGADMP Cc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cnn1-c1cc[nH+]cc1 ZINC000119012210 1413303479 /nfs/dbraw/zinc/30/34/79/1413303479.db2.gz HGBVJFAMCHVLAK-XLIONFOSSA-N 2 1 389.503 3.359 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)cn1 ZINC000177396263 1428716970 /nfs/dbraw/zinc/71/69/70/1428716970.db2.gz IXXNJUGCTNAMIK-UHFFFAOYSA-N 2 1 396.539 3.172 20 0 GGADMP CCc1cc(N2CCC[C@H]([NH2+]C3CC[NH+](CCc4ccccc4)CC3)C2)ncn1 ZINC000119055075 1413319186 /nfs/dbraw/zinc/31/91/86/1413319186.db2.gz ULDPYVKKARZBDT-QHCPKHFHSA-N 2 1 393.579 3.305 20 0 GGADMP C[C@H](CNC(=O)N1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1)C[NH+]1CCCC1 ZINC000119109365 1413340272 /nfs/dbraw/zinc/34/02/72/1413340272.db2.gz CGVKUTLCZZJFJX-UXHICEINSA-N 2 1 378.605 3.404 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)[NH+]2CCCC2)o1 ZINC000119184655 1413369003 /nfs/dbraw/zinc/36/90/03/1413369003.db2.gz GXVLABOWKLPVCU-RBUKOAKNSA-N 2 1 376.545 3.002 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000119290481 1413400783 /nfs/dbraw/zinc/40/07/83/1413400783.db2.gz CGGQWZUJKJJIFU-WOJBJXKFSA-N 2 1 375.532 3.132 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)C1 ZINC000119290481 1413400785 /nfs/dbraw/zinc/40/07/85/1413400785.db2.gz CGGQWZUJKJJIFU-WOJBJXKFSA-N 2 1 375.532 3.132 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000119290481 1413400788 /nfs/dbraw/zinc/40/07/88/1413400788.db2.gz CGGQWZUJKJJIFU-WOJBJXKFSA-N 2 1 375.532 3.132 20 0 GGADMP C[N@@H+](Cc1cnc(N2CCOCC2)s1)C1CCN(Cc2ccccc2)CC1 ZINC000119311776 1413407868 /nfs/dbraw/zinc/40/78/68/1413407868.db2.gz COFPITALZGPRQP-UHFFFAOYSA-N 2 1 386.565 3.076 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)NCCC2CC[NH+](C)CC2)CC1 ZINC000119502869 1413467749 /nfs/dbraw/zinc/46/77/49/1413467749.db2.gz YTVOLUKIFADKKN-LJQANCHMSA-N 2 1 378.605 3.404 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000119774666 1413564634 /nfs/dbraw/zinc/56/46/34/1413564634.db2.gz SRPWMYCJLJZRGB-FPOVZHCZSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000119774666 1413564640 /nfs/dbraw/zinc/56/46/40/1413564640.db2.gz SRPWMYCJLJZRGB-FPOVZHCZSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000119774666 1413564642 /nfs/dbraw/zinc/56/46/42/1413564642.db2.gz SRPWMYCJLJZRGB-FPOVZHCZSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000119774666 1413564647 /nfs/dbraw/zinc/56/46/47/1413564647.db2.gz SRPWMYCJLJZRGB-FPOVZHCZSA-N 2 1 375.532 3.274 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)NC3CC[NH+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000177448796 1428741532 /nfs/dbraw/zinc/74/15/32/1428741532.db2.gz TZBDGQLWJNZUHW-KDURUIRLSA-N 2 1 399.579 3.433 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)NC3CC[NH+](C4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000177448796 1428741537 /nfs/dbraw/zinc/74/15/37/1428741537.db2.gz TZBDGQLWJNZUHW-KDURUIRLSA-N 2 1 399.579 3.433 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)N(C)CCCn1cc[nH+]c1C)[NH+]1CCCC1 ZINC000120077147 1413677789 /nfs/dbraw/zinc/67/77/89/1413677789.db2.gz WGCCYXOTROIOKM-FQEVSTJZSA-N 2 1 399.539 3.069 20 0 GGADMP CC(C)C[C@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)N1CCOCC1 ZINC000120231627 1413743413 /nfs/dbraw/zinc/74/34/13/1413743413.db2.gz KGYWCBBGBNNIKZ-HSZRJFAPSA-N 2 1 391.575 3.169 20 0 GGADMP C[NH+](C)C1(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)CCC1 ZINC000120290360 1413770296 /nfs/dbraw/zinc/77/02/96/1413770296.db2.gz QUZHOFNSBOCNFQ-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000120527347 1413836398 /nfs/dbraw/zinc/83/63/98/1413836398.db2.gz SNCGDIFWDFESCJ-UHFFFAOYSA-N 2 1 389.569 3.197 20 0 GGADMP Cc1c(C(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)cnn1-c1cc[nH+]cc1 ZINC000120707594 1413880315 /nfs/dbraw/zinc/88/03/15/1413880315.db2.gz GTVDTYXZAFHBKW-SFHVURJKSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1c(C(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)cnn1-c1cc[nH+]cc1 ZINC000120707594 1413880319 /nfs/dbraw/zinc/88/03/19/1413880319.db2.gz GTVDTYXZAFHBKW-SFHVURJKSA-N 2 1 389.503 3.312 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCc2ccc(C[NH+](C)C)cc2)C[N@H+]1Cc1ccccc1 ZINC000120713634 1413882769 /nfs/dbraw/zinc/88/27/69/1413882769.db2.gz UWDGZCNGHXXLQF-PGRDOPGGSA-N 2 1 380.536 3.210 20 0 GGADMP COc1cc([C@@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)ccc1S(C)(=O)=O ZINC000120768266 1413897091 /nfs/dbraw/zinc/89/70/91/1413897091.db2.gz PMCHXIWPZMUIBF-MRXNPFEDSA-N 2 1 382.570 3.404 20 0 GGADMP COc1cc([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)ccc1S(C)(=O)=O ZINC000120768266 1413897093 /nfs/dbraw/zinc/89/70/93/1413897093.db2.gz PMCHXIWPZMUIBF-MRXNPFEDSA-N 2 1 382.570 3.404 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](CCC(=O)Nc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000177495993 1428769168 /nfs/dbraw/zinc/76/91/68/1428769168.db2.gz JPDFNFFBYADZPG-HDICACEKSA-N 2 1 391.531 3.366 20 0 GGADMP Cc1nn(Cc2ccc(C)cc2)c(C)c1C[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000121098271 1414006561 /nfs/dbraw/zinc/00/65/61/1414006561.db2.gz NWDLURFVYABRPF-IBGZPJMESA-N 2 1 398.595 3.381 20 0 GGADMP CNC(=O)c1ccc(C[N@@H+](C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000121166461 1414030641 /nfs/dbraw/zinc/03/06/41/1414030641.db2.gz CWPWISUBUSLBNK-UHFFFAOYSA-N 2 1 394.563 3.209 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N(CC[NH+](C)C)Cc3ccco3)cc2)C[C@H](C)O1 ZINC000121231610 1414052245 /nfs/dbraw/zinc/05/22/45/1414052245.db2.gz IUDYSOWVLYPHKO-KDURUIRLSA-N 2 1 399.535 3.093 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N(CC[NH+](C)C)Cc3ccco3)cc2)C[C@H](C)O1 ZINC000121231610 1414052250 /nfs/dbraw/zinc/05/22/50/1414052250.db2.gz IUDYSOWVLYPHKO-KDURUIRLSA-N 2 1 399.535 3.093 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+]([C@H](C(=O)NC3CC3)c3ccccc3)CC2)C[C@H](C)O1 ZINC000177505731 1428773673 /nfs/dbraw/zinc/77/36/73/1428773673.db2.gz UFUDIURMNQOZJN-YYDVJCTNSA-N 2 1 399.579 3.218 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3coc4ccccc34)c2)C1 ZINC000121354335 1414092738 /nfs/dbraw/zinc/09/27/38/1414092738.db2.gz WWNAUTRKDLGNGU-IBGZPJMESA-N 2 1 377.488 3.420 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000121726230 1414237861 /nfs/dbraw/zinc/23/78/61/1414237861.db2.gz MLDXRJDKJJERFI-RTBURBONSA-N 2 1 396.620 3.028 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000121726230 1414237864 /nfs/dbraw/zinc/23/78/64/1414237864.db2.gz MLDXRJDKJJERFI-RTBURBONSA-N 2 1 396.620 3.028 20 0 GGADMP COc1cc(NC(=O)C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc(OC)c1 ZINC000121761230 1414249090 /nfs/dbraw/zinc/24/90/90/1414249090.db2.gz VBMPPLZRALUZNI-UHFFFAOYSA-N 2 1 389.540 3.230 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3[C@@H]4CCO[C@@H]4C34CCC4)CC2)cs1 ZINC000121791180 1414258061 /nfs/dbraw/zinc/25/80/61/1414258061.db2.gz CSXWGECDPJILAZ-IHPCNDPISA-N 2 1 375.582 3.465 20 0 GGADMP CC(C)n1nccc1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000121825717 1414270222 /nfs/dbraw/zinc/27/02/22/1414270222.db2.gz VLTYYWQZTNUTLW-GOSISDBHSA-N 2 1 375.561 3.379 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000121833038 1414272378 /nfs/dbraw/zinc/27/23/78/1414272378.db2.gz KWVKANOXQPTWAJ-UHFFFAOYSA-N 2 1 389.540 3.230 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000121976029 1414329335 /nfs/dbraw/zinc/32/93/35/1414329335.db2.gz YFQZVCKKRDOWEC-WIYYLYMNSA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000121976029 1414329349 /nfs/dbraw/zinc/32/93/49/1414329349.db2.gz YFQZVCKKRDOWEC-WIYYLYMNSA-N 2 1 383.540 3.276 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2ccc(Cl)cn2)CC1 ZINC000122055029 1414350346 /nfs/dbraw/zinc/35/03/46/1414350346.db2.gz JZZUCUPUVWUTSW-MRXNPFEDSA-N 2 1 396.963 3.132 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2ccc(Cl)cn2)CC1 ZINC000122055029 1414350354 /nfs/dbraw/zinc/35/03/54/1414350354.db2.gz JZZUCUPUVWUTSW-MRXNPFEDSA-N 2 1 396.963 3.132 20 0 GGADMP CN(c1ccccc1C[N@@H+](CCC(N)=O)Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000122115650 1414365756 /nfs/dbraw/zinc/36/57/56/1414365756.db2.gz YZUUKBUWSAEHBO-UHFFFAOYSA-N 2 1 394.563 3.095 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2cccc(F)c2)CC1 ZINC000122118379 1414366762 /nfs/dbraw/zinc/36/67/62/1414366762.db2.gz LLAKETLILNRQIS-QGZVFWFLSA-N 2 1 379.520 3.223 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(F)c(F)c2)CC1 ZINC000122170686 1414379097 /nfs/dbraw/zinc/37/90/97/1414379097.db2.gz NDRFSHKZMDTCOD-INIZCTEOSA-N 2 1 397.510 3.362 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1)C1CC1 ZINC000122265030 1414406176 /nfs/dbraw/zinc/40/61/76/1414406176.db2.gz WKAJZZPWROYKKD-GOTSBHOMSA-N 2 1 399.579 3.169 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000122342592 1414429074 /nfs/dbraw/zinc/42/90/74/1414429074.db2.gz GJJTUKXCRHTXCH-OAHLLOKOSA-N 2 1 394.512 3.020 20 0 GGADMP C[NH+](C)CCN(C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCCC1 ZINC000122603575 1414514072 /nfs/dbraw/zinc/51/40/72/1414514072.db2.gz HOSMLLVKVJJPAM-GOSISDBHSA-N 2 1 392.613 3.476 20 0 GGADMP Clc1ccccc1[C@H](C[NH2+]C1CC[NH+](CC2CC2)CC1)N1CCOCC1 ZINC000122701403 1414542617 /nfs/dbraw/zinc/54/26/17/1414542617.db2.gz WEXNTEROYYPOFW-NRFANRHFSA-N 2 1 377.960 3.177 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)c1 ZINC000122724540 1414549375 /nfs/dbraw/zinc/54/93/75/1414549375.db2.gz LYQIZKASGNCATR-DLBZAZTESA-N 2 1 377.529 3.275 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000122784972 1414564385 /nfs/dbraw/zinc/56/43/85/1414564385.db2.gz QBXLQBDLRSKWLZ-KRWDZBQOSA-N 2 1 387.549 3.157 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000122784972 1414564394 /nfs/dbraw/zinc/56/43/94/1414564394.db2.gz QBXLQBDLRSKWLZ-KRWDZBQOSA-N 2 1 387.549 3.157 20 0 GGADMP C[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000122785181 1414564443 /nfs/dbraw/zinc/56/44/43/1414564443.db2.gz QBXLQBDLRSKWLZ-QGZVFWFLSA-N 2 1 387.549 3.157 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000122785181 1414564450 /nfs/dbraw/zinc/56/44/50/1414564450.db2.gz QBXLQBDLRSKWLZ-QGZVFWFLSA-N 2 1 387.549 3.157 20 0 GGADMP CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCOCC1 ZINC000122801155 1414568018 /nfs/dbraw/zinc/56/80/18/1414568018.db2.gz WFZXHLNFDAWSTK-UXHICEINSA-N 2 1 389.540 3.054 20 0 GGADMP Cc1c(C(=O)NCc2ccccc2C[N@@H+](C)C(C)C)cnn1-c1cc[nH+]cc1 ZINC000122928792 1414599633 /nfs/dbraw/zinc/59/96/33/1414599633.db2.gz VRHHNDDMGFKITB-UHFFFAOYSA-N 2 1 377.492 3.346 20 0 GGADMP Cc1c(C(=O)NCc2ccccc2C[N@H+](C)C(C)C)cnn1-c1cc[nH+]cc1 ZINC000122928792 1414599636 /nfs/dbraw/zinc/59/96/36/1414599636.db2.gz VRHHNDDMGFKITB-UHFFFAOYSA-N 2 1 377.492 3.346 20 0 GGADMP C[NH+](C)CCOc1ccccc1CNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000122947151 1414603307 /nfs/dbraw/zinc/60/33/07/1414603307.db2.gz YREOOHKUAJEKTM-QFIPXVFZSA-N 2 1 395.547 3.155 20 0 GGADMP O=C(NC1CC[NH+](Cc2cccnc2)CC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000177645996 1428821667 /nfs/dbraw/zinc/82/16/67/1428821667.db2.gz AACRQSKXDLASNM-QFIPXVFZSA-N 2 1 392.547 3.074 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCc3[nH]c4ccc(OC)cc4c3C2)CC1 ZINC000123093228 1414639647 /nfs/dbraw/zinc/63/96/47/1414639647.db2.gz ZPONAZYKAPNBNY-GOSISDBHSA-N 2 1 384.568 3.041 20 0 GGADMP CC(C)[NH+]1CCN(c2cccc(NC(=O)[C@H](c3ccccc3)[NH+](C)C)c2)CC1 ZINC000123244692 1414677275 /nfs/dbraw/zinc/67/72/75/1414677275.db2.gz VMFSLPSBGPAZJA-QFIPXVFZSA-N 2 1 380.536 3.458 20 0 GGADMP C[NH+](C)CCCC1CC[NH+](CC(=O)Nc2ccc(N3CCCCC3)nc2)CC1 ZINC000123301294 1414692045 /nfs/dbraw/zinc/69/20/45/1414692045.db2.gz QUBYAKKBKWXSIT-UHFFFAOYSA-N 2 1 387.572 3.064 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H]3CCC[C@H]3NC(=O)OC(C)(C)C)CC2)nc(C)[nH+]1 ZINC000123413291 1414723200 /nfs/dbraw/zinc/72/32/00/1414723200.db2.gz IEFCEWWKOGNEPY-ZWKOTPCHSA-N 2 1 389.544 3.098 20 0 GGADMP C[C@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123657180 1414805123 /nfs/dbraw/zinc/80/51/23/1414805123.db2.gz ZKZPJGBYBZYYLL-MRXNPFEDSA-N 2 1 383.544 3.312 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000123860965 1414837206 /nfs/dbraw/zinc/83/72/06/1414837206.db2.gz HOQITGPRHOELJP-JOCHJYFZSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000123860431 1414837317 /nfs/dbraw/zinc/83/73/17/1414837317.db2.gz FBNZUJJQHVGPHL-JTHBVZDNSA-N 2 1 396.579 3.441 20 0 GGADMP OC[C@H](Cc1c[nH]c2ccccc12)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000123995325 1414865597 /nfs/dbraw/zinc/86/55/97/1414865597.db2.gz KTKYUEDBGPSWML-QFIPXVFZSA-N 2 1 377.532 3.368 20 0 GGADMP O=C(CN[C@H]1CCCC[C@H]1C(F)(F)F)Nc1nc(CN2CCCC2)cs1 ZINC000124357654 1414948178 /nfs/dbraw/zinc/94/81/78/1414948178.db2.gz YGYOTUGZFHZALF-KGLIPLIRSA-N 2 1 390.475 3.388 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)CC1 ZINC000124382276 1414953552 /nfs/dbraw/zinc/95/35/52/1414953552.db2.gz NKEMVUWZHOGYPH-UHFFFAOYSA-N 2 1 393.019 3.168 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000124502327 1414982649 /nfs/dbraw/zinc/98/26/49/1414982649.db2.gz GPVHNDOTBKGLPF-FPOVZHCZSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000124502327 1414982656 /nfs/dbraw/zinc/98/26/56/1414982656.db2.gz GPVHNDOTBKGLPF-FPOVZHCZSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000124502327 1414982662 /nfs/dbraw/zinc/98/26/62/1414982662.db2.gz GPVHNDOTBKGLPF-FPOVZHCZSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000124502327 1414982668 /nfs/dbraw/zinc/98/26/68/1414982668.db2.gz GPVHNDOTBKGLPF-FPOVZHCZSA-N 2 1 375.532 3.274 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000124939281 1415076718 /nfs/dbraw/zinc/07/67/18/1415076718.db2.gz PXXJQCUFDSKHGW-SFHLNBCPSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000124939281 1415076721 /nfs/dbraw/zinc/07/67/21/1415076721.db2.gz PXXJQCUFDSKHGW-SFHLNBCPSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000124939281 1415076723 /nfs/dbraw/zinc/07/67/23/1415076723.db2.gz PXXJQCUFDSKHGW-SFHLNBCPSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000124946639 1415079037 /nfs/dbraw/zinc/07/90/37/1415079037.db2.gz KOQJREKFBVJLTJ-XAPVIXHLSA-N 2 1 390.616 3.403 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000124946639 1415079043 /nfs/dbraw/zinc/07/90/43/1415079043.db2.gz KOQJREKFBVJLTJ-XAPVIXHLSA-N 2 1 390.616 3.403 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000124946639 1415079050 /nfs/dbraw/zinc/07/90/50/1415079050.db2.gz KOQJREKFBVJLTJ-XAPVIXHLSA-N 2 1 390.616 3.403 20 0 GGADMP CCCOc1ccc(NC(=O)N(CC[NH+](C)C)C[C@@H]2CCC[N@H+]2CC)cc1 ZINC000125014656 1415091656 /nfs/dbraw/zinc/09/16/56/1415091656.db2.gz QKIYVBJUYYJDNV-IBGZPJMESA-N 2 1 376.545 3.355 20 0 GGADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125013734 1415091987 /nfs/dbraw/zinc/09/19/87/1415091987.db2.gz XSAUVQWHTOPGHJ-HOYKHHGWSA-N 2 1 393.531 3.371 20 0 GGADMP C[C@H](CSC(C)(C)C)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125024618 1415094050 /nfs/dbraw/zinc/09/40/50/1415094050.db2.gz YDJOBZHLKWYXLL-QGZVFWFLSA-N 2 1 393.597 3.357 20 0 GGADMP Cc1ccccc1C[C@H](C)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125028659 1415094490 /nfs/dbraw/zinc/09/44/90/1415094490.db2.gz YYCNPIRLYCNXEU-FQEVSTJZSA-N 2 1 395.547 3.377 20 0 GGADMP CC[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125033267 1415095501 /nfs/dbraw/zinc/09/55/01/1415095501.db2.gz IZBORGDWBOYZQQ-QFIPXVFZSA-N 2 1 395.547 3.458 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)cc1 ZINC000125046823 1415099183 /nfs/dbraw/zinc/09/91/83/1415099183.db2.gz KZUDCBGMPPFXJK-SFHVURJKSA-N 2 1 397.519 3.207 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000177846014 1428871455 /nfs/dbraw/zinc/87/14/55/1428871455.db2.gz DURNOPVAKPINTO-SFHVURJKSA-N 2 1 392.975 3.288 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000177851093 1428872769 /nfs/dbraw/zinc/87/27/69/1428872769.db2.gz REKAXZCUNUNWDA-PXNSSMCTSA-N 2 1 392.975 3.460 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000125479576 1415211129 /nfs/dbraw/zinc/21/11/29/1415211129.db2.gz JNNIVLQSKPBMBO-AVRDEDQJSA-N 2 1 384.568 3.213 20 0 GGADMP O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000125498892 1415214716 /nfs/dbraw/zinc/21/47/16/1415214716.db2.gz XEVCYNKJLMCWJR-RXVVDRJESA-N 2 1 379.508 3.031 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCn2cnc3ccccc3c2=O)CC1 ZINC000177867825 1428878255 /nfs/dbraw/zinc/87/82/55/1428878255.db2.gz WVGBJZJHFWTLHC-IBGZPJMESA-N 2 1 382.552 3.373 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000125692943 1415255887 /nfs/dbraw/zinc/25/58/87/1415255887.db2.gz RIFYUIJWDGEIBZ-HSZRJFAPSA-N 2 1 393.531 3.164 20 0 GGADMP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000125692943 1415255892 /nfs/dbraw/zinc/25/58/92/1415255892.db2.gz RIFYUIJWDGEIBZ-HSZRJFAPSA-N 2 1 393.531 3.164 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000125721044 1415262232 /nfs/dbraw/zinc/26/22/32/1415262232.db2.gz QTQHQPWZCKRKPU-IRXDYDNUSA-N 2 1 377.529 3.131 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)C1 ZINC000125804535 1415285842 /nfs/dbraw/zinc/28/58/42/1415285842.db2.gz VTWOGZJGXKVXGQ-AQNXPRMDSA-N 2 1 398.595 3.448 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)[NH+]2CCCC2)o1 ZINC000125824913 1415290780 /nfs/dbraw/zinc/29/07/80/1415290780.db2.gz SONWMSKGZYGZAC-VQTJNVASSA-N 2 1 390.572 3.392 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000125898521 1415307762 /nfs/dbraw/zinc/30/77/62/1415307762.db2.gz OPTFKUXWUNTXJW-KSZLIROESA-N 2 1 391.556 3.379 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(C(=O)Nc2ccc(Cl)cn2)CC1 ZINC000126036666 1415341168 /nfs/dbraw/zinc/34/11/68/1415341168.db2.gz KVMTUIOGIWNRMN-UHFFFAOYSA-N 2 1 375.904 3.371 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C[N@@H+]1C1CC1 ZINC000126175047 1415377333 /nfs/dbraw/zinc/37/73/33/1415377333.db2.gz WWNPZMGHWNJJLO-PXNSSMCTSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C[N@H+]1C1CC1 ZINC000126175047 1415377338 /nfs/dbraw/zinc/37/73/38/1415377338.db2.gz WWNPZMGHWNJJLO-PXNSSMCTSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C[NH+]1C1CC1 ZINC000126175047 1415377348 /nfs/dbraw/zinc/37/73/48/1415377348.db2.gz WWNPZMGHWNJJLO-PXNSSMCTSA-N 2 1 396.535 3.336 20 0 GGADMP C[C@H]1C[C@H](NC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C[NH+]1C1CC1 ZINC000126175047 1415377352 /nfs/dbraw/zinc/37/73/52/1415377352.db2.gz WWNPZMGHWNJJLO-PXNSSMCTSA-N 2 1 396.535 3.336 20 0 GGADMP COCC[N@@H+](C)CCCC1CCN(C(=O)NC2CC[NH+](C(C)(C)C)CC2)CC1 ZINC000126227852 1415388926 /nfs/dbraw/zinc/38/89/26/1415388926.db2.gz GHFHXLJXBHSXIK-UHFFFAOYSA-N 2 1 396.620 3.029 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1 ZINC000177969752 1428907373 /nfs/dbraw/zinc/90/73/73/1428907373.db2.gz ZIVBQMTXHKRNKA-SFHVURJKSA-N 2 1 376.508 3.020 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)NCCC[N@H+]2CCc3ccccc3C2)o1 ZINC000126298704 1415409400 /nfs/dbraw/zinc/40/94/00/1415409400.db2.gz RNYSLWTWBJDFIU-UHFFFAOYSA-N 2 1 398.551 3.110 20 0 GGADMP CNS(=O)(=O)c1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c1 ZINC000177978655 1428912319 /nfs/dbraw/zinc/91/23/19/1428912319.db2.gz FTZSSTVQGZMEFJ-QGZVFWFLSA-N 2 1 389.565 3.286 20 0 GGADMP C[N@@H+](CC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)[C@@H]1CCSC1 ZINC000126330158 1415419280 /nfs/dbraw/zinc/41/92/80/1415419280.db2.gz QISSRZXAPBQRSN-HXUWFJFHSA-N 2 1 375.582 3.116 20 0 GGADMP CCN1CC[NH+](Cc2ccc(C[NH2+][C@H](C)CC(=O)Nc3ccccc3)cc2)CC1 ZINC000126352673 1415424905 /nfs/dbraw/zinc/42/49/05/1415424905.db2.gz ZQIUDVOLSZRJLQ-HXUWFJFHSA-N 2 1 394.563 3.331 20 0 GGADMP O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000126363869 1415427517 /nfs/dbraw/zinc/42/75/17/1415427517.db2.gz YRFRQJWOGFXKHR-OXQOHEQNSA-N 2 1 390.959 3.260 20 0 GGADMP C[C@@H](c1cn(-c2ccccc2)nn1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000126415076 1415445640 /nfs/dbraw/zinc/44/56/40/1415445640.db2.gz FRLDJTLVENEUQL-OTWHNJEPSA-N 2 1 383.540 3.150 20 0 GGADMP C[C@@H](c1cn(-c2ccccc2)nn1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000126415076 1415445650 /nfs/dbraw/zinc/44/56/50/1415445650.db2.gz FRLDJTLVENEUQL-OTWHNJEPSA-N 2 1 383.540 3.150 20 0 GGADMP C[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000126462046 1415459383 /nfs/dbraw/zinc/45/93/83/1415459383.db2.gz VIEHGNYXJYAFAN-UHFFFAOYSA-N 2 1 398.473 3.017 20 0 GGADMP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCN(C)CC3)cc1)CCCO2 ZINC000126654206 1415519005 /nfs/dbraw/zinc/51/90/05/1415519005.db2.gz MRFWVXBNCJOPQC-QHCPKHFHSA-N 2 1 395.547 3.446 20 0 GGADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)CCCO2 ZINC000126663475 1415521031 /nfs/dbraw/zinc/52/10/31/1415521031.db2.gz CKANQAZEXMFYQK-MAUKXSAKSA-N 2 1 379.932 3.039 20 0 GGADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)CCCO2 ZINC000126663475 1415521036 /nfs/dbraw/zinc/52/10/36/1415521036.db2.gz CKANQAZEXMFYQK-MAUKXSAKSA-N 2 1 379.932 3.039 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc2c(c1)OCCCO2 ZINC000126691989 1415528144 /nfs/dbraw/zinc/52/81/44/1415528144.db2.gz GWPMCXITKHQIDI-IBGZPJMESA-N 2 1 395.547 3.446 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000126713371 1415534971 /nfs/dbraw/zinc/53/49/71/1415534971.db2.gz SFSYULYRQDDOOU-MYUZEXMDSA-N 2 1 385.577 3.022 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc([S@](C)=O)cc1 ZINC000126713186 1415535162 /nfs/dbraw/zinc/53/51/62/1415535162.db2.gz SFSYULYRQDDOOU-DNOBIOAJSA-N 2 1 385.577 3.022 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc([S@](C)=O)cc1 ZINC000126712947 1415535294 /nfs/dbraw/zinc/53/52/94/1415535294.db2.gz SFSYULYRQDDOOU-XRHLQHRESA-N 2 1 385.577 3.022 20 0 GGADMP COCc1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)ccc1OC ZINC000126719881 1415538416 /nfs/dbraw/zinc/53/84/16/1415538416.db2.gz XMWHTYGJCSUCAX-LJQANCHMSA-N 2 1 397.563 3.440 20 0 GGADMP CC(C)(C)c1ncc(CNCc2ccccc2OCCN2CCOCC2)s1 ZINC000126745056 1415545089 /nfs/dbraw/zinc/54/50/89/1415545089.db2.gz MDJXWTMKLWIMMN-UHFFFAOYSA-N 2 1 389.565 3.441 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1)[NH+](C)C ZINC000126750725 1415547383 /nfs/dbraw/zinc/54/73/83/1415547383.db2.gz WJGIGKRKFJPXNY-QUCCMNQESA-N 2 1 390.572 3.109 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[NH+](C)C ZINC000126750725 1415547390 /nfs/dbraw/zinc/54/73/90/1415547390.db2.gz WJGIGKRKFJPXNY-QUCCMNQESA-N 2 1 390.572 3.109 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(-n2cnnn2)c1 ZINC000126768878 1415553406 /nfs/dbraw/zinc/55/34/06/1415553406.db2.gz DOOGHDXMDQYUOZ-SJORKVTESA-N 2 1 382.537 3.287 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(-n2cnnn2)c1 ZINC000126768878 1415553417 /nfs/dbraw/zinc/55/34/17/1415553417.db2.gz DOOGHDXMDQYUOZ-SJORKVTESA-N 2 1 382.537 3.287 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(-n2cnnn2)c1 ZINC000126769366 1415554180 /nfs/dbraw/zinc/55/41/80/1415554180.db2.gz DOOGHDXMDQYUOZ-IAGOWNOFSA-N 2 1 382.537 3.287 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(-n2cnnn2)c1 ZINC000126769366 1415554184 /nfs/dbraw/zinc/55/41/84/1415554184.db2.gz DOOGHDXMDQYUOZ-IAGOWNOFSA-N 2 1 382.537 3.287 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=O)N2CC[C@@H](C[N@H+](C)CC)C2)cc1 ZINC000178034326 1428947903 /nfs/dbraw/zinc/94/79/03/1428947903.db2.gz WKYDLPHMLVSBAZ-SFHVURJKSA-N 2 1 376.545 3.213 20 0 GGADMP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)nnn1-c1ccc(F)cc1 ZINC000178038159 1428950591 /nfs/dbraw/zinc/95/05/91/1428950591.db2.gz POKQFIFQBWGTFB-IXDOHACOSA-N 2 1 389.519 3.255 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]C2CCC3(CC2)c2ccccc2NC3=O)C[C@H](C)O1 ZINC000178040311 1428951609 /nfs/dbraw/zinc/95/16/09/1428951609.db2.gz CBJCPHSEMQKKBR-VCALTZMKSA-N 2 1 385.552 3.298 20 0 GGADMP COc1cccc([C@H](CNC(=O)NCCCC[N@H+]2CCC[C@H](C)C2)[NH+](C)C)c1 ZINC000126867043 1415589333 /nfs/dbraw/zinc/58/93/33/1415589333.db2.gz SLQFQLCSTKPKDX-RXVVDRJESA-N 2 1 390.572 3.109 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(-n2cnnn2)cc1 ZINC000126884021 1415594734 /nfs/dbraw/zinc/59/47/34/1415594734.db2.gz GPOHDTMNAUQCLY-SJORKVTESA-N 2 1 382.537 3.287 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(-n2cnnn2)cc1 ZINC000126884021 1415594740 /nfs/dbraw/zinc/59/47/40/1415594740.db2.gz GPOHDTMNAUQCLY-SJORKVTESA-N 2 1 382.537 3.287 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(-n2cnnn2)cc1 ZINC000126884491 1415594775 /nfs/dbraw/zinc/59/47/75/1415594775.db2.gz GPOHDTMNAUQCLY-IAGOWNOFSA-N 2 1 382.537 3.287 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(-n2cnnn2)cc1 ZINC000126884491 1415594782 /nfs/dbraw/zinc/59/47/82/1415594782.db2.gz GPOHDTMNAUQCLY-IAGOWNOFSA-N 2 1 382.537 3.287 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]C/C=C/c2ccc(F)cc2)c1 ZINC000126913577 1415606213 /nfs/dbraw/zinc/60/62/13/1415606213.db2.gz XEGSNFOYHXLCHW-DUXPYHPUSA-N 2 1 397.494 3.290 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)Nc3cccc(C[NH+](C)C)c3)c2)CCO1 ZINC000127261042 1415707565 /nfs/dbraw/zinc/70/75/65/1415707565.db2.gz VFLLZYOKGWLFRK-GOSISDBHSA-N 2 1 396.535 3.291 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)Nc3cccc(C[NH+](C)C)c3)c2)CCO1 ZINC000127261042 1415707576 /nfs/dbraw/zinc/70/75/76/1415707576.db2.gz VFLLZYOKGWLFRK-GOSISDBHSA-N 2 1 396.535 3.291 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000127424382 1415773959 /nfs/dbraw/zinc/77/39/59/1415773959.db2.gz PZYHKZNZHJLUBP-UHFFFAOYSA-N 2 1 375.904 3.475 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+]1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000127424382 1415773968 /nfs/dbraw/zinc/77/39/68/1415773968.db2.gz PZYHKZNZHJLUBP-UHFFFAOYSA-N 2 1 375.904 3.475 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000178133872 1428994415 /nfs/dbraw/zinc/99/44/15/1428994415.db2.gz TWNNQMKIXRTURE-QYZOEREBSA-N 2 1 397.567 3.283 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)[C@@H]3CC[NH+](C4CCCCC4)C3)c2)CCO1 ZINC000178155007 1429001845 /nfs/dbraw/zinc/00/18/45/1429001845.db2.gz ZGBPBBRWSFMMNY-DENIHFKCSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)[C@@H]3CC[NH+](C4CCCCC4)C3)c2)CCO1 ZINC000178155007 1429001850 /nfs/dbraw/zinc/00/18/50/1429001850.db2.gz ZGBPBBRWSFMMNY-DENIHFKCSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@@H]1C[NH+](Cc2cccc(CNC(=O)[C@@H]3CC[N@@H+](C4CCCCC4)C3)c2)CCO1 ZINC000178155007 1429001852 /nfs/dbraw/zinc/00/18/52/1429001852.db2.gz ZGBPBBRWSFMMNY-DENIHFKCSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@@H]1C[NH+](Cc2cccc(CNC(=O)[C@@H]3CC[N@H+](C4CCCCC4)C3)c2)CCO1 ZINC000178155007 1429001856 /nfs/dbraw/zinc/00/18/56/1429001856.db2.gz ZGBPBBRWSFMMNY-DENIHFKCSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C[N@H+]1C1CC1 ZINC000127651445 1415826539 /nfs/dbraw/zinc/82/65/39/1415826539.db2.gz ITYVRFJVFHCNJT-HNAYVOBHSA-N 2 1 390.959 3.229 20 0 GGADMP C[C@H](C[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(F)cc1 ZINC000127899083 1415872567 /nfs/dbraw/zinc/87/25/67/1415872567.db2.gz UNGPQAPZCYYIGV-UTKZUKDTSA-N 2 1 383.511 3.416 20 0 GGADMP Cc1c([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@H](C(N)=O)C2)cnn1-c1cc(C)ccc1C ZINC000127954851 1415883088 /nfs/dbraw/zinc/88/30/88/1415883088.db2.gz AVKDSXJSDCKAME-ICSRJNTNSA-N 2 1 397.567 3.036 20 0 GGADMP Cc1c([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)cnn1-c1cc(C)ccc1C ZINC000127954851 1415883093 /nfs/dbraw/zinc/88/30/93/1415883093.db2.gz AVKDSXJSDCKAME-ICSRJNTNSA-N 2 1 397.567 3.036 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC(C[NH+](C)Cc3ccccc3)CC2)C[N@H+]1C1CC1 ZINC000127968815 1415885106 /nfs/dbraw/zinc/88/51/06/1415885106.db2.gz CDZYEZWESHVYKM-RXVVDRJESA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C[NH+]1C1CC1 ZINC000127968815 1415885109 /nfs/dbraw/zinc/88/51/09/1415885109.db2.gz CDZYEZWESHVYKM-RXVVDRJESA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C[NH+]1C1CC1 ZINC000127968815 1415885110 /nfs/dbraw/zinc/88/51/10/1415885110.db2.gz CDZYEZWESHVYKM-RXVVDRJESA-N 2 1 384.568 3.165 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CC[NH+](C2CCCCC2)C1 ZINC000178203466 1429017587 /nfs/dbraw/zinc/01/75/87/1429017587.db2.gz LHCJAISWTGHNKE-FGZHOGPDSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000178203466 1429017592 /nfs/dbraw/zinc/01/75/92/1429017592.db2.gz LHCJAISWTGHNKE-FGZHOGPDSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000178203466 1429017598 /nfs/dbraw/zinc/01/75/98/1429017598.db2.gz LHCJAISWTGHNKE-FGZHOGPDSA-N 2 1 383.580 3.322 20 0 GGADMP O=C(NCc1ccco1)[C@H]1CCC[N@@H+]1Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000128267933 1415951912 /nfs/dbraw/zinc/95/19/12/1415951912.db2.gz JQELBCLJDYJSGH-JOCHJYFZSA-N 2 1 397.519 3.035 20 0 GGADMP O=C(NCc1ccco1)[C@H]1CCC[N@H+]1Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000128267933 1415951914 /nfs/dbraw/zinc/95/19/14/1415951914.db2.gz JQELBCLJDYJSGH-JOCHJYFZSA-N 2 1 397.519 3.035 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH+]1CCN(c2ccnc(-c3ccccc3)n2)CC1 ZINC000128442420 1415987900 /nfs/dbraw/zinc/98/79/00/1415987900.db2.gz VBPYYHFJEOZECG-UHFFFAOYSA-N 2 1 376.508 3.251 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccco1 ZINC000128728202 1416052525 /nfs/dbraw/zinc/05/25/25/1416052525.db2.gz PXTVGGZUWTZLGG-MOPGFXCFSA-N 2 1 378.561 3.330 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000128780352 1416066911 /nfs/dbraw/zinc/06/69/11/1416066911.db2.gz PLOXKBGGDZDHIP-IRLDBZIGSA-N 2 1 384.568 3.297 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000128780352 1416066920 /nfs/dbraw/zinc/06/69/20/1416066920.db2.gz PLOXKBGGDZDHIP-IRLDBZIGSA-N 2 1 384.568 3.297 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000128780352 1416066933 /nfs/dbraw/zinc/06/69/33/1416066933.db2.gz PLOXKBGGDZDHIP-IRLDBZIGSA-N 2 1 384.568 3.297 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1 ZINC000178339701 1429055400 /nfs/dbraw/zinc/05/54/00/1429055400.db2.gz OXRPBROGXFCGDE-GOSISDBHSA-N 2 1 395.613 3.488 20 0 GGADMP Cc1c(C(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)cnn1-c1cc[nH+]cc1 ZINC000128811287 1416075037 /nfs/dbraw/zinc/07/50/37/1416075037.db2.gz SSKBSPCLDBUFHO-UHFFFAOYSA-N 2 1 399.445 3.058 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[NH+]2CCCCC2)ccc1S(=O)(=O)C(F)F ZINC000178410509 1429072345 /nfs/dbraw/zinc/07/23/45/1429072345.db2.gz CYJZQUMDRMWZSG-AWEZNQCLSA-N 2 1 390.496 3.218 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](C[C@H](O)COc3cccc4[nH]ccc43)C2)CC1 ZINC000129062221 1416135571 /nfs/dbraw/zinc/13/55/71/1416135571.db2.gz WOIKOUMDDYMDGP-PMACEKPBSA-N 2 1 385.552 3.352 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](C[C@H](O)COc3cccc4[nH]ccc43)C2)CC1 ZINC000129062221 1416135576 /nfs/dbraw/zinc/13/55/76/1416135576.db2.gz WOIKOUMDDYMDGP-PMACEKPBSA-N 2 1 385.552 3.352 20 0 GGADMP O=C(CC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)N1CCCCCC1 ZINC000129073206 1416138529 /nfs/dbraw/zinc/13/85/29/1416138529.db2.gz OFHJXPLDGCPVGZ-UHFFFAOYSA-N 2 1 375.532 3.215 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3cccc(F)c3)C2=O)[C@H](C)C1 ZINC000178401458 1429070204 /nfs/dbraw/zinc/07/02/04/1429070204.db2.gz GORMIXZGSLVEBF-JRGCBEDISA-N 2 1 391.531 3.048 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3cccc(F)c3)C2=O)[C@H](C)C1 ZINC000178401458 1429070207 /nfs/dbraw/zinc/07/02/07/1429070207.db2.gz GORMIXZGSLVEBF-JRGCBEDISA-N 2 1 391.531 3.048 20 0 GGADMP Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)[NH+]2CCCC2)cnn1-c1cc[nH+]cc1 ZINC000129358537 1416196303 /nfs/dbraw/zinc/19/63/03/1416196303.db2.gz DYOGWVVQMWLWQQ-JOCHJYFZSA-N 2 1 389.503 3.451 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCCN(CC(F)(F)F)CC1)C1CC[NH+](C)CC1 ZINC000129473530 1416215218 /nfs/dbraw/zinc/21/52/18/1416215218.db2.gz QOECTMSTZLECMA-UHFFFAOYSA-N 2 1 398.517 3.287 20 0 GGADMP Cc1c(C(=O)N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cnn1-c1cc[nH+]cc1 ZINC000129705436 1416251802 /nfs/dbraw/zinc/25/18/02/1416251802.db2.gz NOHQQWDFPNZHDT-IBGZPJMESA-N 2 1 381.524 3.160 20 0 GGADMP COc1ccc(C[N@H+](C)C2CCN(Cc3[nH+]cc(C)c(OC)c3C)CC2)cn1 ZINC000129759273 1416259694 /nfs/dbraw/zinc/25/96/94/1416259694.db2.gz LTOYAZFDUXTOMX-UHFFFAOYSA-N 2 1 384.524 3.207 20 0 GGADMP COc1ccc(C[N@@H+](C)C2CCN(Cc3[nH+]cc(C)c(OC)c3C)CC2)cn1 ZINC000129759273 1416259697 /nfs/dbraw/zinc/25/96/97/1416259697.db2.gz LTOYAZFDUXTOMX-UHFFFAOYSA-N 2 1 384.524 3.207 20 0 GGADMP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000129860003 1416275404 /nfs/dbraw/zinc/27/54/04/1416275404.db2.gz QUAUEIJITOEKBL-XMSQKQJNSA-N 2 1 388.600 3.442 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000129861082 1416275871 /nfs/dbraw/zinc/27/58/71/1416275871.db2.gz KBBRUNXWPABJAZ-IBGZPJMESA-N 2 1 378.605 3.451 20 0 GGADMP CC(C)CC[NH+]1CCC(CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000129984109 1416296251 /nfs/dbraw/zinc/29/62/51/1416296251.db2.gz ZDAIMFBMVKQLCS-RBBKRZOGSA-N 2 1 390.616 3.403 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O ZINC000130363025 1416365205 /nfs/dbraw/zinc/36/52/05/1416365205.db2.gz IGSNAYGWYSAZSJ-QGZVFWFLSA-N 2 1 380.414 3.338 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O ZINC000130363025 1416365210 /nfs/dbraw/zinc/36/52/10/1416365210.db2.gz IGSNAYGWYSAZSJ-QGZVFWFLSA-N 2 1 380.414 3.338 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2CNC(=O)c2ccc(C[NH+](C)C)cc2)C[C@H](C)O1 ZINC000130369082 1416365968 /nfs/dbraw/zinc/36/59/68/1416365968.db2.gz UFENHYXAMBINEG-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2CNC(=O)c2ccc(C[NH+](C)C)cc2)C[C@H](C)O1 ZINC000130369082 1416365971 /nfs/dbraw/zinc/36/59/71/1416365971.db2.gz UFENHYXAMBINEG-KDURUIRLSA-N 2 1 395.547 3.287 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc(C(=O)OC(C)C)cc1 ZINC000130470136 1416383333 /nfs/dbraw/zinc/38/33/33/1416383333.db2.gz IPLPTRWJXWWIAL-MRXNPFEDSA-N 2 1 386.496 3.106 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)C(=O)Nc1ccc(C(=O)OC(C)C)cc1 ZINC000130470136 1416383339 /nfs/dbraw/zinc/38/33/39/1416383339.db2.gz IPLPTRWJXWWIAL-MRXNPFEDSA-N 2 1 386.496 3.106 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)NCc1ccccc1OC1CCCC1 ZINC000130606770 1416408544 /nfs/dbraw/zinc/40/85/44/1416408544.db2.gz SPUUVJSKVWBAOX-UHFFFAOYSA-N 2 1 384.524 3.151 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)NCc1ccccc1OC1CCCC1 ZINC000130606770 1416408555 /nfs/dbraw/zinc/40/85/55/1416408555.db2.gz SPUUVJSKVWBAOX-UHFFFAOYSA-N 2 1 384.524 3.151 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCSCC1)N1CC[NH+](C2CCCC2)CC1 ZINC000130671335 1416422107 /nfs/dbraw/zinc/42/21/07/1416422107.db2.gz PTNZIWCPSMMYPU-UHFFFAOYSA-N 2 1 388.581 3.328 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2cccs2)C1 ZINC000130678142 1416423373 /nfs/dbraw/zinc/42/33/73/1416423373.db2.gz CFEZBYZGHLINIS-SFHVURJKSA-N 2 1 380.602 3.189 20 0 GGADMP C[C@H](C[NH+]1CCCCC1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000130685978 1416425089 /nfs/dbraw/zinc/42/50/89/1416425089.db2.gz LLJRXDGFZIFILU-QGZVFWFLSA-N 2 1 376.570 3.231 20 0 GGADMP CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)[N@H+](C)CCCn2cc[nH+]c2C)c1 ZINC000130883961 1416475129 /nfs/dbraw/zinc/47/51/29/1416475129.db2.gz PWBMVXOUEMWDHL-QGZVFWFLSA-N 2 1 399.539 3.023 20 0 GGADMP CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)[N@@H+](C)CCCn2cc[nH+]c2C)c1 ZINC000130883961 1416475132 /nfs/dbraw/zinc/47/51/32/1416475132.db2.gz PWBMVXOUEMWDHL-QGZVFWFLSA-N 2 1 399.539 3.023 20 0 GGADMP COc1ccc(C[NH+]2CCC(C(=O)NCC[N@@H+](C)Cc3ccccc3)CC2)cc1 ZINC000130907601 1416479470 /nfs/dbraw/zinc/47/94/70/1416479470.db2.gz SUEZSWOHLJGAGY-UHFFFAOYSA-N 2 1 395.547 3.155 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)o1 ZINC000130917967 1416480997 /nfs/dbraw/zinc/48/09/97/1416480997.db2.gz QGIIDHPVGUPEFU-IBGZPJMESA-N 2 1 378.561 3.029 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](C)C[C@@H]2c2ccccc2)c1 ZINC000131062082 1416503542 /nfs/dbraw/zinc/50/35/42/1416503542.db2.gz SQYROTMAFURCFT-JOCHJYFZSA-N 2 1 380.536 3.337 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](C)C[C@@H]2c2ccccc2)c1 ZINC000131062082 1416503545 /nfs/dbraw/zinc/50/35/45/1416503545.db2.gz SQYROTMAFURCFT-JOCHJYFZSA-N 2 1 380.536 3.337 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)c1 ZINC000131062082 1416503549 /nfs/dbraw/zinc/50/35/49/1416503549.db2.gz SQYROTMAFURCFT-JOCHJYFZSA-N 2 1 380.536 3.337 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)c1 ZINC000131062082 1416503551 /nfs/dbraw/zinc/50/35/51/1416503551.db2.gz SQYROTMAFURCFT-JOCHJYFZSA-N 2 1 380.536 3.337 20 0 GGADMP Cc1ccc([C@H](CNC(=O)NC[C@@H](c2ccco2)[NH+](C)C)[NH+]2CCCC2)cc1 ZINC000131119391 1416512013 /nfs/dbraw/zinc/51/20/13/1416512013.db2.gz XTALBLUHIQFJEE-PMACEKPBSA-N 2 1 384.524 3.327 20 0 GGADMP CCN(C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)[C@@H](C)c1ccc(F)cc1 ZINC000131322188 1416539876 /nfs/dbraw/zinc/53/98/76/1416539876.db2.gz DFBHYJGZDDKFBZ-ZWKOTPCHSA-N 2 1 386.515 3.423 20 0 GGADMP CCN(C(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1)[C@@H](C)c1ccc(F)cc1 ZINC000131322188 1416539877 /nfs/dbraw/zinc/53/98/77/1416539877.db2.gz DFBHYJGZDDKFBZ-ZWKOTPCHSA-N 2 1 386.515 3.423 20 0 GGADMP CC[NH+](CC)Cc1cccc(CNC(=O)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c1 ZINC000131667100 1416593822 /nfs/dbraw/zinc/59/38/22/1416593822.db2.gz GKIBEFQNOPMKBE-QHCPKHFHSA-N 2 1 395.547 3.046 20 0 GGADMP CC[NH+](CC)Cc1cccc(CNC(=O)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c1 ZINC000131667100 1416593824 /nfs/dbraw/zinc/59/38/24/1416593824.db2.gz GKIBEFQNOPMKBE-QHCPKHFHSA-N 2 1 395.547 3.046 20 0 GGADMP Cc1nn(C)cc1[C@@H](C)[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000178575051 1429110927 /nfs/dbraw/zinc/11/09/27/1429110927.db2.gz LXPDMQJGJQKWGU-QGZVFWFLSA-N 2 1 386.540 3.069 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000178604132 1429119743 /nfs/dbraw/zinc/11/97/43/1429119743.db2.gz SKWLXUJTMAKPKK-PKTZIBPZSA-N 2 1 399.579 3.002 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000178604132 1429119751 /nfs/dbraw/zinc/11/97/51/1429119751.db2.gz SKWLXUJTMAKPKK-PKTZIBPZSA-N 2 1 399.579 3.002 20 0 GGADMP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000132166924 1416710673 /nfs/dbraw/zinc/71/06/73/1416710673.db2.gz GYLMHLJJUUMEHH-QGZVFWFLSA-N 2 1 381.586 3.100 20 0 GGADMP CC(C)(C)c1nn(-c2ccccc2)cc1C[NH2+]CCCC[N@H+]1CCC[C@@H]1CO ZINC000132327434 1416736797 /nfs/dbraw/zinc/73/67/97/1416736797.db2.gz XAXWPKXVCUWZEV-OAQYLSRUSA-N 2 1 384.568 3.496 20 0 GGADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccc(NS(C)(=O)=O)c1 ZINC000132356786 1416743988 /nfs/dbraw/zinc/74/39/88/1416743988.db2.gz SQBAAZYYBKGRHB-QGZVFWFLSA-N 2 1 387.549 3.373 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000132376515 1416748791 /nfs/dbraw/zinc/74/87/91/1416748791.db2.gz MPQGEKFGENFOKT-NRFANRHFSA-N 2 1 375.532 3.371 20 0 GGADMP C[NH+](C)CCCC1CCN(C(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000132376515 1416748797 /nfs/dbraw/zinc/74/87/97/1416748797.db2.gz MPQGEKFGENFOKT-NRFANRHFSA-N 2 1 375.532 3.371 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1nnc2ccccn21 ZINC000132831082 1416820477 /nfs/dbraw/zinc/82/04/77/1416820477.db2.gz KBWMWJYFXFLACK-KRWDZBQOSA-N 2 1 378.524 3.111 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC2CC[NH+]([C@H](C)c3ccncc3)CC2)[nH+]c1 ZINC000132952055 1416835231 /nfs/dbraw/zinc/83/52/31/1416835231.db2.gz VOUXTLOGNUNAFT-GOSISDBHSA-N 2 1 396.539 3.112 20 0 GGADMP COC(=O)c1ccccc1-c1ccc(C[NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)o1 ZINC000132965100 1416836633 /nfs/dbraw/zinc/83/66/33/1416836633.db2.gz WJWRSIFNALQJOM-NRFANRHFSA-N 2 1 399.535 3.095 20 0 GGADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCC(=O)N1CC[NH+](C)CC1 ZINC000178667256 1429133319 /nfs/dbraw/zinc/13/33/19/1429133319.db2.gz HGQCYSBAJAMJLJ-AWEZNQCLSA-N 2 1 390.528 3.072 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1cc2ccccc2c(Cl)n1 ZINC000178666200 1429133334 /nfs/dbraw/zinc/13/33/34/1429133334.db2.gz YODSOSJLOPAVAQ-QGZVFWFLSA-N 2 1 388.943 3.376 20 0 GGADMP CC(C)OCCN1CCC([NH2+][C@@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)CC1 ZINC000133015344 1416842310 /nfs/dbraw/zinc/84/23/10/1416842310.db2.gz HOAGKTSCHACFSR-OALUTQOASA-N 2 1 387.568 3.222 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(NC[C@](C)(O)C[NH+](C)C)n1 ZINC000133027925 1416843543 /nfs/dbraw/zinc/84/35/43/1416843543.db2.gz UGVPHEWMOJFYGI-NRFANRHFSA-N 2 1 399.564 3.144 20 0 GGADMP CCC(CC)[C@@H](C[NH2+]C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)[NH+](C)C ZINC000133124986 1416854827 /nfs/dbraw/zinc/85/48/27/1416854827.db2.gz IUXSHUMOLRAPGO-OAQYLSRUSA-N 2 1 395.613 3.104 20 0 GGADMP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000178676231 1429137094 /nfs/dbraw/zinc/13/70/94/1429137094.db2.gz KEMIFBGIVSLNAF-GOSISDBHSA-N 2 1 399.510 3.219 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@H]1C)[NH+]1CCSCC1 ZINC000133127804 1416855217 /nfs/dbraw/zinc/85/52/17/1416855217.db2.gz VCSSOSDPJTXILY-QZTJIDSGSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1C[N@H+]1CCCC[C@H]1C)[NH+]1CCSCC1 ZINC000133127804 1416855219 /nfs/dbraw/zinc/85/52/19/1416855219.db2.gz VCSSOSDPJTXILY-QZTJIDSGSA-N 2 1 375.582 3.115 20 0 GGADMP CC(C)[N@H+](C)Cc1cccc(CNC(=O)[C@@H]2C[NH+](Cc3ccccc3)CCO2)c1 ZINC000133312860 1416877390 /nfs/dbraw/zinc/87/73/90/1416877390.db2.gz CAYLQQOPNPTOLD-QHCPKHFHSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[N@@H+](C)Cc1cccc(CNC(=O)[C@@H]2C[NH+](Cc3ccccc3)CCO2)c1 ZINC000133312860 1416877391 /nfs/dbraw/zinc/87/73/91/1416877391.db2.gz CAYLQQOPNPTOLD-QHCPKHFHSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[NH+](C)Cc1cccc(CNC(=O)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c1 ZINC000133312860 1416877392 /nfs/dbraw/zinc/87/73/92/1416877392.db2.gz CAYLQQOPNPTOLD-QHCPKHFHSA-N 2 1 395.547 3.044 20 0 GGADMP CC(C)[NH+](C)Cc1cccc(CNC(=O)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c1 ZINC000133312860 1416877393 /nfs/dbraw/zinc/87/73/93/1416877393.db2.gz CAYLQQOPNPTOLD-QHCPKHFHSA-N 2 1 395.547 3.044 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cnc(C4CCC4)s3)c2)C1 ZINC000133314569 1416877719 /nfs/dbraw/zinc/87/77/19/1416877719.db2.gz VBRYFRXWZJIQTP-IBGZPJMESA-N 2 1 398.576 3.398 20 0 GGADMP CCN(CC)C(=O)[C@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccccc1 ZINC000178695595 1429143955 /nfs/dbraw/zinc/14/39/55/1429143955.db2.gz WNVVAECCRLFGQP-JOCHJYFZSA-N 2 1 395.551 3.262 20 0 GGADMP Cc1c(C(=O)NCC2([NH+]3CCSCC3)CCCCC2)cnn1-c1cc[nH+]cc1 ZINC000133806446 1416967388 /nfs/dbraw/zinc/96/73/88/1416967388.db2.gz XTJUTSYFLLQEJA-UHFFFAOYSA-N 2 1 399.564 3.057 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000133863159 1416981717 /nfs/dbraw/zinc/98/17/17/1416981717.db2.gz YKKIXZIVCFCVGK-QRVBRYPASA-N 2 1 387.572 3.027 20 0 GGADMP CC(C)n1ncc2cc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)c(Cl)nc21 ZINC000134078257 1417018717 /nfs/dbraw/zinc/01/87/17/1417018717.db2.gz WDWDVMBWYZPYNJ-UHFFFAOYSA-N 2 1 391.947 3.210 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)[C@@H]2CCCCCC[C@@H]2[NH3+])C[C@@H](C)O1 ZINC000178719596 1429151358 /nfs/dbraw/zinc/15/13/58/1429151358.db2.gz QCISIILWRCMJMY-YHBROIRLSA-N 2 1 387.568 3.210 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+][C@@H]3CCCC[C@H]3Cc3ccccc3)cn2)CC1 ZINC000134277801 1417048656 /nfs/dbraw/zinc/04/86/56/1417048656.db2.gz UPPZTGPOAIICGT-FCHUYYIVSA-N 2 1 379.552 3.120 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cnc(C4CC4)s3)c2)C1 ZINC000134301100 1417052623 /nfs/dbraw/zinc/05/26/23/1417052623.db2.gz VBMHSHAAMRYNJJ-GOSISDBHSA-N 2 1 384.549 3.008 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+][C@H](Cc3ccccc3)c3cccs3)cn2)CC1 ZINC000134336021 1417057093 /nfs/dbraw/zinc/05/70/93/1417057093.db2.gz ZQRBZRRWJUONFS-HXUWFJFHSA-N 2 1 393.560 3.364 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+][C@@H](Cc3ccccc3)c3cccs3)cn2)CC1 ZINC000134336001 1417057204 /nfs/dbraw/zinc/05/72/04/1417057204.db2.gz ZQRBZRRWJUONFS-FQEVSTJZSA-N 2 1 393.560 3.364 20 0 GGADMP C[C@@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(-c2ccncc2)cc1 ZINC000134383165 1417063079 /nfs/dbraw/zinc/06/30/79/1417063079.db2.gz YUVNOGFCYWVQFO-GOSISDBHSA-N 2 1 388.519 3.141 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000178734805 1429156676 /nfs/dbraw/zinc/15/66/76/1429156676.db2.gz VKIZAQFZIFQHRJ-MOPGFXCFSA-N 2 1 376.545 3.084 20 0 GGADMP CS[C@H]1CCCC[N@H+]([C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000134545336 1417084857 /nfs/dbraw/zinc/08/48/57/1417084857.db2.gz KEDPHPVZERCBKK-RXVVDRJESA-N 2 1 389.609 3.373 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cccs1 ZINC000178739206 1429157800 /nfs/dbraw/zinc/15/78/00/1429157800.db2.gz VCNPGDCADNWOPN-KBAYOESNSA-N 2 1 376.570 3.009 20 0 GGADMP CS[C@@H]1CCCC[N@@H+](CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)C1 ZINC000134608589 1417095967 /nfs/dbraw/zinc/09/59/67/1417095967.db2.gz YVMKIKQGYQDMGX-LJQANCHMSA-N 2 1 393.622 3.391 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(OCCC[NH+](C)C)cc1)[N@@H+]1CCc2ccccc2C1 ZINC000134873973 1417137555 /nfs/dbraw/zinc/13/75/55/1417137555.db2.gz FGTRCQORKNHSDI-SFHVURJKSA-N 2 1 381.520 3.402 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(OCCC[NH+](C)C)cc1)[N@H+]1CCc2ccccc2C1 ZINC000134873973 1417137558 /nfs/dbraw/zinc/13/75/58/1417137558.db2.gz FGTRCQORKNHSDI-SFHVURJKSA-N 2 1 381.520 3.402 20 0 GGADMP C[C@H](CNC(=O)NCc1ccc(C[NH+](C)C)c(F)c1)[N@H+]1CCc2ccccc2C1 ZINC000134994298 1417157708 /nfs/dbraw/zinc/15/77/08/1417157708.db2.gz UJQXDFBPUQRLIN-QGZVFWFLSA-N 2 1 398.526 3.133 20 0 GGADMP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000135050265 1417167400 /nfs/dbraw/zinc/16/74/00/1417167400.db2.gz OCXBSIYEJYCILF-UHFFFAOYSA-N 2 1 378.586 3.081 20 0 GGADMP C[C@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000135266450 1417200080 /nfs/dbraw/zinc/20/00/80/1417200080.db2.gz WJLWBRQGVXUPMS-PXNSSMCTSA-N 2 1 394.531 3.271 20 0 GGADMP CC[N@@H+](CCNC(=O)NC[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000135343292 1417209825 /nfs/dbraw/zinc/20/98/25/1417209825.db2.gz SUIXUSGZTPNIOH-DNVCBOLYSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+](CCNC(=O)NC[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000135343292 1417209831 /nfs/dbraw/zinc/20/98/31/1417209831.db2.gz SUIXUSGZTPNIOH-DNVCBOLYSA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+](CCNC(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000135343292 1417209834 /nfs/dbraw/zinc/20/98/34/1417209834.db2.gz SUIXUSGZTPNIOH-DNVCBOLYSA-N 2 1 396.938 3.255 20 0 GGADMP CC(C)[N@@H+](C)CCNC(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135343673 1417209955 /nfs/dbraw/zinc/20/99/55/1417209955.db2.gz DHKTZMMJHJRFQW-MAUKXSAKSA-N 2 1 384.927 3.111 20 0 GGADMP CC(C)[NH+](C)CCNC(=O)NC[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135343673 1417209960 /nfs/dbraw/zinc/20/99/60/1417209960.db2.gz DHKTZMMJHJRFQW-MAUKXSAKSA-N 2 1 384.927 3.111 20 0 GGADMP CC(C)[NH+](C)CCNC(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135343673 1417209967 /nfs/dbraw/zinc/20/99/67/1417209967.db2.gz DHKTZMMJHJRFQW-MAUKXSAKSA-N 2 1 384.927 3.111 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000136017047 1417286482 /nfs/dbraw/zinc/28/64/82/1417286482.db2.gz SWOKNTZEQWJMJW-OALUTQOASA-N 2 1 397.567 3.428 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cc(F)c(F)cc3F)c2)C1 ZINC000136089959 1417291439 /nfs/dbraw/zinc/29/14/39/1417291439.db2.gz ZEKBUJHOGNOYSK-INIZCTEOSA-N 2 1 391.437 3.091 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(F)c(F)cc3F)c2)C1 ZINC000136089959 1417291451 /nfs/dbraw/zinc/29/14/51/1417291451.db2.gz ZEKBUJHOGNOYSK-INIZCTEOSA-N 2 1 391.437 3.091 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NCc2ccc(C[NH+](C)C)c(F)c2)C[N@H+]1Cc1ccccc1 ZINC000136170334 1417297913 /nfs/dbraw/zinc/29/79/13/1417297913.db2.gz ZKGLRXRXWLJATD-LAUBAEHRSA-N 2 1 398.526 3.350 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NC[C@@H](c3ccccc3)[NH+]3CCCC3)CC2)c1 ZINC000136187235 1417299114 /nfs/dbraw/zinc/29/91/14/1417299114.db2.gz HVTJOUZZJYAYBE-NRFANRHFSA-N 2 1 393.535 3.059 20 0 GGADMP C[C@@H](CCc1ccc(O)cc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000136415538 1417315099 /nfs/dbraw/zinc/31/50/99/1417315099.db2.gz SWWMBUASJXQHAW-AVRDEDQJSA-N 2 1 395.547 3.200 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c(SC)cc1OC ZINC000136558346 1417326119 /nfs/dbraw/zinc/32/61/19/1417326119.db2.gz NXLGFFDYGDPWFO-ROUUACIJSA-N 2 1 394.581 3.283 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c(SC)cc1OC ZINC000136558384 1417326240 /nfs/dbraw/zinc/32/62/40/1417326240.db2.gz NXLGFFDYGDPWFO-QZTJIDSGSA-N 2 1 394.581 3.283 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc1 ZINC000136575423 1417327774 /nfs/dbraw/zinc/32/77/74/1417327774.db2.gz AAAYKCNTGLCRSU-UHFFFAOYSA-N 2 1 395.551 3.264 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1OC(F)F ZINC000136576577 1417328193 /nfs/dbraw/zinc/32/81/93/1417328193.db2.gz JNKCQLDVYMFKTF-IAGOWNOFSA-N 2 1 384.467 3.154 20 0 GGADMP COc1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1OC(F)F ZINC000136576500 1417328212 /nfs/dbraw/zinc/32/82/12/1417328212.db2.gz JNKCQLDVYMFKTF-SJORKVTESA-N 2 1 384.467 3.154 20 0 GGADMP CCCOc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)ccc1OC ZINC000136582327 1417329022 /nfs/dbraw/zinc/32/90/22/1417329022.db2.gz LMVJMKANHXFBID-PMACEKPBSA-N 2 1 376.541 3.342 20 0 GGADMP CCCOc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1OC ZINC000136581053 1417329078 /nfs/dbraw/zinc/32/90/78/1417329078.db2.gz QNVNJGWABAJQBW-VQTJNVASSA-N 2 1 376.541 3.342 20 0 GGADMP CCCOc1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1OC ZINC000136581018 1417329129 /nfs/dbraw/zinc/32/91/29/1417329129.db2.gz QNVNJGWABAJQBW-WOJBJXKFSA-N 2 1 376.541 3.342 20 0 GGADMP CCCOc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)ccc1OC ZINC000136582367 1417329501 /nfs/dbraw/zinc/32/95/01/1417329501.db2.gz LMVJMKANHXFBID-WOJBJXKFSA-N 2 1 376.541 3.342 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000136586166 1417329758 /nfs/dbraw/zinc/32/97/58/1417329758.db2.gz ZABNOUXSSAPVFJ-DHIUTWEWSA-N 2 1 382.552 3.347 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000136586092 1417329849 /nfs/dbraw/zinc/32/98/49/1417329849.db2.gz ZABNOUXSSAPVFJ-PKTZIBPZSA-N 2 1 382.552 3.347 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)CC1 ZINC000136745150 1417343335 /nfs/dbraw/zinc/34/33/35/1417343335.db2.gz YZHAURPYADVYRF-IFMALSPDSA-N 2 1 384.568 3.085 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC2CC[NH+](C[C@@H]3CCOC3)CC2)cc1)C(C)C ZINC000136816073 1417347912 /nfs/dbraw/zinc/34/79/12/1417347912.db2.gz VFJGPVXMRYDLCN-FQEVSTJZSA-N 2 1 387.568 3.148 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)N1CCC[C@H](Cc2nccn2C)C1 ZINC000136859998 1417350948 /nfs/dbraw/zinc/35/09/48/1417350948.db2.gz DBPKUZGDCALMAL-RBUKOAKNSA-N 2 1 375.561 3.039 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N1CCC[C@H](Cc2nccn2C)C1 ZINC000136859955 1417351308 /nfs/dbraw/zinc/35/13/08/1417351308.db2.gz DBPKUZGDCALMAL-RTBURBONSA-N 2 1 375.561 3.039 20 0 GGADMP Cc1cccc(N2CCC([NH2+][C@H](C)CCCOc3ccccc3C(N)=O)CC2)[nH+]1 ZINC000137467659 1417387138 /nfs/dbraw/zinc/38/71/38/1417387138.db2.gz RJHIKSDUXRSGFK-QGZVFWFLSA-N 2 1 396.535 3.295 20 0 GGADMP Cc1cc(C)c(NC(=O)CCC[NH+]2CCC([N@H+](C)CCCO)CC2)c(C)c1 ZINC000137471307 1417387717 /nfs/dbraw/zinc/38/77/17/1417387717.db2.gz UZIXAEGCAWXFMR-UHFFFAOYSA-N 2 1 375.557 3.109 20 0 GGADMP Cc1cc(C)c(NC(=O)CCC[NH+]2CCC([N@@H+](C)CCCO)CC2)c(C)c1 ZINC000137471307 1417387723 /nfs/dbraw/zinc/38/77/23/1417387723.db2.gz UZIXAEGCAWXFMR-UHFFFAOYSA-N 2 1 375.557 3.109 20 0 GGADMP Cc1ccc(N2CCC([NH2+][C@@H](C)CCCOc3ccccc3C(N)=O)CC2)[nH+]c1 ZINC000137481566 1417387730 /nfs/dbraw/zinc/38/77/30/1417387730.db2.gz CSOYRXFWTTXCDS-SFHVURJKSA-N 2 1 396.535 3.295 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)[NH+]2CCCC2)cc1 ZINC000138026328 1417402254 /nfs/dbraw/zinc/40/22/54/1417402254.db2.gz OHLAZNJFMPDCJW-VSKRKVRLSA-N 2 1 384.568 3.258 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cccc(C[NH+]3CCCC3)c2)cn1 ZINC000139333557 1417456712 /nfs/dbraw/zinc/45/67/12/1417456712.db2.gz CTIFPDYWVIRDHJ-UHFFFAOYSA-N 2 1 375.476 3.102 20 0 GGADMP C[N@@H+]1CCC[C@@H]2C[NH+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@@H]21 ZINC000140021057 1417484940 /nfs/dbraw/zinc/48/49/40/1417484940.db2.gz ZLQDCYGNJFTEIX-XXBNENTESA-N 2 1 392.547 3.200 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@@H]21 ZINC000140021057 1417484942 /nfs/dbraw/zinc/48/49/42/1417484942.db2.gz ZLQDCYGNJFTEIX-XXBNENTESA-N 2 1 392.547 3.200 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@@H]21 ZINC000140021057 1417484947 /nfs/dbraw/zinc/48/49/47/1417484947.db2.gz ZLQDCYGNJFTEIX-XXBNENTESA-N 2 1 392.547 3.200 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)CC[C@@H]21 ZINC000140021057 1417484951 /nfs/dbraw/zinc/48/49/51/1417484951.db2.gz ZLQDCYGNJFTEIX-XXBNENTESA-N 2 1 392.547 3.200 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000140094045 1417488211 /nfs/dbraw/zinc/48/82/11/1417488211.db2.gz OIXCELUMRZSCRK-JOCHJYFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000140094045 1417488217 /nfs/dbraw/zinc/48/82/17/1417488217.db2.gz OIXCELUMRZSCRK-JOCHJYFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000140094045 1417488221 /nfs/dbraw/zinc/48/82/21/1417488221.db2.gz OIXCELUMRZSCRK-JOCHJYFZSA-N 2 1 380.536 3.212 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H](C)[NH+]2CCc3ccccc3C2)c1 ZINC000140741652 1417514923 /nfs/dbraw/zinc/51/49/23/1417514923.db2.gz YOQDORNWRUKBAJ-LJQANCHMSA-N 2 1 394.563 3.384 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NC[C@@H](C)[N@@H+]2CCc3ccccc3C2)c1 ZINC000140741652 1417514946 /nfs/dbraw/zinc/51/49/46/1417514946.db2.gz YOQDORNWRUKBAJ-LJQANCHMSA-N 2 1 394.563 3.384 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)c1 ZINC000140741652 1417514962 /nfs/dbraw/zinc/51/49/62/1417514962.db2.gz YOQDORNWRUKBAJ-LJQANCHMSA-N 2 1 394.563 3.384 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@H]1[NH2+]CCc2ccccc21 ZINC000178845502 1429193022 /nfs/dbraw/zinc/19/30/22/1429193022.db2.gz WSBXJTPZILSLPT-OFNKIYASSA-N 2 1 377.532 3.244 20 0 GGADMP C[C@@H](CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000142201955 1417576617 /nfs/dbraw/zinc/57/66/17/1417576617.db2.gz OHCGHQWXAHUFIU-MSOLQXFVSA-N 2 1 392.613 3.380 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000143601736 1417642912 /nfs/dbraw/zinc/64/29/12/1417642912.db2.gz CSMPIWRSLBUPRA-UHFFFAOYSA-N 2 1 389.503 3.104 20 0 GGADMP [NH3+]CCCCCCC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000178856291 1429198443 /nfs/dbraw/zinc/19/84/43/1429198443.db2.gz HCUMHEMDARHCJZ-UHFFFAOYSA-N 2 1 396.373 3.439 20 0 GGADMP C[C@@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000145590715 1417692920 /nfs/dbraw/zinc/69/29/20/1417692920.db2.gz HZMZKXMQDSEOKU-MOPGFXCFSA-N 2 1 388.625 3.236 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000149004976 1417770692 /nfs/dbraw/zinc/77/06/92/1417770692.db2.gz IQBKTVPQDMVCER-QGZVFWFLSA-N 2 1 378.586 3.132 20 0 GGADMP CC(C)OCC[NH+]1CCC([NH2+]CC2CCN(C(=O)OC(C)(C)C)CC2)CC1 ZINC000150944734 1417841506 /nfs/dbraw/zinc/84/15/06/1417841506.db2.gz CHJZCXPOFUFGFO-UHFFFAOYSA-N 2 1 383.577 3.113 20 0 GGADMP O=S(=O)(CCC[NH+]1CCC(CCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000178912837 1429218738 /nfs/dbraw/zinc/21/87/38/1429218738.db2.gz ICTOMYKSMVGQQL-UHFFFAOYSA-N 2 1 378.582 3.438 20 0 GGADMP Cc1cccc(NC[C@@H]2CC[N@H+](C[C@H](O)COc3ccccc3Cl)C2)[nH+]1 ZINC000151114901 1417875032 /nfs/dbraw/zinc/87/50/32/1417875032.db2.gz CWPSTMGSZPMVIP-IRXDYDNUSA-N 2 1 375.900 3.217 20 0 GGADMP Cc1cccc(NC[C@@H]2CC[N@@H+](C[C@H](O)COc3ccccc3Cl)C2)[nH+]1 ZINC000151114901 1417875034 /nfs/dbraw/zinc/87/50/34/1417875034.db2.gz CWPSTMGSZPMVIP-IRXDYDNUSA-N 2 1 375.900 3.217 20 0 GGADMP CC[NH+]1CCC(NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000151424459 1417961454 /nfs/dbraw/zinc/96/14/54/1417961454.db2.gz COOLWBDBEUXYPP-UNMCSNQZSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1)C[NH+]1CCCC1 ZINC000151555219 1418023205 /nfs/dbraw/zinc/02/32/05/1418023205.db2.gz QDEODDGWYFNWRY-YMPZKCBVSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[N@@H+](CC(=O)NC1CC[NH+](CC)CC1)[C@@H]1C[C@H](OCC)C12CCCC2 ZINC000151651732 1418050763 /nfs/dbraw/zinc/05/07/63/1418050763.db2.gz QEPFVXOZIRZXOO-UXHICEINSA-N 2 1 379.589 3.037 20 0 GGADMP FC(F)(F)c1ccnc(NCC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)n1 ZINC000151756854 1418079320 /nfs/dbraw/zinc/07/93/20/1418079320.db2.gz MSDJBSNPTMBIDN-UHFFFAOYSA-N 2 1 393.457 3.204 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1)[NH+](C)C1CC1 ZINC000151759315 1418079863 /nfs/dbraw/zinc/07/98/63/1418079863.db2.gz SKLQJYCYWXSXNR-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)[N@H+](C)C1CC1 ZINC000151759315 1418079871 /nfs/dbraw/zinc/07/98/71/1418079871.db2.gz SKLQJYCYWXSXNR-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)[N@@H+](C)C1CC1 ZINC000151759315 1418079877 /nfs/dbraw/zinc/07/98/77/1418079877.db2.gz SKLQJYCYWXSXNR-SYYKKAFVSA-N 2 1 384.568 3.165 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000151806150 1418091677 /nfs/dbraw/zinc/09/16/77/1418091677.db2.gz PWSANFQNJGNFDY-UHFFFAOYSA-N 2 1 386.500 3.255 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000151806150 1418091679 /nfs/dbraw/zinc/09/16/79/1418091679.db2.gz PWSANFQNJGNFDY-UHFFFAOYSA-N 2 1 386.500 3.255 20 0 GGADMP C[C@H]1C[NH+](CCC2CC[NH+](Cc3cnn(C)c3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000152023481 1418123137 /nfs/dbraw/zinc/12/31/37/1418123137.db2.gz KOPJOJSCNNEBTQ-GJZGRUSLSA-N 2 1 388.478 3.150 20 0 GGADMP COC(=O)c1ccc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000152023872 1418123266 /nfs/dbraw/zinc/12/32/66/1418123266.db2.gz USUJSVXFRUETPS-CALCHBBNSA-N 2 1 392.515 3.324 20 0 GGADMP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3cnn(C)c3C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000152023564 1418123364 /nfs/dbraw/zinc/12/33/64/1418123364.db2.gz KOPJOJSCNNEBTQ-HUUCEWRRSA-N 2 1 388.478 3.150 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)C1 ZINC000152071874 1418137552 /nfs/dbraw/zinc/13/75/52/1418137552.db2.gz GQYBVWUZETWVKM-RBUKOAKNSA-N 2 1 387.572 3.027 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)CC2)[nH+]c1 ZINC000178993448 1429237506 /nfs/dbraw/zinc/23/75/06/1429237506.db2.gz QBHDCLPDNQVKJY-FPOVZHCZSA-N 2 1 382.552 3.082 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)CC2)[nH+]c1 ZINC000178993448 1429237513 /nfs/dbraw/zinc/23/75/13/1429237513.db2.gz QBHDCLPDNQVKJY-FPOVZHCZSA-N 2 1 382.552 3.082 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NCCC[N@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000152195324 1418170304 /nfs/dbraw/zinc/17/03/04/1418170304.db2.gz ZUUUBPDIPLHWAE-CEXWTWQISA-N 2 1 375.561 3.160 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000152195324 1418170308 /nfs/dbraw/zinc/17/03/08/1418170308.db2.gz ZUUUBPDIPLHWAE-CEXWTWQISA-N 2 1 375.561 3.160 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[C@@H](C)[C@H](n3ccnc3)C2)C1 ZINC000152259067 1418187058 /nfs/dbraw/zinc/18/70/58/1418187058.db2.gz SHGVDXDMOGKRNI-IYWMVGAKSA-N 2 1 375.561 3.234 20 0 GGADMP O=C1C[C@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000179061979 1429252341 /nfs/dbraw/zinc/25/23/41/1429252341.db2.gz RQRKURDFGLNUDQ-JOCHJYFZSA-N 2 1 377.532 3.289 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)NCc1ccc(F)cc1 ZINC000179389242 1429354683 /nfs/dbraw/zinc/35/46/83/1429354683.db2.gz WQUCRIAJOTVJJT-UHFFFAOYSA-N 2 1 384.499 3.075 20 0 GGADMP COc1ccc(NC(=O)C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000179390395 1429355365 /nfs/dbraw/zinc/35/53/65/1429355365.db2.gz LPURJACAXLYTFD-UHFFFAOYSA-N 2 1 382.508 3.267 20 0 GGADMP Cc1ccccc1CCNC(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179391035 1429356366 /nfs/dbraw/zinc/35/63/66/1429356366.db2.gz LOQRPOPQIDKLBL-UHFFFAOYSA-N 2 1 394.563 3.287 20 0 GGADMP Cc1ccsc1CNC(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179396228 1429358093 /nfs/dbraw/zinc/35/80/93/1429358093.db2.gz GQSHPBPOBCTKFP-UHFFFAOYSA-N 2 1 386.565 3.306 20 0 GGADMP Cc1cc2ncc([C@H](C)[NH2+]C3CCN(c4cc(C)[nH+]c(C)n4)CC3)c(C)n2n1 ZINC000179443673 1429378554 /nfs/dbraw/zinc/37/85/54/1429378554.db2.gz STRHPFKGXXUPIN-HNNXBMFYSA-N 2 1 379.512 3.073 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H](O)CN2Cc2ccccc2)cc1 ZINC000179485460 1429390422 /nfs/dbraw/zinc/39/04/22/1429390422.db2.gz KMNJXZCSPPVDQP-NWVWQQAFSA-N 2 1 390.531 3.467 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000152305255 1422067987 /nfs/dbraw/zinc/06/79/87/1422067987.db2.gz CWZZLDXOIOPKDV-RTWAWAEBSA-N 2 1 395.551 3.457 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000152305255 1422067995 /nfs/dbraw/zinc/06/79/95/1422067995.db2.gz CWZZLDXOIOPKDV-RTWAWAEBSA-N 2 1 395.551 3.457 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000152305406 1422068172 /nfs/dbraw/zinc/06/81/72/1422068172.db2.gz CWZZLDXOIOPKDV-SFTDATJTSA-N 2 1 395.551 3.457 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000152305406 1422068178 /nfs/dbraw/zinc/06/81/78/1422068178.db2.gz CWZZLDXOIOPKDV-SFTDATJTSA-N 2 1 395.551 3.457 20 0 GGADMP C[C@H]([NH2+]C1(CNCc2ccc(-n3cncn3)cc2)CCOCC1)c1ccccc1 ZINC000152365127 1422084313 /nfs/dbraw/zinc/08/43/13/1422084313.db2.gz JLJVRRIBVHBOMW-IBGZPJMESA-N 2 1 391.519 3.257 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NCC(C)(C)[N@@H+]2CCC[C@H](C)C2)C1 ZINC000152455370 1422108390 /nfs/dbraw/zinc/10/83/90/1422108390.db2.gz CPSGPRWWDOHIQM-ZWKOTPCHSA-N 2 1 375.561 3.303 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)C1 ZINC000152455370 1422108403 /nfs/dbraw/zinc/10/84/03/1422108403.db2.gz CPSGPRWWDOHIQM-ZWKOTPCHSA-N 2 1 375.561 3.303 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NCC(C)(C)[N@@H+]2CCC[C@H](C)C2)C1 ZINC000152455463 1422108607 /nfs/dbraw/zinc/10/86/07/1422108607.db2.gz CPSGPRWWDOHIQM-ROUUACIJSA-N 2 1 375.561 3.303 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)C1 ZINC000152455463 1422108617 /nfs/dbraw/zinc/10/86/17/1422108617.db2.gz CPSGPRWWDOHIQM-ROUUACIJSA-N 2 1 375.561 3.303 20 0 GGADMP Cc1cc(N2CCC([NH2+]C3CCN(C(=O)CC(C)(C)C)CC3)CC2)nc(C)[nH+]1 ZINC000152497947 1422121186 /nfs/dbraw/zinc/12/11/86/1422121186.db2.gz WEDGECHUEWHGCO-UHFFFAOYSA-N 2 1 387.572 3.079 20 0 GGADMP C[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C[C@H]1n1ccnc1 ZINC000152552645 1422140700 /nfs/dbraw/zinc/14/07/00/1422140700.db2.gz RUNHMXXMPZFJTO-LAUBAEHRSA-N 2 1 399.514 3.279 20 0 GGADMP O[C@@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)COc1ccc(F)cc1 ZINC000152555021 1422142803 /nfs/dbraw/zinc/14/28/03/1422142803.db2.gz QPRHDZPAQIJQLQ-NRFANRHFSA-N 2 1 390.474 3.001 20 0 GGADMP CCc1nc2c(s1)[C@H]([N@H+](C)CC(=O)NC1CC[NH+](C(C)C)CC1)CCC2 ZINC000152604406 1422161010 /nfs/dbraw/zinc/16/10/10/1422161010.db2.gz BCXBNTSFMWUINC-QGZVFWFLSA-N 2 1 378.586 3.004 20 0 GGADMP CCc1nc2c(s1)[C@H]([N@@H+](C)CC(=O)NC1CC[NH+](C(C)C)CC1)CCC2 ZINC000152604406 1422161015 /nfs/dbraw/zinc/16/10/15/1422161015.db2.gz BCXBNTSFMWUINC-QGZVFWFLSA-N 2 1 378.586 3.004 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)N3CC[C@H]4[C@@H](CCC[N@H+]4C)C3)CC2)CC1 ZINC000152746105 1422234159 /nfs/dbraw/zinc/23/41/59/1422234159.db2.gz OJQLLWVABAYIHE-HAMDTZRPSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000152865682 1422276413 /nfs/dbraw/zinc/27/64/13/1422276413.db2.gz CJKMGIZVIYLABE-ICSRJNTNSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000152865682 1422276427 /nfs/dbraw/zinc/27/64/27/1422276427.db2.gz CJKMGIZVIYLABE-ICSRJNTNSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC2CC[NH+](C3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000153094293 1422354588 /nfs/dbraw/zinc/35/45/88/1422354588.db2.gz ZWJXNHBDEYVJOF-WIYYLYMNSA-N 2 1 384.568 3.356 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCOc2ccc(S(C)(=O)=O)cc2)cc1 ZINC000153111051 1422360568 /nfs/dbraw/zinc/36/05/68/1422360568.db2.gz RYKDHHPLLDXCDA-INIZCTEOSA-N 2 1 399.516 3.314 20 0 GGADMP Cc1cc(-c2nnc(C[NH+]3CCC(C[N@@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)o2)c(C)o1 ZINC000153461287 1422549877 /nfs/dbraw/zinc/54/98/77/1422549877.db2.gz ULIKHPLKLUDNAN-IYBDPMFKSA-N 2 1 388.512 3.268 20 0 GGADMP Cc1cc(-c2nnc(C[NH+]3CCC(C[N@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)o2)c(C)o1 ZINC000153461287 1422549887 /nfs/dbraw/zinc/54/98/87/1422549887.db2.gz ULIKHPLKLUDNAN-IYBDPMFKSA-N 2 1 388.512 3.268 20 0 GGADMP Cc1c(C(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cnn1-c1cc[nH+]cc1 ZINC000153527111 1422586520 /nfs/dbraw/zinc/58/65/20/1422586520.db2.gz DMYBCGZNZCIWRT-OAQYLSRUSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1c(C(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cnn1-c1cc[nH+]cc1 ZINC000153527111 1422586527 /nfs/dbraw/zinc/58/65/27/1422586527.db2.gz DMYBCGZNZCIWRT-OAQYLSRUSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1c(C(=O)NCC[C@H](C)[N@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000153537082 1422592839 /nfs/dbraw/zinc/59/28/39/1422592839.db2.gz DOHKELJFHIJYRU-KRWDZBQOSA-N 2 1 377.492 3.216 20 0 GGADMP Cc1c(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)cnn1-c1cc[nH+]cc1 ZINC000153537082 1422592864 /nfs/dbraw/zinc/59/28/64/1422592864.db2.gz DOHKELJFHIJYRU-KRWDZBQOSA-N 2 1 377.492 3.216 20 0 GGADMP O=C(c1ccc(C[NH+]2CCSCC2)cc1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000153653048 1422680337 /nfs/dbraw/zinc/68/03/37/1422680337.db2.gz BIBZJXKEEMLWCL-UNMCSNQZSA-N 2 1 399.604 3.324 20 0 GGADMP COc1cc(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c(SC)cc1OC ZINC000153790789 1422760080 /nfs/dbraw/zinc/76/00/80/1422760080.db2.gz OVCGKSZGXNJJDU-OAHLLOKOSA-N 2 1 380.554 3.016 20 0 GGADMP OC[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000154065904 1422834638 /nfs/dbraw/zinc/83/46/38/1422834638.db2.gz WMVWPBFRPKLSOW-NOZRDPDXSA-N 2 1 393.575 3.124 20 0 GGADMP OC[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000154065904 1422834639 /nfs/dbraw/zinc/83/46/39/1422834639.db2.gz WMVWPBFRPKLSOW-NOZRDPDXSA-N 2 1 393.575 3.124 20 0 GGADMP OC[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000154065835 1422834673 /nfs/dbraw/zinc/83/46/73/1422834673.db2.gz WMVWPBFRPKLSOW-ILBGXUMGSA-N 2 1 393.575 3.124 20 0 GGADMP OC[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000154065835 1422834677 /nfs/dbraw/zinc/83/46/77/1422834677.db2.gz WMVWPBFRPKLSOW-ILBGXUMGSA-N 2 1 393.575 3.124 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)[C@H]3CCC[N@H+]3C3CCOCC3)cc2)CC1 ZINC000154302887 1422869565 /nfs/dbraw/zinc/86/95/65/1422869565.db2.gz CIBSQEKDPITRIN-HSZRJFAPSA-N 2 1 399.579 3.178 20 0 GGADMP Cc1nccn1C[C@H](C)CNC(=O)N1CCC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000154370487 1422879681 /nfs/dbraw/zinc/87/96/81/1422879681.db2.gz RJVWKOJGPVAXST-MOPGFXCFSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000154370487 1422879683 /nfs/dbraw/zinc/87/96/83/1422879683.db2.gz RJVWKOJGPVAXST-MOPGFXCFSA-N 2 1 383.540 3.134 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000154395890 1422883532 /nfs/dbraw/zinc/88/35/32/1422883532.db2.gz IOCSBEJUKHSHBI-FQEVSTJZSA-N 2 1 384.524 3.017 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000154503388 1422897788 /nfs/dbraw/zinc/89/77/88/1422897788.db2.gz OYEQRKJHMFIWAH-UHFFFAOYSA-N 2 1 393.019 3.312 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2cnn(-c3ccc(F)cc3)c2C)CC1 ZINC000154545976 1422918847 /nfs/dbraw/zinc/91/88/47/1422918847.db2.gz IVLXGCXGEACFLX-GOSISDBHSA-N 2 1 387.547 3.388 20 0 GGADMP CN(C)Cc1ccc(CNC(=O)[C@@H]2CCCN2Cc2ccc(F)cc2)cc1F ZINC000154640683 1422977984 /nfs/dbraw/zinc/97/79/84/1422977984.db2.gz IMUIHPRZMIYTNB-NRFANRHFSA-N 2 1 387.474 3.307 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCCN1CCN(c2ccccc2Cl)CC1 ZINC000154660813 1422988944 /nfs/dbraw/zinc/98/89/44/1422988944.db2.gz XXMPOCQDWVNRLT-QWFCFKBJSA-N 2 1 378.992 3.170 20 0 GGADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCC(=O)N3CCc4sccc4C3)C2)CC1 ZINC000154709055 1423008233 /nfs/dbraw/zinc/00/82/33/1423008233.db2.gz XOMUNUJBVIKDCD-LJQANCHMSA-N 2 1 389.609 3.467 20 0 GGADMP COc1ccc(COC[C@@H](O)C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000154736224 1423016186 /nfs/dbraw/zinc/01/61/86/1423016186.db2.gz SWFRHLMXGGLLJG-VXKWHMMOSA-N 2 1 390.568 3.017 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)[C@H]1C[NH+](C)CCO1 ZINC000155013619 1423115704 /nfs/dbraw/zinc/11/57/04/1423115704.db2.gz UBLFWBYXCUYAID-DYESRHJHSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[N@@H+](C)C1CCCCC1)[C@H]1C[NH+](C)CCO1 ZINC000155013619 1423115710 /nfs/dbraw/zinc/11/57/10/1423115710.db2.gz UBLFWBYXCUYAID-DYESRHJHSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@H]1C[N@H+](C)CCO1 ZINC000155013619 1423115716 /nfs/dbraw/zinc/11/57/16/1423115716.db2.gz UBLFWBYXCUYAID-DYESRHJHSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@H]1C[N@@H+](C)CCO1 ZINC000155013619 1423115723 /nfs/dbraw/zinc/11/57/23/1423115723.db2.gz UBLFWBYXCUYAID-DYESRHJHSA-N 2 1 388.556 3.292 20 0 GGADMP CCN(CC)[C@H](CNC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1)c1ccco1 ZINC000155411465 1423352565 /nfs/dbraw/zinc/35/25/65/1423352565.db2.gz RHDWLSVVHNWJPP-NHCUHLMSSA-N 2 1 399.535 3.070 20 0 GGADMP CCN(CC)[C@@H](CNC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1)c1ccco1 ZINC000155411354 1423353257 /nfs/dbraw/zinc/35/32/57/1423353257.db2.gz RHDWLSVVHNWJPP-RTWAWAEBSA-N 2 1 399.535 3.070 20 0 GGADMP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](Cc2cn(C)nc2-c2ccccc2)CC1 ZINC000179910722 1429636169 /nfs/dbraw/zinc/63/61/69/1429636169.db2.gz DPBZSQVINHFOTP-PMACEKPBSA-N 2 1 381.568 3.078 20 0 GGADMP C[C@@H]1CC[C@@H](C)[NH+]1CCN1CC[NH+](Cc2cn(C)nc2-c2ccccc2)CC1 ZINC000179910739 1429636178 /nfs/dbraw/zinc/63/61/78/1429636178.db2.gz DPBZSQVINHFOTP-WOJBJXKFSA-N 2 1 381.568 3.078 20 0 GGADMP O=C1CCCCCN1CCC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000155511592 1423393909 /nfs/dbraw/zinc/39/39/09/1423393909.db2.gz ZCEJPZQWMMZEEL-UHFFFAOYSA-N 2 1 375.532 3.215 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cn1cc(Br)cn1 ZINC000179916199 1429639293 /nfs/dbraw/zinc/63/92/93/1429639293.db2.gz QPDUVHBMVLSSRC-UHFFFAOYSA-N 2 1 378.318 3.237 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCNC3CC[NH+](CC4CC4)CC3)CC2)c1 ZINC000155694774 1423490675 /nfs/dbraw/zinc/49/06/75/1423490675.db2.gz VBKSFXNQKFERHO-UHFFFAOYSA-N 2 1 391.003 3.316 20 0 GGADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1cccc(N2CCCS2(=O)=O)c1)C(C)C ZINC000155822560 1423548326 /nfs/dbraw/zinc/54/83/26/1423548326.db2.gz GKJVMEQUHSKMDM-GOSISDBHSA-N 2 1 381.586 3.386 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc([S@](C)=O)cc3)CC2)cs1 ZINC000156055852 1423654259 /nfs/dbraw/zinc/65/42/59/1423654259.db2.gz XYJBJIQHALVEME-AREMUKBSSA-N 2 1 391.606 3.445 20 0 GGADMP O=C1[C@@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000179972354 1429669791 /nfs/dbraw/zinc/66/97/91/1429669791.db2.gz LFGKBIILQBEWHD-QRVBRYPASA-N 2 1 395.469 3.413 20 0 GGADMP O=C1[C@@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000179972354 1429669794 /nfs/dbraw/zinc/66/97/94/1429669794.db2.gz LFGKBIILQBEWHD-QRVBRYPASA-N 2 1 395.469 3.413 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000156311736 1423771850 /nfs/dbraw/zinc/77/18/50/1423771850.db2.gz NZJIEYDJJOQPFB-XZOQPEGZSA-N 2 1 398.595 3.483 20 0 GGADMP CC[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000156311603 1423771916 /nfs/dbraw/zinc/77/19/16/1423771916.db2.gz NZJIEYDJJOQPFB-PKTZIBPZSA-N 2 1 398.595 3.483 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000156680398 1423847009 /nfs/dbraw/zinc/84/70/09/1423847009.db2.gz UPQVACTVCLWYEX-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000156680398 1423847011 /nfs/dbraw/zinc/84/70/11/1423847011.db2.gz UPQVACTVCLWYEX-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000156680398 1423847017 /nfs/dbraw/zinc/84/70/17/1423847017.db2.gz UPQVACTVCLWYEX-KAGYGMCKSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000156785533 1423864551 /nfs/dbraw/zinc/86/45/51/1423864551.db2.gz BQBDMDYMMWDMGG-SIKLNZKXSA-N 2 1 384.568 3.093 20 0 GGADMP Cc1cccc2c1CC[C@H]2[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156895194 1423882173 /nfs/dbraw/zinc/88/21/73/1423882173.db2.gz YVSLQGFYNXWOKC-NZQKXSOJSA-N 2 1 377.532 3.469 20 0 GGADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156926526 1423887085 /nfs/dbraw/zinc/88/70/85/1423887085.db2.gz LJCTWZRFVRGIRX-UWJYYQICSA-N 2 1 383.511 3.244 20 0 GGADMP C[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C[NH+]1CCCC1 ZINC000157046332 1423910289 /nfs/dbraw/zinc/91/02/89/1423910289.db2.gz CNTAKIWSMLLNGS-KCZVDYSFSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H](CNC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C[NH+]1CCCC1 ZINC000157046614 1423910420 /nfs/dbraw/zinc/91/04/20/1423910420.db2.gz CNTAKIWSMLLNGS-SJBKTWHCSA-N 2 1 386.584 3.413 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cnn(-c2ccccc2)c1C ZINC000157157152 1423940470 /nfs/dbraw/zinc/94/04/70/1423940470.db2.gz IOXGOEZBWULHQI-HXUWFJFHSA-N 2 1 398.555 3.061 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000157289735 1423975964 /nfs/dbraw/zinc/97/59/64/1423975964.db2.gz WWJQGJREBASSKJ-IFMALSPDSA-N 2 1 387.568 3.048 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000157289735 1423975974 /nfs/dbraw/zinc/97/59/74/1423975974.db2.gz WWJQGJREBASSKJ-IFMALSPDSA-N 2 1 387.568 3.048 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000157289735 1423975980 /nfs/dbraw/zinc/97/59/80/1423975980.db2.gz WWJQGJREBASSKJ-IFMALSPDSA-N 2 1 387.568 3.048 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000157289735 1423975988 /nfs/dbraw/zinc/97/59/88/1423975988.db2.gz WWJQGJREBASSKJ-IFMALSPDSA-N 2 1 387.568 3.048 20 0 GGADMP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000157289888 1423976020 /nfs/dbraw/zinc/97/60/20/1423976020.db2.gz WWJQGJREBASSKJ-RBBKRZOGSA-N 2 1 387.568 3.048 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCCNC(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000157289888 1423976024 /nfs/dbraw/zinc/97/60/24/1423976024.db2.gz WWJQGJREBASSKJ-RBBKRZOGSA-N 2 1 387.568 3.048 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCCNC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000157289888 1423976034 /nfs/dbraw/zinc/97/60/34/1423976034.db2.gz WWJQGJREBASSKJ-RBBKRZOGSA-N 2 1 387.568 3.048 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCCNC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000157289888 1423976039 /nfs/dbraw/zinc/97/60/39/1423976039.db2.gz WWJQGJREBASSKJ-RBBKRZOGSA-N 2 1 387.568 3.048 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H]1CC[N@@H+](CC(C)C)C1)c1ccsc1 ZINC000157322395 1423984630 /nfs/dbraw/zinc/98/46/30/1423984630.db2.gz FDRDUTBQHKWVCS-HKUYNNGSSA-N 2 1 380.602 3.408 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[NH+]2CCC(Oc3ccccc3Cl)CC2)CC1 ZINC000157394405 1424001610 /nfs/dbraw/zinc/00/16/10/1424001610.db2.gz KQLYGVZSQJTFGU-UHFFFAOYSA-N 2 1 393.959 3.172 20 0 GGADMP O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000157413730 1424006316 /nfs/dbraw/zinc/00/63/16/1424006316.db2.gz CJKDQYUHNURSAS-HXUWFJFHSA-N 2 1 376.589 3.301 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)C1 ZINC000157475728 1424019138 /nfs/dbraw/zinc/01/91/38/1424019138.db2.gz QPVQXNOVHORVMJ-ZCNNSNEGSA-N 2 1 378.605 3.403 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000157706355 1424069786 /nfs/dbraw/zinc/06/97/86/1424069786.db2.gz HTQVOWVWYPXBRJ-INIZCTEOSA-N 2 1 382.936 3.228 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)ccc1S(C)(=O)=O ZINC000157871439 1424109124 /nfs/dbraw/zinc/10/91/24/1424109124.db2.gz LAKLXYOGQUKMBT-SJORKVTESA-N 2 1 382.570 3.404 20 0 GGADMP CCOc1cc(F)ccc1NC(=O)N(CC[NH+](C)C)C[C@H]1CCC[N@H+]1CC ZINC000157969833 1424131703 /nfs/dbraw/zinc/13/17/03/1424131703.db2.gz OCKOFNMLGBVYMP-QGZVFWFLSA-N 2 1 380.508 3.104 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C[NH+]1CCC(OC2CCCCC2)CC1)c1ccccc1 ZINC000158066942 1424155686 /nfs/dbraw/zinc/15/56/86/1424155686.db2.gz BOWDMVZCWOKBGL-JOCHJYFZSA-N 2 1 387.568 3.219 20 0 GGADMP Cc1[nH+]c(N2CCOCC2)ccc1N[C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000180047362 1429712023 /nfs/dbraw/zinc/71/20/23/1429712023.db2.gz ZXMCVMOZJUSYCH-KRWDZBQOSA-N 2 1 384.524 3.340 20 0 GGADMP C[C@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158877617 1424362361 /nfs/dbraw/zinc/36/23/61/1424362361.db2.gz CDPRXTYEYURSSO-CKEIUWERSA-N 2 1 385.430 3.328 20 0 GGADMP CCN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000159046312 1424404421 /nfs/dbraw/zinc/40/44/21/1424404421.db2.gz CMUZPXRCUGJVDN-UXHICEINSA-N 2 1 384.524 3.188 20 0 GGADMP CCN(C(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159046312 1424404430 /nfs/dbraw/zinc/40/44/30/1424404430.db2.gz CMUZPXRCUGJVDN-UXHICEINSA-N 2 1 384.524 3.188 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000159210158 1424444227 /nfs/dbraw/zinc/44/42/27/1424444227.db2.gz RWXFDHNMZRASFQ-ZDUSSCGKSA-N 2 1 384.402 3.439 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000159210158 1424444237 /nfs/dbraw/zinc/44/42/37/1424444237.db2.gz RWXFDHNMZRASFQ-ZDUSSCGKSA-N 2 1 384.402 3.439 20 0 GGADMP CN(C(=O)NCCSC(C)(C)C)[C@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000160609486 1424618977 /nfs/dbraw/zinc/61/89/77/1424618977.db2.gz ZZNGRJBUCASNLX-OALUTQOASA-N 2 1 398.661 3.497 20 0 GGADMP Cc1ccc(NC(=O)COc2ccc(CC[NH2+][C@@H]3CC[N@H+](C)C[C@@H]3C)cc2)cc1 ZINC000161733080 1424754007 /nfs/dbraw/zinc/75/40/07/1424754007.db2.gz YEOQYEKYOCEASD-WMZHIEFXSA-N 2 1 395.547 3.485 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]C3CCN(CC(F)F)CC3)CC2)cs1 ZINC000161782609 1424763224 /nfs/dbraw/zinc/76/32/24/1424763224.db2.gz FANJDWKNMKOYOX-UHFFFAOYSA-N 2 1 386.556 3.237 20 0 GGADMP CCN(Cc1ccccc1)C(=O)C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000161925973 1424798576 /nfs/dbraw/zinc/79/85/76/1424798576.db2.gz SSWPLPUNWSUMPJ-UHFFFAOYSA-N 2 1 379.548 3.332 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cnn(CCC(C)C)c1C ZINC000162030092 1424810551 /nfs/dbraw/zinc/81/05/51/1424810551.db2.gz UYGUCCWLZZRMPO-LJQANCHMSA-N 2 1 392.592 3.117 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)CC2)nc(C)[nH+]1 ZINC000162225156 1424828077 /nfs/dbraw/zinc/82/80/77/1424828077.db2.gz UQHNOVXTBUIRAF-GOSISDBHSA-N 3 1 397.567 3.353 20 0 GGADMP COCCOc1ccc([C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)cc1 ZINC000162252849 1424831489 /nfs/dbraw/zinc/83/14/89/1424831489.db2.gz BTQRNYUWCUHTMN-KRWDZBQOSA-N 2 1 384.524 3.438 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H](C)c3cccc(N4CCOC4=O)c3)CC2)nc(C)[nH+]1 ZINC000162266773 1424832580 /nfs/dbraw/zinc/83/25/80/1424832580.db2.gz PFJZKNDYOXHTGH-MRXNPFEDSA-N 2 1 395.507 3.370 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000162512643 1424860564 /nfs/dbraw/zinc/86/05/64/1424860564.db2.gz DRRFJKRMGYTROF-ROUUACIJSA-N 2 1 378.586 3.162 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000162745482 1424886921 /nfs/dbraw/zinc/88/69/21/1424886921.db2.gz ARBMFENRHAFLAL-KRWDZBQOSA-N 2 1 375.538 3.231 20 0 GGADMP COc1cc([C@@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)ccc1S(C)(=O)=O ZINC000162745846 1424887130 /nfs/dbraw/zinc/88/71/30/1424887130.db2.gz WRHAMNGCHJABAW-QGZVFWFLSA-N 2 1 390.549 3.271 20 0 GGADMP COc1cc([C@@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)ccc1S(C)(=O)=O ZINC000162745846 1424887131 /nfs/dbraw/zinc/88/71/31/1424887131.db2.gz WRHAMNGCHJABAW-QGZVFWFLSA-N 2 1 390.549 3.271 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(-n4cncn4)cc3)CC2)oc1C ZINC000162788026 1424890405 /nfs/dbraw/zinc/89/04/05/1424890405.db2.gz ZXTJISDRVYTXPC-KRWDZBQOSA-N 2 1 394.523 3.435 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCc2ccc(-n3nc(C)cc3C)nc2)[C@H](C)C1 ZINC000162786755 1424890559 /nfs/dbraw/zinc/89/05/59/1424890559.db2.gz RNKFLUJMNCQWTP-UTKZUKDTSA-N 2 1 385.556 3.111 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-n3nc(C)cc3C)nc2)[C@H](C)C1 ZINC000162786755 1424890560 /nfs/dbraw/zinc/89/05/60/1424890560.db2.gz RNKFLUJMNCQWTP-UTKZUKDTSA-N 2 1 385.556 3.111 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC[N@@H+]1C ZINC000163038655 1424928571 /nfs/dbraw/zinc/92/85/71/1424928571.db2.gz PFEGTEZZRZOAJY-WIYYLYMNSA-N 2 1 397.542 3.120 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC[N@H+]1C ZINC000163038655 1424928574 /nfs/dbraw/zinc/92/85/74/1424928574.db2.gz PFEGTEZZRZOAJY-WIYYLYMNSA-N 2 1 397.542 3.120 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccc(-n2cnnn2)c1 ZINC000163219404 1424961181 /nfs/dbraw/zinc/96/11/81/1424961181.db2.gz WZAZGMSGCCAKAI-LVCYWYKZSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccc(-n2cnnn2)c1 ZINC000163219404 1424961185 /nfs/dbraw/zinc/96/11/85/1424961185.db2.gz WZAZGMSGCCAKAI-LVCYWYKZSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(-n2cnnn2)cc1 ZINC000163264212 1424969714 /nfs/dbraw/zinc/96/97/14/1424969714.db2.gz AELSFCJTZZADHU-BBTUJRGHSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(-n2cnnn2)cc1 ZINC000163264212 1424969727 /nfs/dbraw/zinc/96/97/27/1424969727.db2.gz AELSFCJTZZADHU-BBTUJRGHSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc(C[NH+](C)C)cc1 ZINC000163789152 1425044398 /nfs/dbraw/zinc/04/43/98/1425044398.db2.gz KDZMWTWSEMNGMQ-GCJKJVERSA-N 2 1 380.536 3.068 20 0 GGADMP Cc1ncc([C@H](C)[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)c(C)n1 ZINC000163954841 1425061817 /nfs/dbraw/zinc/06/18/17/1425061817.db2.gz HWCPRFYQFXOQCF-KRWDZBQOSA-N 2 1 398.551 3.434 20 0 GGADMP C[C@@H](CC1CCOCC1)[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000163975551 1425064844 /nfs/dbraw/zinc/06/48/44/1425064844.db2.gz UIDQUXFAUZVISL-IBGZPJMESA-N 2 1 390.568 3.471 20 0 GGADMP [NH3+]C1(C(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CCCCC1 ZINC000163995012 1425066932 /nfs/dbraw/zinc/06/69/32/1425066932.db2.gz BPMQPGUEOIGVOH-UHFFFAOYSA-N 2 1 383.458 3.401 20 0 GGADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)CC1 ZINC000164025447 1425069690 /nfs/dbraw/zinc/06/96/90/1425069690.db2.gz NVZYTYAPXOCPBN-GOSISDBHSA-N 2 1 393.597 3.070 20 0 GGADMP CCOc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000164258388 1425093082 /nfs/dbraw/zinc/09/30/82/1425093082.db2.gz AHXOVWLFGNDWDL-KSZLIROESA-N 2 1 388.556 3.037 20 0 GGADMP C[N@@H+]1CCC[C@@H]2C[NH+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@@H]21 ZINC000164607496 1425128167 /nfs/dbraw/zinc/12/81/67/1425128167.db2.gz GAEXGASHAYNGFB-PBHICJAKSA-N 2 1 390.325 3.138 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@@H]21 ZINC000164607496 1425128172 /nfs/dbraw/zinc/12/81/72/1425128172.db2.gz GAEXGASHAYNGFB-PBHICJAKSA-N 2 1 390.325 3.138 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@@H]21 ZINC000164607496 1425128179 /nfs/dbraw/zinc/12/81/79/1425128179.db2.gz GAEXGASHAYNGFB-PBHICJAKSA-N 2 1 390.325 3.138 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cn3ccc(=O)c4cccc(Br)c43)CC[C@@H]21 ZINC000164607496 1425128183 /nfs/dbraw/zinc/12/81/83/1425128183.db2.gz GAEXGASHAYNGFB-PBHICJAKSA-N 2 1 390.325 3.138 20 0 GGADMP C[C@@H]1CC[N@H+]([C@@H]2CC(=O)N(c3ccc4ccccc4c3)C2=O)C[C@@H]1n1ccnc1 ZINC000164754698 1425139704 /nfs/dbraw/zinc/13/97/04/1425139704.db2.gz ZUFPQWDEKXSCKK-HBGVWJBISA-N 2 1 388.471 3.251 20 0 GGADMP C[C@@H]1CCN([C@@H]2CC(=O)N(c3ccc4ccccc4c3)C2=O)C[C@@H]1n1ccnc1 ZINC000164754698 1425139719 /nfs/dbraw/zinc/13/97/19/1425139719.db2.gz ZUFPQWDEKXSCKK-HBGVWJBISA-N 2 1 388.471 3.251 20 0 GGADMP CN(C)C(=O)c1cccc(CC[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)c1 ZINC000165120339 1425164650 /nfs/dbraw/zinc/16/46/50/1425164650.db2.gz DQCJAMPEYMMPKV-UHFFFAOYSA-N 2 1 397.538 3.367 20 0 GGADMP O=C(CC1CC[NH2+]CC1)NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000165147665 1425166667 /nfs/dbraw/zinc/16/66/67/1425166667.db2.gz ODSLJTFOJJFRKH-HXUWFJFHSA-N 2 1 383.561 3.353 20 0 GGADMP O=C(CC1CC[NH2+]CC1)NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000165147665 1425166691 /nfs/dbraw/zinc/16/66/91/1425166691.db2.gz ODSLJTFOJJFRKH-HXUWFJFHSA-N 2 1 383.561 3.353 20 0 GGADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(-n2cncn2)cc1 ZINC000165343590 1425176441 /nfs/dbraw/zinc/17/64/41/1425176441.db2.gz KBTAAFFWYYVVDF-CTNGQTDRSA-N 2 1 375.520 3.483 20 0 GGADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+]C3CCN(Cc4cccnc4)CC3)C2)cc1 ZINC000165345966 1425176704 /nfs/dbraw/zinc/17/67/04/1425176704.db2.gz VAFLBNPSYZAJIF-QHCPKHFHSA-N 2 1 378.564 3.200 20 0 GGADMP O=C(NCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1Cl ZINC000165504358 1425182442 /nfs/dbraw/zinc/18/24/42/1425182442.db2.gz ZCRSJRBQKCXFAP-UHFFFAOYSA-N 2 1 385.939 3.367 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](C)c1cccc(F)c1F ZINC000165762986 1425195285 /nfs/dbraw/zinc/19/52/85/1425195285.db2.gz XXEKAJWRRZKGKP-JKSUJKDBSA-N 2 1 382.499 3.083 20 0 GGADMP Clc1cccc(N2CCN(CCC[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)c1 ZINC000166536004 1425213865 /nfs/dbraw/zinc/21/38/65/1425213865.db2.gz FUHUPEWWFPNSMZ-PZJWPPBQSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCN[C@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)c1 ZINC000166536004 1425213874 /nfs/dbraw/zinc/21/38/74/1425213874.db2.gz FUHUPEWWFPNSMZ-PZJWPPBQSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCN[C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)c1 ZINC000166536004 1425213883 /nfs/dbraw/zinc/21/38/83/1425213883.db2.gz FUHUPEWWFPNSMZ-PZJWPPBQSA-N 2 1 376.976 3.069 20 0 GGADMP COc1ccccc1[C@H]([NH3+])C(=O)Nc1cccc(C[NH+]2CCSCC2)c1C ZINC000166724385 1425216698 /nfs/dbraw/zinc/21/66/98/1425216698.db2.gz NNXOZOATEZDSLM-FQEVSTJZSA-N 2 1 385.533 3.191 20 0 GGADMP O=C(NCc1ccncc1)Nc1cccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000167321445 1425224880 /nfs/dbraw/zinc/22/48/80/1425224880.db2.gz RXPUAGGCYFADQW-UHFFFAOYSA-N 2 1 393.535 3.367 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000167361310 1425224906 /nfs/dbraw/zinc/22/49/06/1425224906.db2.gz SOULHRBMGXRUBT-LZJOCLMNSA-N 2 1 381.524 3.222 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000167361310 1425224915 /nfs/dbraw/zinc/22/49/15/1425224915.db2.gz SOULHRBMGXRUBT-LZJOCLMNSA-N 2 1 381.524 3.222 20 0 GGADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(NC(=O)NCc3ccncc3)c2)[C@H](C)C1 ZINC000167341390 1425225328 /nfs/dbraw/zinc/22/53/28/1425225328.db2.gz GHGWYXOJGHEKEY-DYESRHJHSA-N 2 1 381.524 3.223 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2cccc(NC(=O)NCc3ccncc3)c2)[C@H](C)C1 ZINC000167341390 1425225333 /nfs/dbraw/zinc/22/53/33/1425225333.db2.gz GHGWYXOJGHEKEY-DYESRHJHSA-N 2 1 381.524 3.223 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)C2(c3ccccc3)CC[NH2+]CC2)CC[N@H+]1Cc1ccccc1 ZINC000167544613 1425227304 /nfs/dbraw/zinc/22/73/04/1425227304.db2.gz BYJBROYEWCWUPE-REWPJTCUSA-N 2 1 391.559 3.477 20 0 GGADMP COc1ccccc1[C@H]([NH3+])C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000168784195 1425239669 /nfs/dbraw/zinc/23/96/69/1425239669.db2.gz FXAQVTTYTPBXGC-MFXLTOHQSA-N 2 1 379.504 3.007 20 0 GGADMP COc1ccccc1[C@H]([NH3+])C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000168784195 1425239676 /nfs/dbraw/zinc/23/96/76/1425239676.db2.gz FXAQVTTYTPBXGC-MFXLTOHQSA-N 2 1 379.504 3.007 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000169001481 1425241247 /nfs/dbraw/zinc/24/12/47/1425241247.db2.gz XGLOPOLHNYNNIL-JOCHJYFZSA-N 2 1 377.532 3.089 20 0 GGADMP C[N@@H+]1CCC[C@H]2CN(C(=O)Nc3ccccc3C[NH+]3CCSCC3)CC[C@@H]21 ZINC000169122917 1425243638 /nfs/dbraw/zinc/24/36/38/1425243638.db2.gz VLDPWHJQLWIKEY-ICSRJNTNSA-N 2 1 388.581 3.183 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(C(=O)Nc3ccccc3C[NH+]3CCSCC3)CC[C@@H]21 ZINC000169122917 1425243650 /nfs/dbraw/zinc/24/36/50/1425243650.db2.gz VLDPWHJQLWIKEY-ICSRJNTNSA-N 2 1 388.581 3.183 20 0 GGADMP Cn1cccc1[C@@H]1CCCN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000170643117 1425272157 /nfs/dbraw/zinc/27/21/57/1425272157.db2.gz ROEVREWTEIBBCR-NRFANRHFSA-N 2 1 398.576 3.350 20 0 GGADMP O=C(c1ccc(F)cc1)N1CCC[N@@H+](Cc2ccc(-n3ccnc3)cc2)CC1 ZINC000170643245 1425272260 /nfs/dbraw/zinc/27/22/60/1425272260.db2.gz FBCKMPLAYXDWAI-UHFFFAOYSA-N 2 1 378.451 3.360 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)CCCC[NH+]2CCOCC2)c2cccs2)CC1 ZINC000170693220 1425302828 /nfs/dbraw/zinc/30/28/28/1425302828.db2.gz COAXAQKYHVPQFH-LJQANCHMSA-N 2 1 393.597 3.140 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@H](c3ccccc3)[NH+](C)C)CC2)cs1 ZINC000170693153 1425302972 /nfs/dbraw/zinc/30/29/72/1425302972.db2.gz CJSPDZABAIYBFJ-HXUWFJFHSA-N 2 1 386.565 3.083 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCc3ccccc3C[NH+](C)C)CC2)cs1 ZINC000170693434 1425303211 /nfs/dbraw/zinc/30/32/11/1425303211.db2.gz TVYOKXVIHITFFF-UHFFFAOYSA-N 2 1 386.565 3.042 20 0 GGADMP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)CCCC[NH+]1CCOCC1 ZINC000170694409 1425303902 /nfs/dbraw/zinc/30/39/02/1425303902.db2.gz ARSFCCSNIIEYQI-FQEVSTJZSA-N 2 1 387.568 3.180 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)CCCC[NH+]1CCOCC1 ZINC000170694409 1425303912 /nfs/dbraw/zinc/30/39/12/1425303912.db2.gz ARSFCCSNIIEYQI-FQEVSTJZSA-N 2 1 387.568 3.180 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)CCCC[NH+]2CCOCC2)CC1 ZINC000170694378 1425304076 /nfs/dbraw/zinc/30/40/76/1425304076.db2.gz VJKROVQAZRMEBU-UHFFFAOYSA-N 2 1 387.568 3.037 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)CC1 ZINC000170756534 1425328963 /nfs/dbraw/zinc/32/89/63/1425328963.db2.gz RYWCBUFOGFNMOT-LJQANCHMSA-N 2 1 380.964 3.459 20 0 GGADMP O=C(NC1CC[NH+](CC2CC2)CC1)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000171016077 1425438049 /nfs/dbraw/zinc/43/80/49/1425438049.db2.gz UHOHUMHBSBLRQI-UHFFFAOYSA-N 2 1 398.595 3.211 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@H](c1ccc(C)cc1)[NH+]1CCCC1 ZINC000171211913 1425542481 /nfs/dbraw/zinc/54/24/81/1425542481.db2.gz UNNGGLCEHRSLQU-GHTZIAJQSA-N 2 1 383.540 3.272 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000171212605 1425542495 /nfs/dbraw/zinc/54/24/95/1425542495.db2.gz BVVMNRBVLSIYSC-SJLPKXTDSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000171212605 1425542499 /nfs/dbraw/zinc/54/24/99/1425542499.db2.gz BVVMNRBVLSIYSC-SJLPKXTDSA-N 2 1 389.569 3.101 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000171362691 1425641400 /nfs/dbraw/zinc/64/14/00/1425641400.db2.gz BXCVTISWSBCYJF-UYAOXDASSA-N 2 1 375.561 3.125 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)Nc1ccc(N2CCC[NH+](C)CC2)cc1)c1ccccc1 ZINC000171478615 1425699513 /nfs/dbraw/zinc/69/95/13/1425699513.db2.gz VWRREGRRBLYUIW-JOCHJYFZSA-N 2 1 380.536 3.460 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)Nc1ccc(N2CCC[N@H+](C)CC2)cc1)c1ccccc1 ZINC000171478615 1425699514 /nfs/dbraw/zinc/69/95/14/1425699514.db2.gz VWRREGRRBLYUIW-JOCHJYFZSA-N 2 1 380.536 3.460 20 0 GGADMP CC[NH+](C)[C@@H](C(=O)Nc1ccc(N2CCC[N@@H+](C)CC2)cc1)c1ccccc1 ZINC000171478615 1425699520 /nfs/dbraw/zinc/69/95/20/1425699520.db2.gz VWRREGRRBLYUIW-JOCHJYFZSA-N 2 1 380.536 3.460 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[C@H]1C[NH+]1CCCC1)c1ccccc1Cl ZINC000171588143 1425749017 /nfs/dbraw/zinc/74/90/17/1425749017.db2.gz DCHHKPSEJOECQJ-LPHOPBHVSA-N 2 1 378.948 3.213 20 0 GGADMP CC(C)(CNC(=O)N1CCC[C@H]1C[NH+]1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000171633268 1425766659 /nfs/dbraw/zinc/76/66/59/1425766659.db2.gz VEBTWXMQKYBQBS-NRFANRHFSA-N 2 1 384.568 3.093 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[N@@H+]1CCc2ccccc2C1 ZINC000171761188 1425813529 /nfs/dbraw/zinc/81/35/29/1425813529.db2.gz RTVLWODMYRPATP-IBGZPJMESA-N 2 1 377.532 3.345 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000171761188 1425813532 /nfs/dbraw/zinc/81/35/32/1425813532.db2.gz RTVLWODMYRPATP-IBGZPJMESA-N 2 1 377.532 3.345 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)NC1CC[NH+](CC2CC2)CC1 ZINC000171768006 1425815227 /nfs/dbraw/zinc/81/52/27/1425815227.db2.gz QNNAQPRAFPAKMN-OAQYLSRUSA-N 2 1 376.589 3.205 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)CCCC[NH+]2CCOCC2)CCCC1)c1ccccc1 ZINC000172036296 1425879706 /nfs/dbraw/zinc/87/97/06/1425879706.db2.gz ZKZQWRUFBQSJNG-FQEVSTJZSA-N 2 1 387.568 3.269 20 0 GGADMP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2coc(-c3ccccc3)n2)CC1 ZINC000172124837 1425906186 /nfs/dbraw/zinc/90/61/86/1425906186.db2.gz ZNMSMFZHYINVIJ-UHFFFAOYSA-N 2 1 398.551 3.402 20 0 GGADMP Cc1ccc(C)c(OC2CC[NH+](CC(=O)NC3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000172246974 1425965181 /nfs/dbraw/zinc/96/51/81/1425965181.db2.gz OHAMYXMVMYNZGH-UHFFFAOYSA-N 2 1 387.568 3.136 20 0 GGADMP C[C@@H](c1ccc(NC(=O)NC2CC[NH+](CC3CC3)CC2)cc1)[NH+]1CCOCC1 ZINC000172250290 1425966674 /nfs/dbraw/zinc/96/66/74/1425966674.db2.gz YBURYBSOBLZMOJ-KRWDZBQOSA-N 2 1 386.540 3.076 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172514270 1426066573 /nfs/dbraw/zinc/06/65/73/1426066573.db2.gz HBCBXDDCJCULOM-HXUWFJFHSA-N 2 1 388.556 3.467 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172539242 1426078927 /nfs/dbraw/zinc/07/89/27/1426078927.db2.gz BCUWJPGDOCAAHA-UHFFFAOYSA-N 2 1 384.568 3.442 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)[NH+]1CCc2ccccc2C1 ZINC000172550016 1426082881 /nfs/dbraw/zinc/08/28/81/1426082881.db2.gz MJZBNFCULWJOPN-IBGZPJMESA-N 2 1 384.568 3.093 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[NH+](C2CCCC2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000172550016 1426082888 /nfs/dbraw/zinc/08/28/88/1426082888.db2.gz MJZBNFCULWJOPN-IBGZPJMESA-N 2 1 384.568 3.093 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[NH+](C2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000172550016 1426082894 /nfs/dbraw/zinc/08/28/94/1426082894.db2.gz MJZBNFCULWJOPN-IBGZPJMESA-N 2 1 384.568 3.093 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)c1ccc(F)cc1 ZINC000172556844 1426085984 /nfs/dbraw/zinc/08/59/84/1426085984.db2.gz JOKAFAQNGCWCAK-HXUWFJFHSA-N 2 1 376.520 3.088 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[N@@H+](C3CCCC3)CC2)cc1F ZINC000172566627 1426091125 /nfs/dbraw/zinc/09/11/25/1426091125.db2.gz ZXGYTSTXNDNWMW-UHFFFAOYSA-N 2 1 399.514 3.480 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[N@H+](C3CCCC3)CC2)cc1F ZINC000172566627 1426091134 /nfs/dbraw/zinc/09/11/34/1426091134.db2.gz ZXGYTSTXNDNWMW-UHFFFAOYSA-N 2 1 399.514 3.480 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[NH+](C2CCCC2)CC1 ZINC000172582249 1426097488 /nfs/dbraw/zinc/09/74/88/1426097488.db2.gz KVTNVIQOTBOCQZ-QFIPXVFZSA-N 2 1 398.595 3.211 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000172582249 1426097495 /nfs/dbraw/zinc/09/74/95/1426097495.db2.gz KVTNVIQOTBOCQZ-QFIPXVFZSA-N 2 1 398.595 3.211 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172582249 1426097501 /nfs/dbraw/zinc/09/75/01/1426097501.db2.gz KVTNVIQOTBOCQZ-QFIPXVFZSA-N 2 1 398.595 3.211 20 0 GGADMP C[C@H](NC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)(C)C[NH+](C)C ZINC000173057334 1426326320 /nfs/dbraw/zinc/32/63/20/1426326320.db2.gz GQFIDUNJUSERLT-KSZLIROESA-N 2 1 375.557 3.002 20 0 GGADMP C[C@H](NC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)(C)C[NH+](C)C ZINC000173057334 1426326330 /nfs/dbraw/zinc/32/63/30/1426326330.db2.gz GQFIDUNJUSERLT-KSZLIROESA-N 2 1 375.557 3.002 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)cc1)[NH+]1CCOCC1 ZINC000173136827 1426359339 /nfs/dbraw/zinc/35/93/39/1426359339.db2.gz GGIJJTQCICSDIP-RXVVDRJESA-N 2 1 388.556 3.418 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1)[NH+]1CCOCC1 ZINC000173136827 1426359342 /nfs/dbraw/zinc/35/93/42/1426359342.db2.gz GGIJJTQCICSDIP-RXVVDRJESA-N 2 1 388.556 3.418 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)CC1 ZINC000173137654 1426359668 /nfs/dbraw/zinc/35/96/68/1426359668.db2.gz XRIKTYLPBHEVCC-GOSISDBHSA-N 2 1 388.556 3.466 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000173141313 1426361973 /nfs/dbraw/zinc/36/19/73/1426361973.db2.gz WHVWJQXHUNZBDI-GOSISDBHSA-N 2 1 376.545 3.213 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000173323565 1426506604 /nfs/dbraw/zinc/50/66/04/1426506604.db2.gz GZKORVOZBUCXRA-GMAHTHKFSA-N 2 1 394.563 3.453 20 0 GGADMP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000173351287 1426528947 /nfs/dbraw/zinc/52/89/47/1426528947.db2.gz SQODDHSHGQZLKP-VQTJNVASSA-N 2 1 384.524 3.046 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000173351287 1426528958 /nfs/dbraw/zinc/52/89/58/1426528958.db2.gz SQODDHSHGQZLKP-VQTJNVASSA-N 2 1 384.524 3.046 20 0 GGADMP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000173351314 1426529159 /nfs/dbraw/zinc/52/91/59/1426529159.db2.gz SQODDHSHGQZLKP-WOJBJXKFSA-N 2 1 384.524 3.046 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000173351314 1426529166 /nfs/dbraw/zinc/52/91/66/1426529166.db2.gz SQODDHSHGQZLKP-WOJBJXKFSA-N 2 1 384.524 3.046 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@@H]1CCSc2ccccc21 ZINC000173376054 1426549117 /nfs/dbraw/zinc/54/91/17/1426549117.db2.gz LQCITPQNKPRXIP-IEBWSBKVSA-N 2 1 390.597 3.281 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000173429030 1426610687 /nfs/dbraw/zinc/61/06/87/1426610687.db2.gz NVENRJGOMLTFCS-LPHOPBHVSA-N 2 1 380.964 3.316 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000173429030 1426610700 /nfs/dbraw/zinc/61/07/00/1426610700.db2.gz NVENRJGOMLTFCS-LPHOPBHVSA-N 2 1 380.964 3.316 20 0 GGADMP CC[NH+](CC)C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)C1 ZINC000173602212 1426772935 /nfs/dbraw/zinc/77/29/35/1426772935.db2.gz YTBPXSSEHUXMCF-SBHAEUEKSA-N 2 1 387.568 3.100 20 0 GGADMP CC[NH+](CC)C[C@H]1CCN(C(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173602198 1426773506 /nfs/dbraw/zinc/77/35/06/1426773506.db2.gz YTBPXSSEHUXMCF-SVFBPWRDSA-N 2 1 387.568 3.100 20 0 GGADMP CC[NH+](CC)C[C@H]1CCN(C(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173602198 1426773518 /nfs/dbraw/zinc/77/35/18/1426773518.db2.gz YTBPXSSEHUXMCF-SVFBPWRDSA-N 2 1 387.568 3.100 20 0 GGADMP C[C@@H](C(=O)N(C)Cc1nc2ccccc2s1)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000173643308 1426808075 /nfs/dbraw/zinc/80/80/75/1426808075.db2.gz BLWQDOYZYAEDTB-IRXDYDNUSA-N 2 1 388.581 3.449 20 0 GGADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000173785164 1426850930 /nfs/dbraw/zinc/85/09/30/1426850930.db2.gz LZEPYNHTJZPLMA-FQEVSTJZSA-N 2 1 397.567 3.481 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]Cc2ccc3c(c2)CCC3)c1 ZINC000173834036 1426864380 /nfs/dbraw/zinc/86/43/80/1426864380.db2.gz WAPLXNMXZMBNHT-UHFFFAOYSA-N 2 1 393.531 3.126 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc4c(c3)CCC4)c2)C1 ZINC000173838045 1426865575 /nfs/dbraw/zinc/86/55/75/1426865575.db2.gz PNLGZLKJTAYTOW-QHCPKHFHSA-N 2 1 377.532 3.162 20 0 GGADMP CC(C)[C@H]1C[N@H+]([C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CCS1 ZINC000173864079 1426874563 /nfs/dbraw/zinc/87/45/63/1426874563.db2.gz HDFANKXAOOHWAH-GHTZIAJQSA-N 2 1 389.609 3.229 20 0 GGADMP CC[NH+](C)C[C@H]1CC[NH+](Cc2ccccc2CN2CC[C@H](C[N@H+](C)CC)C2)C1 ZINC000173885594 1426881249 /nfs/dbraw/zinc/88/12/49/1426881249.db2.gz OVYMLUOFWOXPCW-FGZHOGPDSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2CN2CC[C@H](C[NH+](C)CC)C2)C1 ZINC000173885594 1426881251 /nfs/dbraw/zinc/88/12/51/1426881251.db2.gz OVYMLUOFWOXPCW-FGZHOGPDSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2CN2CC[C@H](C[NH+](C)CC)C2)C1 ZINC000173885594 1426881253 /nfs/dbraw/zinc/88/12/53/1426881253.db2.gz OVYMLUOFWOXPCW-FGZHOGPDSA-N 3 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(Cc2ccccc2CN2CC[C@H](C[N@@H+](C)CC)C2)C1 ZINC000173885594 1426881258 /nfs/dbraw/zinc/88/12/58/1426881258.db2.gz OVYMLUOFWOXPCW-FGZHOGPDSA-N 2 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@H]1CCN(Cc2ccccc2CN2CC[C@H](C[N@H+](C)CC)C2)C1 ZINC000173885594 1426881260 /nfs/dbraw/zinc/88/12/60/1426881260.db2.gz OVYMLUOFWOXPCW-FGZHOGPDSA-N 2 1 386.628 3.234 20 0 GGADMP CC[N@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000173906202 1426887071 /nfs/dbraw/zinc/88/70/71/1426887071.db2.gz VMVGMAQIALBXEH-UXHICEINSA-N 2 1 384.520 3.492 20 0 GGADMP CC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000173906202 1426887075 /nfs/dbraw/zinc/88/70/75/1426887075.db2.gz VMVGMAQIALBXEH-UXHICEINSA-N 2 1 384.520 3.492 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@H+](C[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000173906202 1426887076 /nfs/dbraw/zinc/88/70/76/1426887076.db2.gz VMVGMAQIALBXEH-UXHICEINSA-N 2 1 384.520 3.492 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000173906202 1426887078 /nfs/dbraw/zinc/88/70/78/1426887078.db2.gz VMVGMAQIALBXEH-UXHICEINSA-N 2 1 384.520 3.492 20 0 GGADMP C[C@H](c1nc(-c2cccs2)no1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173950691 1426906727 /nfs/dbraw/zinc/90/67/27/1426906727.db2.gz OAXZJHMORSQYMV-OAHLLOKOSA-N 2 1 376.526 3.436 20 0 GGADMP C[C@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173955123 1426908226 /nfs/dbraw/zinc/90/82/26/1426908226.db2.gz CXZQUWDZXTYMLI-MRXNPFEDSA-N 2 1 379.932 3.244 20 0 GGADMP C[NH+]1CCC(C(=O)NC[C@@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CC1 ZINC000173991190 1426930089 /nfs/dbraw/zinc/93/00/89/1426930089.db2.gz UWANETOJIPHYAB-FQEVSTJZSA-N 2 1 383.561 3.306 20 0 GGADMP C[NH+]1CCC(C(=O)NC[C@@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CC1 ZINC000173991190 1426930091 /nfs/dbraw/zinc/93/00/91/1426930091.db2.gz UWANETOJIPHYAB-FQEVSTJZSA-N 2 1 383.561 3.306 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccncc2)CC1)[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000174049710 1426972002 /nfs/dbraw/zinc/97/20/02/1426972002.db2.gz OELZZGUVMMMGRK-HSZRJFAPSA-N 2 1 392.547 3.217 20 0 GGADMP CN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000174112349 1427007493 /nfs/dbraw/zinc/00/74/93/1427007493.db2.gz YKXCPFFCVVFDRJ-VQTJNVASSA-N 2 1 384.524 3.188 20 0 GGADMP CN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000174112349 1427007502 /nfs/dbraw/zinc/00/75/02/1427007502.db2.gz YKXCPFFCVVFDRJ-VQTJNVASSA-N 2 1 384.524 3.188 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)C1 ZINC000174118961 1427009749 /nfs/dbraw/zinc/00/97/49/1427009749.db2.gz OOQRBWQYVAOAOI-LJQANCHMSA-N 2 1 390.547 3.163 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCN(CC(F)(F)F)C1=O ZINC000174156399 1427024533 /nfs/dbraw/zinc/02/45/33/1427024533.db2.gz ABODXUGALZXWGV-SFHVURJKSA-N 2 1 395.425 3.164 20 0 GGADMP O=C(C[NH+]1CCC(C(F)(F)F)CC1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000174182745 1427036471 /nfs/dbraw/zinc/03/64/71/1427036471.db2.gz GKGDPNCPNGXVJL-UHFFFAOYSA-N 2 1 383.458 3.173 20 0 GGADMP Cc1cccc(N2CCC(NC(=O)NCCC[NH+](C(C)C)C(C)C)CC2)[nH+]1 ZINC000174269111 1427077655 /nfs/dbraw/zinc/07/76/55/1427077655.db2.gz DSWZDOIOYXTJEW-UHFFFAOYSA-N 2 1 375.561 3.167 20 0 GGADMP CC(C)[NH+]1CCC([NH2+][C@H](C)C(=O)N(C)CCOc2ccc(Cl)cc2)CC1 ZINC000174296151 1427090371 /nfs/dbraw/zinc/09/03/71/1427090371.db2.gz DRDYADFREOJYLB-MRXNPFEDSA-N 2 1 381.948 3.028 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]2CCS[C@H](C(C)C)C2)CC1 ZINC000174330152 1427104819 /nfs/dbraw/zinc/10/48/19/1427104819.db2.gz TVHOGQRULBBXJV-NRFANRHFSA-N 2 1 389.609 3.149 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2CCS[C@H](C(C)C)C2)CC1 ZINC000174330152 1427104825 /nfs/dbraw/zinc/10/48/25/1427104825.db2.gz TVHOGQRULBBXJV-NRFANRHFSA-N 2 1 389.609 3.149 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000174345250 1427111921 /nfs/dbraw/zinc/11/19/21/1427111921.db2.gz DXWDFQQIKPBDGL-QFIPXVFZSA-N 2 1 386.584 3.414 20 0 GGADMP C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174398400 1427138394 /nfs/dbraw/zinc/13/83/94/1427138394.db2.gz OLAGETUGFMUXTD-FQEVSTJZSA-N 2 1 391.515 3.127 20 0 GGADMP C[NH+](CCCN1C(=O)c2ccccc2C1=O)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174398400 1427138399 /nfs/dbraw/zinc/13/83/99/1427138399.db2.gz OLAGETUGFMUXTD-FQEVSTJZSA-N 2 1 391.515 3.127 20 0 GGADMP C[NH+](CCCN1C(=O)c2ccccc2C1=O)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174398400 1427138410 /nfs/dbraw/zinc/13/84/10/1427138410.db2.gz OLAGETUGFMUXTD-FQEVSTJZSA-N 2 1 391.515 3.127 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2cc(Cl)ccc2OC[C@@H]2CCCO2)CC1 ZINC000174421134 1427150142 /nfs/dbraw/zinc/15/01/42/1427150142.db2.gz SWBNWJLNIGPMPX-FQEVSTJZSA-N 2 1 395.975 3.015 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NC[C@@H](c1ccc(C)cc1)[NH+]1CCCC1 ZINC000174453595 1427162659 /nfs/dbraw/zinc/16/26/59/1427162659.db2.gz QAZKCTGPOBQVDS-NRFANRHFSA-N 2 1 383.540 3.416 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1OC(F)F ZINC000174498894 1427184272 /nfs/dbraw/zinc/18/42/72/1427184272.db2.gz LFQCBKDFERUXTM-HNNXBMFYSA-N 2 1 384.471 3.168 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1OC(F)F ZINC000174498876 1427184640 /nfs/dbraw/zinc/18/46/40/1427184640.db2.gz LFQCBKDFERUXTM-OAHLLOKOSA-N 2 1 384.471 3.168 20 0 GGADMP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](C)Cn1cc[nH+]c1C ZINC000174501025 1427186313 /nfs/dbraw/zinc/18/63/13/1427186313.db2.gz KWILNNSLGCDTSG-KNQAVFIVSA-N 2 1 397.567 3.381 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](C)Cn1cc[nH+]c1C ZINC000174501025 1427186327 /nfs/dbraw/zinc/18/63/27/1427186327.db2.gz KWILNNSLGCDTSG-KNQAVFIVSA-N 2 1 397.567 3.381 20 0 GGADMP O=C1COc2ccccc2N1CCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000174521176 1427200067 /nfs/dbraw/zinc/20/00/67/1427200067.db2.gz JPVNQUITPARXLS-UHFFFAOYSA-N 2 1 379.504 3.056 20 0 GGADMP O=C([C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000174568874 1427229280 /nfs/dbraw/zinc/22/92/80/1427229280.db2.gz XPXNHSZBASBEJE-RTWAWAEBSA-N 2 1 387.543 3.372 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@H+](C)CC34CCCCC4)cc2)C[C@@H](C)O1 ZINC000174573884 1427233738 /nfs/dbraw/zinc/23/37/38/1427233738.db2.gz BWWQNZRCRMVOPI-WOJBJXKFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@@H+](C)CC34CCCCC4)cc2)C[C@@H](C)O1 ZINC000174573884 1427233748 /nfs/dbraw/zinc/23/37/48/1427233748.db2.gz BWWQNZRCRMVOPI-WOJBJXKFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CC[NH+](C)CC34CCCCC4)cc2)C[C@H](C)O1 ZINC000174573857 1427233982 /nfs/dbraw/zinc/23/39/82/1427233982.db2.gz BWWQNZRCRMVOPI-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CC[NH+](C)CC34CCCCC4)cc2)C[C@H](C)O1 ZINC000174573857 1427233995 /nfs/dbraw/zinc/23/39/95/1427233995.db2.gz BWWQNZRCRMVOPI-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@H+](C)CC34CCCCC4)cc2)C[C@H](C)O1 ZINC000174573857 1427234001 /nfs/dbraw/zinc/23/40/01/1427234001.db2.gz BWWQNZRCRMVOPI-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@@H+](C)CC34CCCCC4)cc2)C[C@H](C)O1 ZINC000174573857 1427234009 /nfs/dbraw/zinc/23/40/09/1427234009.db2.gz BWWQNZRCRMVOPI-BGYRXZFFSA-N 2 1 399.579 3.386 20 0 GGADMP CCc1cc2oc(=O)cc(C[N@@H+](C)CCCN3CC[NH+](C)CC3)c2cc1Cl ZINC000174723493 1427332173 /nfs/dbraw/zinc/33/21/73/1427332173.db2.gz TVLJWICRIXCHNR-UHFFFAOYSA-N 2 1 391.943 3.078 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1c(-c2ccccc2)nc2ccccn21 ZINC000174728498 1427334759 /nfs/dbraw/zinc/33/47/59/1427334759.db2.gz YTLJYKACZVZUFL-UHFFFAOYSA-N 2 1 377.536 3.071 20 0 GGADMP CC[NH+](CC)CCSCC(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000174764084 1427354548 /nfs/dbraw/zinc/35/45/48/1427354548.db2.gz JKQOFQYMAPRLIJ-UHFFFAOYSA-N 2 1 378.517 3.011 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(C)c(OC)c1C ZINC000174900767 1427435060 /nfs/dbraw/zinc/43/50/60/1427435060.db2.gz LVYKYDKQJKRULM-GOSISDBHSA-N 2 1 376.545 3.192 20 0 GGADMP C[C@H](C(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000174971609 1427473082 /nfs/dbraw/zinc/47/30/82/1427473082.db2.gz OLFHBNBCILOFGL-IRLDBZIGSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@H](C(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000174971609 1427473088 /nfs/dbraw/zinc/47/30/88/1427473088.db2.gz OLFHBNBCILOFGL-IRLDBZIGSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@H](C(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000174971609 1427473093 /nfs/dbraw/zinc/47/30/93/1427473093.db2.gz OLFHBNBCILOFGL-IRLDBZIGSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@H](C(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000174971609 1427473097 /nfs/dbraw/zinc/47/30/97/1427473097.db2.gz OLFHBNBCILOFGL-IRLDBZIGSA-N 2 1 391.559 3.414 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@H]2CCc3ccc(F)cc32)c1 ZINC000174998194 1427487096 /nfs/dbraw/zinc/48/70/96/1427487096.db2.gz CKDNYYWPCZPMRD-QFIPXVFZSA-N 2 1 397.494 3.264 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000175237066 1427618784 /nfs/dbraw/zinc/61/87/84/1427618784.db2.gz HMRCQMVPZBXTGN-JOCHJYFZSA-N 2 1 398.595 3.414 20 0 GGADMP C[C@@H](CCNC(=O)NCc1cccc(C[NH+](C)C)c1)[N@@H+](C)Cc1ccccc1 ZINC000175301764 1427661026 /nfs/dbraw/zinc/66/10/26/1427661026.db2.gz HWHUPHYJDKUYAC-IBGZPJMESA-N 2 1 382.552 3.458 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000175418397 1427744180 /nfs/dbraw/zinc/74/41/80/1427744180.db2.gz MJBJQHXUSFQLCI-GCJKJVERSA-N 2 1 384.568 3.213 20 0 GGADMP CN(C[C@H]1CCC[N@H+](C)C1)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175454024 1427763152 /nfs/dbraw/zinc/76/31/52/1427763152.db2.gz DNVXDPHEUWNRRL-IBGZPJMESA-N 2 1 398.551 3.395 20 0 GGADMP CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175454024 1427763168 /nfs/dbraw/zinc/76/31/68/1427763168.db2.gz DNVXDPHEUWNRRL-IBGZPJMESA-N 2 1 398.551 3.395 20 0 GGADMP CN(C[C@H]1CCC[NH+](C)C1)C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000175454024 1427763182 /nfs/dbraw/zinc/76/31/82/1427763182.db2.gz DNVXDPHEUWNRRL-IBGZPJMESA-N 2 1 398.551 3.395 20 0 GGADMP CN(C[C@H]1CCC[NH+](C)C1)C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000175454024 1427763205 /nfs/dbraw/zinc/76/32/05/1427763205.db2.gz DNVXDPHEUWNRRL-IBGZPJMESA-N 2 1 398.551 3.395 20 0 GGADMP CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175454773 1427763255 /nfs/dbraw/zinc/76/32/55/1427763255.db2.gz TYVVMJDWZFATTO-QFIPXVFZSA-N 2 1 398.551 3.393 20 0 GGADMP CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175454773 1427763273 /nfs/dbraw/zinc/76/32/73/1427763273.db2.gz TYVVMJDWZFATTO-QFIPXVFZSA-N 2 1 398.551 3.393 20 0 GGADMP CC(C)[C@@H]1C[NH+](C)CCN1C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000175454773 1427763284 /nfs/dbraw/zinc/76/32/84/1427763284.db2.gz TYVVMJDWZFATTO-QFIPXVFZSA-N 2 1 398.551 3.393 20 0 GGADMP CC(C)[C@@H]1C[NH+](C)CCN1C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000175454773 1427763298 /nfs/dbraw/zinc/76/32/98/1427763298.db2.gz TYVVMJDWZFATTO-QFIPXVFZSA-N 2 1 398.551 3.393 20 0 GGADMP Cc1nccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473694 1427773818 /nfs/dbraw/zinc/77/38/18/1427773818.db2.gz NYMWLGUDMUHPIF-DBXWQHBBSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473694 1427773820 /nfs/dbraw/zinc/77/38/20/1427773820.db2.gz NYMWLGUDMUHPIF-DBXWQHBBSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175473694 1427773823 /nfs/dbraw/zinc/77/38/23/1427773823.db2.gz NYMWLGUDMUHPIF-DBXWQHBBSA-N 2 1 383.540 3.180 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175578259 1427820808 /nfs/dbraw/zinc/82/08/08/1427820808.db2.gz GHBSREWNWNNHKI-NQIIRXRSSA-N 2 1 383.540 3.324 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000175578259 1427820809 /nfs/dbraw/zinc/82/08/09/1427820809.db2.gz GHBSREWNWNNHKI-NQIIRXRSSA-N 2 1 383.540 3.324 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(COC(C)C)cc1 ZINC000175634279 1427838715 /nfs/dbraw/zinc/83/87/15/1427838715.db2.gz SXAJUAGIMYUQSR-OAQYLSRUSA-N 2 1 390.572 3.491 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](C2CCCC2)CC1)[N@@H+]1CCc2sccc2C1 ZINC000175637893 1427839924 /nfs/dbraw/zinc/83/99/24/1427839924.db2.gz PXIABRNJMZNJQT-INIZCTEOSA-N 2 1 390.597 3.201 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](C2CCCC2)CC1)[N@H+]1CCc2sccc2C1 ZINC000175637893 1427839925 /nfs/dbraw/zinc/83/99/25/1427839925.db2.gz PXIABRNJMZNJQT-INIZCTEOSA-N 2 1 390.597 3.201 20 0 GGADMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CCC(OCCC[NH+](C)C)CC2)C1 ZINC000175754012 1427879481 /nfs/dbraw/zinc/87/94/81/1427879481.db2.gz VXYDKZMHGXNJNR-LJQANCHMSA-N 2 1 396.620 3.029 20 0 GGADMP C[C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000175780681 1427889879 /nfs/dbraw/zinc/88/98/79/1427889879.db2.gz URUIKUAHVWQXEC-UXHICEINSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000175780702 1427889929 /nfs/dbraw/zinc/88/99/29/1427889929.db2.gz URUIKUAHVWQXEC-PMACEKPBSA-N 2 1 386.584 3.413 20 0 GGADMP C[N@@H+](CCNC(=O)NC1CC[NH+](C2CCCCC2)CC1)Cc1ccc(F)cc1 ZINC000175842692 1427925025 /nfs/dbraw/zinc/92/50/25/1427925025.db2.gz ZLNIEZQSFAVMFG-UHFFFAOYSA-N 2 1 390.547 3.354 20 0 GGADMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)N[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000175869840 1427942932 /nfs/dbraw/zinc/94/29/32/1427942932.db2.gz GPJKNPYWWJTLCF-LEWJYISDSA-N 2 1 381.524 3.030 20 0 GGADMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000175869840 1427942937 /nfs/dbraw/zinc/94/29/37/1427942937.db2.gz GPJKNPYWWJTLCF-LEWJYISDSA-N 2 1 381.524 3.030 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000175919698 1427972116 /nfs/dbraw/zinc/97/21/16/1427972116.db2.gz XRMQKPFEJHFXOR-UHFFFAOYSA-N 2 1 383.540 3.183 20 0 GGADMP CCOCc1cccc(NC(=O)N(CC[NH+](C)C)C[C@H]2CCC[N@H+]2CC)c1 ZINC000175932088 1427981082 /nfs/dbraw/zinc/98/10/82/1427981082.db2.gz GVVAULMMWOZKCN-HXUWFJFHSA-N 2 1 376.545 3.103 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(CSC)cc1 ZINC000176012866 1428026871 /nfs/dbraw/zinc/02/68/71/1428026871.db2.gz JMDFAUGLNLXJRH-IBGZPJMESA-N 2 1 378.586 3.429 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000176013934 1428027473 /nfs/dbraw/zinc/02/74/73/1428027473.db2.gz KWKLTEVWMHKNCA-LJQANCHMSA-N 2 1 384.568 3.309 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000176013934 1428027479 /nfs/dbraw/zinc/02/74/79/1428027479.db2.gz KWKLTEVWMHKNCA-LJQANCHMSA-N 2 1 384.568 3.309 20 0 GGADMP Cc1cccc(C[NH+]2CCN(C(=O)NC3CC[NH+](C4CCCC4)CC3)CC2)c1 ZINC000176023827 1428032374 /nfs/dbraw/zinc/03/23/74/1428032374.db2.gz VFNJBQPKXFVWHN-UHFFFAOYSA-N 2 1 384.568 3.229 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000176056433 1428056073 /nfs/dbraw/zinc/05/60/73/1428056073.db2.gz CJBOBUZZWDGMQH-GOSISDBHSA-N 2 1 383.540 3.134 20 0 GGADMP C[NH+](C)CCOc1cccc(CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)c1 ZINC000176205352 1428167128 /nfs/dbraw/zinc/16/71/28/1428167128.db2.gz CIVGYZKRDIXLOK-QFIPXVFZSA-N 2 1 399.510 3.047 20 0 GGADMP C[NH+](C)CCOc1cccc(CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)c1 ZINC000176205352 1428167134 /nfs/dbraw/zinc/16/71/34/1428167134.db2.gz CIVGYZKRDIXLOK-QFIPXVFZSA-N 2 1 399.510 3.047 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)C[C@H](C)O1 ZINC000180312641 1429833599 /nfs/dbraw/zinc/83/35/99/1429833599.db2.gz DBMGERDWVRDHNH-FCGDIQPGSA-N 2 1 383.577 3.159 20 0 GGADMP O=C(Nc1cccc(CC[NH+]2CCCC2)c1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000180315817 1429834424 /nfs/dbraw/zinc/83/44/24/1429834424.db2.gz KWOGBMURBJPTGA-QHCPKHFHSA-N 2 1 393.531 3.164 20 0 GGADMP O=C(Nc1cccc(CC[NH+]2CCCC2)c1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000180315817 1429834429 /nfs/dbraw/zinc/83/44/29/1429834429.db2.gz KWOGBMURBJPTGA-QHCPKHFHSA-N 2 1 393.531 3.164 20 0 GGADMP C[C@@H](CNC(=O)NCC1CCN(c2cc[nH+]cc2)CC1)[N@@H+](C)Cc1ccccc1 ZINC000180338632 1429839519 /nfs/dbraw/zinc/83/95/19/1429839519.db2.gz QKOCKGORJZFOQC-IBGZPJMESA-N 2 1 395.551 3.118 20 0 GGADMP C[C@H](CNC(=O)NCC1CCN(c2cc[nH+]cc2)CC1)[N@@H+](C)Cc1ccccc1 ZINC000180338650 1429839620 /nfs/dbraw/zinc/83/96/20/1429839620.db2.gz QKOCKGORJZFOQC-LJQANCHMSA-N 2 1 395.551 3.118 20 0 GGADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1 ZINC000180404541 1429859115 /nfs/dbraw/zinc/85/91/15/1429859115.db2.gz BVNVLIOUBMJCLB-SFHVURJKSA-N 2 1 393.597 3.385 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C[N@@H+](C)Cc1ccccc1N1CCCC1)c1ccccc1 ZINC000180421106 1429864477 /nfs/dbraw/zinc/86/44/77/1429864477.db2.gz OIVVUBFGKZSNGG-QHCPKHFHSA-N 2 1 394.563 3.138 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C[N@H+](C)Cc1ccccc1N1CCCC1)c1ccccc1 ZINC000180421106 1429864481 /nfs/dbraw/zinc/86/44/81/1429864481.db2.gz OIVVUBFGKZSNGG-QHCPKHFHSA-N 2 1 394.563 3.138 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(Cl)c(C)c3)CC2)CC1 ZINC000180430645 1429867403 /nfs/dbraw/zinc/86/74/03/1429867403.db2.gz ZTOOFNQAGRGPJO-UHFFFAOYSA-N 2 1 377.960 3.415 20 0 GGADMP CCc1cc(NCc2cccc(OCC[N@H+](C)C3CCOCC3)c2)nc(C)[nH+]1 ZINC000180434187 1429868758 /nfs/dbraw/zinc/86/87/58/1429868758.db2.gz LIMFIZHPZOFCQA-UHFFFAOYSA-N 2 1 384.524 3.449 20 0 GGADMP CCc1cc(NCc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)nc(C)[nH+]1 ZINC000180434187 1429868759 /nfs/dbraw/zinc/86/87/59/1429868759.db2.gz LIMFIZHPZOFCQA-UHFFFAOYSA-N 2 1 384.524 3.449 20 0 GGADMP C[C@@H](NCC1([NH+]2CCCCC2)CCOCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000180739170 1430009581 /nfs/dbraw/zinc/00/95/81/1430009581.db2.gz VTRHGOLCIIBOFF-HXUWFJFHSA-N 2 1 389.584 3.313 20 0 GGADMP C[C@H](NCC1([NH+]2CCCCC2)CCOCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000180738969 1430009763 /nfs/dbraw/zinc/00/97/63/1430009763.db2.gz LVDCTXTUASHKDE-FQEVSTJZSA-N 2 1 389.584 3.313 20 0 GGADMP O=C1Nc2ccccc2C12CCC([NH2+]CC1([NH+]3CCCCC3)CCOCC1)CC2 ZINC000180738942 1430009840 /nfs/dbraw/zinc/00/98/40/1430009840.db2.gz CJCXFVWRBZYPKR-UHFFFAOYSA-N 2 1 397.563 3.444 20 0 GGADMP COc1ccccc1NC(=O)C[C@H](C)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180740801 1430010968 /nfs/dbraw/zinc/01/09/68/1430010968.db2.gz WLEZIKXRNXYXDC-SFHVURJKSA-N 2 1 389.540 3.037 20 0 GGADMP COc1ccccc1NC(=O)C[C@@H](C)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180740814 1430011299 /nfs/dbraw/zinc/01/12/99/1430011299.db2.gz WLEZIKXRNXYXDC-GOSISDBHSA-N 2 1 389.540 3.037 20 0 GGADMP O=C([C@H]1CCC[N@H+]1Cc1ccccc1)N1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000180748387 1430016426 /nfs/dbraw/zinc/01/64/26/1430016426.db2.gz LSVLMCAXUNGMHK-HSZRJFAPSA-N 2 1 399.579 3.002 20 0 GGADMP COC(=O)COc1c(C)cc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000180786314 1430039345 /nfs/dbraw/zinc/03/93/45/1430039345.db2.gz POBNJTJAMALTOX-TZIWHRDSSA-N 2 1 386.536 3.304 20 0 GGADMP COC(=O)COc1c(C)cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1C ZINC000180786314 1430039356 /nfs/dbraw/zinc/03/93/56/1430039356.db2.gz POBNJTJAMALTOX-TZIWHRDSSA-N 2 1 386.536 3.304 20 0 GGADMP COC(=O)COc1c(C)cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1C ZINC000180786314 1430039363 /nfs/dbraw/zinc/03/93/63/1430039363.db2.gz POBNJTJAMALTOX-TZIWHRDSSA-N 2 1 386.536 3.304 20 0 GGADMP C[C@H]1C[N@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CCN1CC(F)(F)F ZINC000180834782 1430062889 /nfs/dbraw/zinc/06/28/89/1430062889.db2.gz QYLGJHHCJWERLB-KRWDZBQOSA-N 2 1 398.517 3.285 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CCN1CC(F)(F)F ZINC000180834782 1430062896 /nfs/dbraw/zinc/06/28/96/1430062896.db2.gz QYLGJHHCJWERLB-KRWDZBQOSA-N 2 1 398.517 3.285 20 0 GGADMP COc1cc(-c2noc(CCCCC[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)n2)ccc1O ZINC000180865389 1430076285 /nfs/dbraw/zinc/07/62/85/1430076285.db2.gz FBXKTNYYVGZLGL-WBVHZDCISA-N 2 1 388.512 3.236 20 0 GGADMP COc1cc(-c2noc(CCCCC[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)n2)ccc1O ZINC000180865371 1430076835 /nfs/dbraw/zinc/07/68/35/1430076835.db2.gz FBXKTNYYVGZLGL-DOTOQJQBSA-N 2 1 388.512 3.236 20 0 GGADMP C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180879491 1430084592 /nfs/dbraw/zinc/08/45/92/1430084592.db2.gz RQUHNENUWIOMLN-MOPGFXCFSA-N 2 1 395.588 3.257 20 0 GGADMP C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180879543 1430084762 /nfs/dbraw/zinc/08/47/62/1430084762.db2.gz RQUHNENUWIOMLN-RBUKOAKNSA-N 2 1 395.588 3.257 20 0 GGADMP Cc1cc(C)c(NC(=O)CCC[N@H+](C)CCN(C)C2CC[NH+](C)CC2)c(C)c1 ZINC000180933990 1430123101 /nfs/dbraw/zinc/12/31/01/1430123101.db2.gz UQQIRGJIDSQHBH-UHFFFAOYSA-N 2 1 388.600 3.288 20 0 GGADMP CC(C)(C)OC(=O)C1CCC([NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)CC1 ZINC000180993644 1430157120 /nfs/dbraw/zinc/15/71/20/1430157120.db2.gz KUSXFAQKGLLSFJ-JITJBCMDSA-N 2 1 388.552 3.243 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000181027831 1430174444 /nfs/dbraw/zinc/17/44/44/1430174444.db2.gz DAVBHJIIXNVBHB-HXUWFJFHSA-N 2 1 394.563 3.471 20 0 GGADMP CCOC(=O)c1nn(-c2ccccc2)cc1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000181035649 1430179834 /nfs/dbraw/zinc/17/98/34/1430179834.db2.gz RRTKVUDECZNYPF-UHFFFAOYSA-N 2 1 392.503 3.400 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cnn(Cc2ccccc2)c1 ZINC000181409885 1430290861 /nfs/dbraw/zinc/29/08/61/1430290861.db2.gz FQULUJVGVVFZEL-NMNUPHIUSA-N 2 1 382.552 3.350 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc(OC)c1OC ZINC000181418061 1430293222 /nfs/dbraw/zinc/29/32/22/1430293222.db2.gz SGDUUIYRVZSBCZ-MNEFBYGVSA-N 2 1 392.540 3.131 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000181499487 1430310991 /nfs/dbraw/zinc/31/09/91/1430310991.db2.gz MSINVJGPHPPGCY-SFHVURJKSA-N 2 1 398.555 3.171 20 0 GGADMP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCN(C)S(=O)(=O)c3cccs3)CC2)C1 ZINC000181504709 1430311623 /nfs/dbraw/zinc/31/16/23/1430311623.db2.gz DQVNCFKSEUOHGP-WMZOPIPTSA-N 2 1 399.626 3.001 20 0 GGADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCN(C)S(=O)(=O)c3cccs3)CC2)C1 ZINC000181504695 1430311663 /nfs/dbraw/zinc/31/16/63/1430311663.db2.gz DQVNCFKSEUOHGP-AEFFLSMTSA-N 2 1 399.626 3.001 20 0 GGADMP Cc1cc(S(=O)(=O)NCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(C)s1 ZINC000181506655 1430312307 /nfs/dbraw/zinc/31/23/07/1430312307.db2.gz ITEHDQFTYLHOGX-UHFFFAOYSA-N 2 1 399.626 3.030 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)C1 ZINC000181518668 1430314047 /nfs/dbraw/zinc/31/40/47/1430314047.db2.gz XEGSORKTPHXEJH-OALUTQOASA-N 2 1 393.597 3.245 20 0 GGADMP C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000181576521 1430322655 /nfs/dbraw/zinc/32/26/55/1430322655.db2.gz LSMPXYZXVDKJLW-TXPKVOOTSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000181576521 1430322658 /nfs/dbraw/zinc/32/26/58/1430322658.db2.gz LSMPXYZXVDKJLW-TXPKVOOTSA-N 2 1 387.474 3.395 20 0 GGADMP CC[NH+](CC)CCOc1ccc(NC(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)cc1 ZINC000181593849 1430324940 /nfs/dbraw/zinc/32/49/40/1430324940.db2.gz SDHCARBFXBAAQW-FQEVSTJZSA-N 2 1 376.545 3.211 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N[C@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)CC2)[nH+]c1 ZINC000181644313 1430333658 /nfs/dbraw/zinc/33/36/58/1430333658.db2.gz GFRRRFJBSQXYEG-UYAOXDASSA-N 2 1 384.568 3.376 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N[C@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)CC2)[nH+]c1 ZINC000181644313 1430333660 /nfs/dbraw/zinc/33/36/60/1430333660.db2.gz GFRRRFJBSQXYEG-UYAOXDASSA-N 2 1 384.568 3.376 20 0 GGADMP O=C1C[C@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000181821649 1430367326 /nfs/dbraw/zinc/36/73/26/1430367326.db2.gz LENWHZNUDNSDNS-HSZRJFAPSA-N 2 1 391.559 3.332 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000181901923 1430380643 /nfs/dbraw/zinc/38/06/43/1430380643.db2.gz AHLOPNYKQQTXBF-IRXDYDNUSA-N 2 1 386.458 3.395 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000181901923 1430380646 /nfs/dbraw/zinc/38/06/46/1430380646.db2.gz AHLOPNYKQQTXBF-IRXDYDNUSA-N 2 1 386.458 3.395 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000181916640 1430383006 /nfs/dbraw/zinc/38/30/06/1430383006.db2.gz ODDSAYODEDGUBO-SJORKVTESA-N 2 1 386.458 3.253 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000181916640 1430383009 /nfs/dbraw/zinc/38/30/09/1430383009.db2.gz ODDSAYODEDGUBO-SJORKVTESA-N 2 1 386.458 3.253 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000182215813 1430431212 /nfs/dbraw/zinc/43/12/12/1430431212.db2.gz OGFJMDJXDLQUSU-KURKYZTESA-N 2 1 376.570 3.011 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)c1ccc([S@](C)=O)cc1 ZINC000182235392 1430434593 /nfs/dbraw/zinc/43/45/93/1430434593.db2.gz BRWLWVHTOQOPDS-QHOOGPDPSA-N 2 1 386.561 3.232 20 0 GGADMP CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)c1 ZINC000182251943 1430437434 /nfs/dbraw/zinc/43/74/34/1430437434.db2.gz ILJKVACNWLROTC-UZUQRXQVSA-N 2 1 381.520 3.453 20 0 GGADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc2c(c1)OCCO2 ZINC000182259071 1430438756 /nfs/dbraw/zinc/43/87/56/1430438756.db2.gz RNVLDLPOAWARMS-SFTDATJTSA-N 2 1 382.504 3.265 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cnn(Cc2ccccc2)c1 ZINC000182268387 1430440196 /nfs/dbraw/zinc/44/01/96/1430440196.db2.gz OSWNKEGKTJVTGP-CYFREDJKSA-N 2 1 390.531 3.349 20 0 GGADMP COCCc1nc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)s1 ZINC000182269788 1430440357 /nfs/dbraw/zinc/44/03/57/1430440357.db2.gz URGRADMOZXVWTI-BEFAXECRSA-N 2 1 389.565 3.058 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cccc(N2CCCC2=O)c1 ZINC000182272589 1430440911 /nfs/dbraw/zinc/44/09/11/1430440911.db2.gz UFVXPSDFHMNDCV-MBSDFSHPSA-N 2 1 393.531 3.231 20 0 GGADMP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)CCCO2 ZINC000182273116 1430441163 /nfs/dbraw/zinc/44/11/63/1430441163.db2.gz BBXPEYAVORSISE-UGKGYDQZSA-N 2 1 382.504 3.265 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000182273538 1430441200 /nfs/dbraw/zinc/44/12/00/1430441200.db2.gz FABYBWMPPPVITK-XXBNENTESA-N 3 1 397.563 3.044 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21)Cc1ccccc1 ZINC000182330925 1430449762 /nfs/dbraw/zinc/44/97/62/1430449762.db2.gz ZYMUIODBPBGPLV-FSSWDIPSSA-N 2 1 386.584 3.065 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccnn1-c1ccccc1C ZINC000182391288 1430458178 /nfs/dbraw/zinc/45/81/78/1430458178.db2.gz RRVCNMXKIJKLDJ-IBGZPJMESA-N 2 1 398.555 3.061 20 0 GGADMP C[C@H](NC(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182401660 1430460870 /nfs/dbraw/zinc/46/08/70/1430460870.db2.gz LVFZBIBWIFVWFQ-ZGXWSNOMSA-N 2 1 378.605 3.307 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182401660 1430460871 /nfs/dbraw/zinc/46/08/71/1430460871.db2.gz LVFZBIBWIFVWFQ-ZGXWSNOMSA-N 2 1 378.605 3.307 20 0 GGADMP C[C@H](NC(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182401660 1430460873 /nfs/dbraw/zinc/46/08/73/1430460873.db2.gz LVFZBIBWIFVWFQ-ZGXWSNOMSA-N 2 1 378.605 3.307 20 0 GGADMP CC[C@@H]([NH2+]CC(=O)N1CCC[N@H+](Cc2ccc(C)cc2)CC1)c1c(C)noc1C ZINC000182449462 1430469329 /nfs/dbraw/zinc/46/93/29/1430469329.db2.gz RINCNIJPNMVZLV-OAQYLSRUSA-N 2 1 398.551 3.375 20 0 GGADMP CC[C@@H]([NH2+]CC(=O)N1CCC[N@@H+](Cc2ccc(C)cc2)CC1)c1c(C)noc1C ZINC000182449462 1430469332 /nfs/dbraw/zinc/46/93/32/1430469332.db2.gz RINCNIJPNMVZLV-OAQYLSRUSA-N 2 1 398.551 3.375 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCCC[C@@H]2S(C)(=O)=O)C1 ZINC000182448736 1430469487 /nfs/dbraw/zinc/46/94/87/1430469487.db2.gz NZUMESYTYITNCV-UIFIKXQLSA-N 2 1 378.582 3.364 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cn1 ZINC000182548498 1430488868 /nfs/dbraw/zinc/48/88/68/1430488868.db2.gz XYZXATPSLISNIG-QFBILLFUSA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cn1 ZINC000182548498 1430488873 /nfs/dbraw/zinc/48/88/73/1430488873.db2.gz XYZXATPSLISNIG-QFBILLFUSA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cn1 ZINC000182548519 1430488987 /nfs/dbraw/zinc/48/89/87/1430488987.db2.gz XYZXATPSLISNIG-VQIMIIECSA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cn1 ZINC000182548519 1430488992 /nfs/dbraw/zinc/48/89/92/1430488992.db2.gz XYZXATPSLISNIG-VQIMIIECSA-N 2 1 396.539 3.028 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCC[NH+]2CCC(O)CC2)cc1C[NH+]1CCCCC1 ZINC000182568434 1430494215 /nfs/dbraw/zinc/49/42/15/1430494215.db2.gz CQVZJFASTBIRQA-IBGZPJMESA-N 3 1 389.584 3.179 20 0 GGADMP C[C@H](NC(=O)NC1CC[NH+](C2CCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182690217 1430518042 /nfs/dbraw/zinc/51/80/42/1430518042.db2.gz FKOJFQJVKCJZTA-ZWKOTPCHSA-N 2 1 376.589 3.346 20 0 GGADMP C[C@@H](NC(=O)NC1CC[NH+](C2CCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182690239 1430518103 /nfs/dbraw/zinc/51/81/03/1430518103.db2.gz FKOJFQJVKCJZTA-QZTJIDSGSA-N 2 1 376.589 3.346 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N[C@@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)C1 ZINC000182756867 1430534497 /nfs/dbraw/zinc/53/44/97/1430534497.db2.gz LVEAYGOMJKFIDV-XUVXKRRUSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)C1 ZINC000182756867 1430534501 /nfs/dbraw/zinc/53/45/01/1430534501.db2.gz LVEAYGOMJKFIDV-XUVXKRRUSA-N 2 1 378.605 3.307 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000182756867 1430534506 /nfs/dbraw/zinc/53/45/06/1430534506.db2.gz LVEAYGOMJKFIDV-XUVXKRRUSA-N 2 1 378.605 3.307 20 0 GGADMP C[C@@H](NC(=O)NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182777833 1430538264 /nfs/dbraw/zinc/53/82/64/1430538264.db2.gz WCTDINLBYCMRQT-UYAOXDASSA-N 2 1 399.583 3.250 20 0 GGADMP C[C@H](NC(=O)NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182777812 1430538277 /nfs/dbraw/zinc/53/82/77/1430538277.db2.gz WCTDINLBYCMRQT-AZUAARDMSA-N 2 1 399.583 3.250 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000182837095 1430550640 /nfs/dbraw/zinc/55/06/40/1430550640.db2.gz KDHCRVOVNWOKNN-UNMCSNQZSA-N 2 1 398.595 3.475 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)CC1 ZINC000182837095 1430550645 /nfs/dbraw/zinc/55/06/45/1430550645.db2.gz KDHCRVOVNWOKNN-UNMCSNQZSA-N 2 1 398.595 3.475 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182856876 1430554788 /nfs/dbraw/zinc/55/47/88/1430554788.db2.gz TVPOXAKYTNPZJL-RBUKOAKNSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182862631 1430555940 /nfs/dbraw/zinc/55/59/40/1430555940.db2.gz GVTVUHWCONFDNA-QKNQBKEWSA-N 2 1 376.589 3.299 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)C1 ZINC000182861587 1430555955 /nfs/dbraw/zinc/55/59/55/1430555955.db2.gz VNZMGUVQIQXCQJ-NLWGTHIKSA-N 2 1 387.572 3.445 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000182861587 1430555957 /nfs/dbraw/zinc/55/59/57/1430555957.db2.gz VNZMGUVQIQXCQJ-NLWGTHIKSA-N 2 1 387.572 3.445 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)o1 ZINC000182865999 1430556920 /nfs/dbraw/zinc/55/69/20/1430556920.db2.gz SVFAHKCXOPJFRL-OALUTQOASA-N 2 1 390.572 3.314 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1cccs1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182914005 1430569906 /nfs/dbraw/zinc/56/99/06/1430569906.db2.gz TUBUGNKQHRJHOS-QZTJIDSGSA-N 2 1 392.613 3.474 20 0 GGADMP CC(C)c1cnc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)s1 ZINC000183015152 1430593116 /nfs/dbraw/zinc/59/31/16/1430593116.db2.gz NFOMKUXOYOHCAO-UHFFFAOYSA-N 2 1 380.602 3.183 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCC[C@H](C)[NH+]3CCCCC3)CC2)cs1 ZINC000183125903 1430621397 /nfs/dbraw/zinc/62/13/97/1430621397.db2.gz LWIYKEPBIQLOTN-INIZCTEOSA-N 2 1 378.586 3.044 20 0 GGADMP CNC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000183132509 1430624093 /nfs/dbraw/zinc/62/40/93/1430624093.db2.gz LWBQWVVOSHSCHH-XPWALMASSA-N 2 1 377.532 3.437 20 0 GGADMP CNC(=O)c1cccc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000183145179 1430628299 /nfs/dbraw/zinc/62/82/99/1430628299.db2.gz BEJUDJGXKRTVJJ-TZRRMPRUSA-N 2 1 391.559 3.479 20 0 GGADMP COC1CCC([NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)CC1 ZINC000183148404 1430629527 /nfs/dbraw/zinc/62/95/27/1430629527.db2.gz YEVCDFHNUXYZBL-UHFFFAOYSA-N 2 1 376.541 3.223 20 0 GGADMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000183191362 1430643759 /nfs/dbraw/zinc/64/37/59/1430643759.db2.gz NTQOREFCAJXEKV-JFIYKMOQSA-N 2 1 379.570 3.362 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]3C[NH+](C)CC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC000183224285 1430652136 /nfs/dbraw/zinc/65/21/36/1430652136.db2.gz MPCRDZLYZVQIAG-ZDFPQIBNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000183224285 1430652142 /nfs/dbraw/zinc/65/21/42/1430652142.db2.gz MPCRDZLYZVQIAG-ZDFPQIBNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)CC[NH+]1Cc1ccccc1 ZINC000183224285 1430652151 /nfs/dbraw/zinc/65/21/51/1430652151.db2.gz MPCRDZLYZVQIAG-ZDFPQIBNSA-N 2 1 384.568 3.165 20 0 GGADMP Cn1ccnc1[C@@H]([NH2+]CCCCN1CC[NH+](Cc2ccccc2)CC1)C1CC1 ZINC000183250780 1430660050 /nfs/dbraw/zinc/66/00/50/1430660050.db2.gz CWTRAYDXRKFVSF-QFIPXVFZSA-N 2 1 381.568 3.059 20 0 GGADMP COc1cccc([C@@H]2[C@H](NC(=O)CCn3cc[nH+]c3C(C)C)CC[N@@H+]2C2CC2)c1 ZINC000183272233 1430666756 /nfs/dbraw/zinc/66/67/56/1430666756.db2.gz NHLRHASPOUHLII-IFMALSPDSA-N 2 1 396.535 3.499 20 0 GGADMP COc1cccc([C@@H]2[C@H](NC(=O)CCn3cc[nH+]c3C(C)C)CC[N@H+]2C2CC2)c1 ZINC000183272233 1430666757 /nfs/dbraw/zinc/66/67/57/1430666757.db2.gz NHLRHASPOUHLII-IFMALSPDSA-N 2 1 396.535 3.499 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000183453736 1430715606 /nfs/dbraw/zinc/71/56/06/1430715606.db2.gz GSHQXDUCHFPTKS-JOCHJYFZSA-N 2 1 381.520 3.193 20 0 GGADMP C[C@@H](CCNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)[NH+]1CCCCC1 ZINC000183677839 1430770112 /nfs/dbraw/zinc/77/01/12/1430770112.db2.gz WGZATYWKVRREQX-OALUTQOASA-N 2 1 388.556 3.466 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cn(-c2ccccc2)nc1C ZINC000183737594 1430784262 /nfs/dbraw/zinc/78/42/62/1430784262.db2.gz LULXLJZWVNOTHA-HXUWFJFHSA-N 2 1 398.555 3.061 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C[NH+]1CCC(Nc2ccc(F)cc2)CC1)c1ccccc1 ZINC000184600144 1430914884 /nfs/dbraw/zinc/91/48/84/1430914884.db2.gz SYUUNJLRAQPRFJ-QFIPXVFZSA-N 2 1 398.526 3.121 20 0 GGADMP CCN(C(=O)NC1CC[NH+](CC2CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000184605810 1430917312 /nfs/dbraw/zinc/91/73/12/1430917312.db2.gz OELCMKDFIQPGFA-JOCHJYFZSA-N 2 1 384.568 3.167 20 0 GGADMP Cc1ccc(CNC(=O)C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000184741970 1430961107 /nfs/dbraw/zinc/96/11/07/1430961107.db2.gz LAVIAFKUPLIMEX-PMACEKPBSA-N 2 1 379.548 3.357 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)NCc1ccccc1F ZINC000184755170 1430967538 /nfs/dbraw/zinc/96/75/38/1430967538.db2.gz XJDKBVIHFOZHGG-ROUUACIJSA-N 2 1 383.511 3.188 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)N(C)CC[N@@H+](C)C2CC2)c2cccs2)CC1 ZINC000185063218 1431052282 /nfs/dbraw/zinc/05/22/82/1431052282.db2.gz XYVIVMCENYJNBX-SFHVURJKSA-N 2 1 378.586 3.257 20 0 GGADMP CC(C)[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000185082622 1431056455 /nfs/dbraw/zinc/05/64/55/1431056455.db2.gz SNHDWPPRSVHHIX-UNMCSNQZSA-N 2 1 379.552 3.278 20 0 GGADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC1(C[NH+](C)C)CCCC1 ZINC000185170522 1431076933 /nfs/dbraw/zinc/07/69/33/1431076933.db2.gz WOVJWLURSMQFNW-OAQYLSRUSA-N 2 1 386.584 3.272 20 0 GGADMP O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000185322090 1431113354 /nfs/dbraw/zinc/11/33/54/1431113354.db2.gz XTJLOLGGTHXZRS-GOSISDBHSA-N 2 1 389.883 3.495 20 0 GGADMP COc1ccc(C[C@H](C)C[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1F ZINC000185322130 1431113800 /nfs/dbraw/zinc/11/38/00/1431113800.db2.gz VKMHNCGGWSUGEH-UWJYYQICSA-N 2 1 386.511 3.369 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)N[C@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000185395289 1431135517 /nfs/dbraw/zinc/13/55/17/1431135517.db2.gz BDVFQYMEFWIQDV-KRWDZBQOSA-N 2 1 398.473 3.015 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)N[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000185395289 1431135526 /nfs/dbraw/zinc/13/55/26/1431135526.db2.gz BDVFQYMEFWIQDV-KRWDZBQOSA-N 2 1 398.473 3.015 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000185395289 1431135530 /nfs/dbraw/zinc/13/55/30/1431135530.db2.gz BDVFQYMEFWIQDV-KRWDZBQOSA-N 2 1 398.473 3.015 20 0 GGADMP CCC[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccnc1 ZINC000185400408 1431136734 /nfs/dbraw/zinc/13/67/34/1431136734.db2.gz MJHYGCQAOLHKMB-FCHUYYIVSA-N 2 1 380.536 3.410 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000185677378 1431203114 /nfs/dbraw/zinc/20/31/14/1431203114.db2.gz YCZJAZLPVJNQJP-YESZJQIVSA-N 2 1 387.524 3.027 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000185677378 1431203118 /nfs/dbraw/zinc/20/31/18/1431203118.db2.gz YCZJAZLPVJNQJP-YESZJQIVSA-N 2 1 387.524 3.027 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NCCc1c[nH]c2ccccc12)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185680128 1431203771 /nfs/dbraw/zinc/20/37/71/1431203771.db2.gz OYENDEQUBMLSLI-WSTZPKSXSA-N 2 1 396.579 3.458 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)NCCc1c[nH]c2ccccc12)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185680128 1431203772 /nfs/dbraw/zinc/20/37/72/1431203772.db2.gz OYENDEQUBMLSLI-WSTZPKSXSA-N 2 1 396.579 3.458 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCOc1cccc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185682423 1431204299 /nfs/dbraw/zinc/20/42/99/1431204299.db2.gz GTXVUOJOOBDEIG-IAGOWNOFSA-N 2 1 393.959 3.078 20 0 GGADMP C[C@@H]([NH2+]CC(=O)NCCOc1cccc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185682423 1431204306 /nfs/dbraw/zinc/20/43/06/1431204306.db2.gz GTXVUOJOOBDEIG-IAGOWNOFSA-N 2 1 393.959 3.078 20 0 GGADMP COc1ccc(Cl)cc1CNC(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185683529 1431204851 /nfs/dbraw/zinc/20/48/51/1431204851.db2.gz OVVBUGQOOWJRDI-HZPDHXFCSA-N 2 1 393.959 3.207 20 0 GGADMP COc1ccc(Cl)cc1CNC(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185683529 1431204858 /nfs/dbraw/zinc/20/48/58/1431204858.db2.gz OVVBUGQOOWJRDI-HZPDHXFCSA-N 2 1 393.959 3.207 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185685927 1431206073 /nfs/dbraw/zinc/20/60/73/1431206073.db2.gz ZVWKEIDVTDQFRP-RBUKOAKNSA-N 2 1 384.568 3.468 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185685927 1431206078 /nfs/dbraw/zinc/20/60/78/1431206078.db2.gz ZVWKEIDVTDQFRP-RBUKOAKNSA-N 2 1 384.568 3.468 20 0 GGADMP COc1ccc2c(c1)CCCN2C(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185689446 1431206590 /nfs/dbraw/zinc/20/65/90/1431206590.db2.gz VNCZXYPTDNETJF-IEBWSBKVSA-N 2 1 385.552 3.217 20 0 GGADMP COc1ccc2c(c1)CCCN2C(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185689446 1431206594 /nfs/dbraw/zinc/20/65/94/1431206594.db2.gz VNCZXYPTDNETJF-IEBWSBKVSA-N 2 1 385.552 3.217 20 0 GGADMP C[C@@H]([NH2+]CCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185690987 1431207137 /nfs/dbraw/zinc/20/71/37/1431207137.db2.gz SLXIXBUFNKTDGH-QZTJIDSGSA-N 2 1 383.536 3.305 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCCOC1CCCCC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185695319 1431208111 /nfs/dbraw/zinc/20/81/11/1431208111.db2.gz UYAYURCVIZQZCA-RBUKOAKNSA-N 2 1 379.589 3.085 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCCOC1CCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185695319 1431208114 /nfs/dbraw/zinc/20/81/14/1431208114.db2.gz UYAYURCVIZQZCA-RBUKOAKNSA-N 2 1 379.589 3.085 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185696081 1431208930 /nfs/dbraw/zinc/20/89/30/1431208930.db2.gz MXMZSVXMFFCYGU-ZBFHGGJFSA-N 2 1 386.508 3.426 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185696081 1431208934 /nfs/dbraw/zinc/20/89/34/1431208934.db2.gz MXMZSVXMFFCYGU-ZBFHGGJFSA-N 2 1 386.508 3.426 20 0 GGADMP Cc1cccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1C ZINC000185698127 1431209212 /nfs/dbraw/zinc/20/92/12/1431209212.db2.gz ZHMJLOIBXNVLGS-ZWKOTPCHSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1cccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1C ZINC000185698127 1431209216 /nfs/dbraw/zinc/20/92/16/1431209216.db2.gz ZHMJLOIBXNVLGS-ZWKOTPCHSA-N 2 1 386.540 3.194 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(OC)c1 ZINC000185706735 1431211612 /nfs/dbraw/zinc/21/16/12/1431211612.db2.gz CKGVPOGCQACFQM-YESZJQIVSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(OC)c1 ZINC000185706735 1431211620 /nfs/dbraw/zinc/21/16/20/1431211620.db2.gz CKGVPOGCQACFQM-YESZJQIVSA-N 2 1 389.540 3.273 20 0 GGADMP CCOc1ccc(OC[C@H](O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185717566 1431214452 /nfs/dbraw/zinc/21/44/52/1431214452.db2.gz LNUBQHIOKIPYPD-QWFCFKBJSA-N 2 1 376.541 3.068 20 0 GGADMP CCOc1ccc(OC[C@@H](O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185717553 1431214514 /nfs/dbraw/zinc/21/45/14/1431214514.db2.gz LNUBQHIOKIPYPD-NSHGMRRFSA-N 2 1 376.541 3.068 20 0 GGADMP CCOc1ccc(OC[C@@H](O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185717584 1431214671 /nfs/dbraw/zinc/21/46/71/1431214671.db2.gz LNUBQHIOKIPYPD-GGPKGHCWSA-N 2 1 376.541 3.068 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N1CCc2sccc2C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185723772 1431215912 /nfs/dbraw/zinc/21/59/12/1431215912.db2.gz WYRMHYTZINPXLZ-IKGGRYGDSA-N 2 1 375.582 3.264 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N1CCc2sccc2C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185723772 1431215916 /nfs/dbraw/zinc/21/59/16/1431215916.db2.gz WYRMHYTZINPXLZ-IKGGRYGDSA-N 2 1 375.582 3.264 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(OC(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185740976 1431220373 /nfs/dbraw/zinc/22/03/73/1431220373.db2.gz UHOCLLFACFPBLO-GJZGRUSLSA-N 2 1 381.467 3.469 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(OC(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185740976 1431220377 /nfs/dbraw/zinc/22/03/77/1431220377.db2.gz UHOCLLFACFPBLO-GJZGRUSLSA-N 2 1 381.467 3.469 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000185741901 1431220447 /nfs/dbraw/zinc/22/04/47/1431220447.db2.gz MIINHHASKUSBMM-IXDOHACOSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1OC ZINC000185741901 1431220458 /nfs/dbraw/zinc/22/04/58/1431220458.db2.gz MIINHHASKUSBMM-IXDOHACOSA-N 2 1 389.540 3.273 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(OC(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185740994 1431220670 /nfs/dbraw/zinc/22/06/70/1431220670.db2.gz UHOCLLFACFPBLO-CABCVRRESA-N 2 1 381.467 3.469 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(OC(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185740994 1431220675 /nfs/dbraw/zinc/22/06/75/1431220675.db2.gz UHOCLLFACFPBLO-CABCVRRESA-N 2 1 381.467 3.469 20 0 GGADMP Cc1ccc(S(=O)(=O)CCC[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185744018 1431221824 /nfs/dbraw/zinc/22/18/24/1431221824.db2.gz QOVSAFGHCMIUGO-OALUTQOASA-N 2 1 378.582 3.401 20 0 GGADMP Cc1ccc(S(=O)(=O)CCC[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185744018 1431221827 /nfs/dbraw/zinc/22/18/27/1431221827.db2.gz QOVSAFGHCMIUGO-OALUTQOASA-N 2 1 378.582 3.401 20 0 GGADMP COc1ccc(CN(C(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)C2CC2)cc1 ZINC000185745594 1431222019 /nfs/dbraw/zinc/22/20/19/1431222019.db2.gz ALLDBANTJVAVIS-ICSRJNTNSA-N 2 1 399.579 3.429 20 0 GGADMP COc1ccc(CN(C(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C2CC2)cc1 ZINC000185745594 1431222032 /nfs/dbraw/zinc/22/20/32/1431222032.db2.gz ALLDBANTJVAVIS-ICSRJNTNSA-N 2 1 399.579 3.429 20 0 GGADMP C[C@@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1=O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185751235 1431223736 /nfs/dbraw/zinc/22/37/36/1431223736.db2.gz AKTBESUJJIIVGS-SPYBWZPUSA-N 2 1 377.479 3.313 20 0 GGADMP C[C@@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1=O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185751235 1431223742 /nfs/dbraw/zinc/22/37/42/1431223742.db2.gz AKTBESUJJIIVGS-SPYBWZPUSA-N 2 1 377.479 3.313 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185752341 1431224611 /nfs/dbraw/zinc/22/46/11/1431224611.db2.gz CMQHFWFOCKSKKC-ZIAGYGMSSA-N 2 1 394.903 3.429 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185752341 1431224619 /nfs/dbraw/zinc/22/46/19/1431224619.db2.gz CMQHFWFOCKSKKC-ZIAGYGMSSA-N 2 1 394.903 3.429 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCOc1ccc(Cl)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185757647 1431226868 /nfs/dbraw/zinc/22/68/68/1431226868.db2.gz BNJXUZQNJGSUIA-DLBZAZTESA-N 2 1 393.959 3.078 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCOc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185757647 1431226872 /nfs/dbraw/zinc/22/68/72/1431226872.db2.gz BNJXUZQNJGSUIA-DLBZAZTESA-N 2 1 393.959 3.078 20 0 GGADMP CCCOc1cccc(CNC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185764768 1431228527 /nfs/dbraw/zinc/22/85/27/1431228527.db2.gz VDZPCBYUKSIHCT-ICSRJNTNSA-N 2 1 387.568 3.334 20 0 GGADMP CCCOc1cccc(CNC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185764768 1431228536 /nfs/dbraw/zinc/22/85/36/1431228536.db2.gz VDZPCBYUKSIHCT-ICSRJNTNSA-N 2 1 387.568 3.334 20 0 GGADMP Cc1ccc(NC(=O)[C@@H](c2ccccc2)[NH+](C)C)cc1NC(=O)CC[NH+](C)C ZINC000185849505 1431251392 /nfs/dbraw/zinc/25/13/92/1431251392.db2.gz GCQDPJJIRLTJLJ-OAQYLSRUSA-N 2 1 382.508 3.127 20 0 GGADMP C[C@H](C[NH+]1CCCCCC1)NC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186108525 1431332071 /nfs/dbraw/zinc/33/20/71/1431332071.db2.gz JPNAFTKIUYNLGJ-IRLDBZIGSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@H]1C[NH+](Cc2ccc(C(=O)NCC3(C[NH+](C)C)CCCC3)cc2)C[C@H](C)O1 ZINC000186181792 1431348003 /nfs/dbraw/zinc/34/80/03/1431348003.db2.gz NNFCXSOATJNGMM-OALUTQOASA-N 2 1 387.568 3.148 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)CC1 ZINC000186273753 1431368446 /nfs/dbraw/zinc/36/84/46/1431368446.db2.gz CZTFYGXGHOSMJR-QFIPXVFZSA-N 2 1 386.584 3.270 20 0 GGADMP CCO[C@H]1C[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C12CCOCC2 ZINC000186316273 1431380550 /nfs/dbraw/zinc/38/05/50/1431380550.db2.gz IASQMALAVNTNNE-VXKWHMMOSA-N 2 1 390.543 3.396 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC[N@@H+]1C ZINC000186467737 1431427161 /nfs/dbraw/zinc/42/71/61/1431427161.db2.gz YFCPKJZBCCPGGX-GOEBONIOSA-N 2 1 383.458 3.382 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC[N@H+]1C ZINC000186467737 1431427162 /nfs/dbraw/zinc/42/71/62/1431427162.db2.gz YFCPKJZBCCPGGX-GOEBONIOSA-N 2 1 383.458 3.382 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC[N@@H+]1C ZINC000186467719 1431427269 /nfs/dbraw/zinc/42/72/69/1431427269.db2.gz YFCPKJZBCCPGGX-GDBMZVCRSA-N 2 1 383.458 3.382 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC[N@H+]1C ZINC000186467719 1431427275 /nfs/dbraw/zinc/42/72/75/1431427275.db2.gz YFCPKJZBCCPGGX-GDBMZVCRSA-N 2 1 383.458 3.382 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC[N@@H+]1C ZINC000186467764 1431427305 /nfs/dbraw/zinc/42/73/05/1431427305.db2.gz YFCPKJZBCCPGGX-HOCLYGCPSA-N 2 1 383.458 3.382 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC[N@H+]1C ZINC000186467764 1431427311 /nfs/dbraw/zinc/42/73/11/1431427311.db2.gz YFCPKJZBCCPGGX-HOCLYGCPSA-N 2 1 383.458 3.382 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCSC2(CCOCC2)C1)C1CC[NH+](C)CC1 ZINC000186501645 1431438330 /nfs/dbraw/zinc/43/83/30/1431438330.db2.gz JELWCDYLTUVPRG-UHFFFAOYSA-N 2 1 389.609 3.315 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)C1CCS(=O)(=O)CC1 ZINC000187005664 1431587666 /nfs/dbraw/zinc/58/76/66/1431587666.db2.gz NQJMXZRYXZIVTN-ROUUACIJSA-N 2 1 378.582 3.364 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](N[C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@H](C)C1 ZINC000187012608 1431589422 /nfs/dbraw/zinc/58/94/22/1431589422.db2.gz WNXYUOILIWNNPG-SVFBPWRDSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@H](C)C1 ZINC000187012608 1431589424 /nfs/dbraw/zinc/58/94/24/1431589424.db2.gz WNXYUOILIWNNPG-SVFBPWRDSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@H](C)C1 ZINC000187012608 1431589426 /nfs/dbraw/zinc/58/94/26/1431589426.db2.gz WNXYUOILIWNNPG-SVFBPWRDSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)NCc2ccc(Cl)cc2)[C@H](C)C1 ZINC000187014185 1431590455 /nfs/dbraw/zinc/59/04/55/1431590455.db2.gz MMMZMEPGJQABJV-FUHIMQAGSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)NCc2ccc(Cl)cc2)[C@H](C)C1 ZINC000187014185 1431590457 /nfs/dbraw/zinc/59/04/57/1431590457.db2.gz MMMZMEPGJQABJV-FUHIMQAGSA-N 2 1 395.975 3.071 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)C1CCS(=O)(=O)CC1 ZINC000187017148 1431591478 /nfs/dbraw/zinc/59/14/78/1431591478.db2.gz XZACIBBJGLGZFD-OTWHNJEPSA-N 2 1 392.609 3.467 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+]Cc2cc(-c3ccncc3)ccc2OC)CC1 ZINC000187121888 1431621868 /nfs/dbraw/zinc/62/18/68/1431621868.db2.gz SWXKIZKGLBTLSC-UHFFFAOYSA-N 2 1 382.552 3.265 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccc4c(c3)CCC(=O)N4C)c2)CCO1 ZINC000187162081 1431635056 /nfs/dbraw/zinc/63/50/56/1431635056.db2.gz PGZGFWLOUAADSP-SFHVURJKSA-N 2 1 393.531 3.106 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccc4c(c3)CCC(=O)N4C)c2)CCO1 ZINC000187162081 1431635064 /nfs/dbraw/zinc/63/50/64/1431635064.db2.gz PGZGFWLOUAADSP-SFHVURJKSA-N 2 1 393.531 3.106 20 0 GGADMP Cc1cc(Br)cc([C@@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)c1O ZINC000187164515 1431635674 /nfs/dbraw/zinc/63/56/74/1431635674.db2.gz COVBMFSLZXWQIJ-OAHLLOKOSA-N 2 1 398.389 3.387 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CCS(=O)(=O)CC1 ZINC000187246029 1431664736 /nfs/dbraw/zinc/66/47/36/1431664736.db2.gz SRNYFSGASMKMOA-QGZVFWFLSA-N 2 1 390.549 3.215 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)[NH+](C)C)C[N@H+]1C1CC1 ZINC000187355694 1431707125 /nfs/dbraw/zinc/70/71/25/1431707125.db2.gz DLJUUKRZLHKFIN-QBIMZIAESA-N 2 1 398.473 3.233 20 0 GGADMP C[C@@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)C1(c2ccccc2)CCCC1 ZINC000187575696 1431771081 /nfs/dbraw/zinc/77/10/81/1431771081.db2.gz KDCRCADVZGCFCH-LJQANCHMSA-N 2 1 379.552 3.219 20 0 GGADMP COc1ccc2c(c1)[C@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)CCCS2 ZINC000187962253 1431831658 /nfs/dbraw/zinc/83/16/58/1431831658.db2.gz ZTDGKIMZNJIHNQ-HXUWFJFHSA-N 2 1 377.598 3.485 20 0 GGADMP CC[NH+](CC)Cc1ccc(NC(=O)[C@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC000188371623 1431878265 /nfs/dbraw/zinc/87/82/65/1431878265.db2.gz NLPALVNFDMBYNM-JOCHJYFZSA-N 2 1 381.520 3.368 20 0 GGADMP CC[NH+](CC)Cc1ccc(NC(=O)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC000188371623 1431878266 /nfs/dbraw/zinc/87/82/66/1431878266.db2.gz NLPALVNFDMBYNM-JOCHJYFZSA-N 2 1 381.520 3.368 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCC(=O)N3CCc4ccccc4C3)C2)CC1 ZINC000188985461 1432022397 /nfs/dbraw/zinc/02/23/97/1432022397.db2.gz LWASNBJTSLXKEC-NRFANRHFSA-N 2 1 383.580 3.405 20 0 GGADMP Cc1ccc(CN2CC[C@H]([NH2+]C3CC[NH+](CCc4ccccc4)CC3)C2=O)cc1 ZINC000189098762 1432044757 /nfs/dbraw/zinc/04/47/57/1432044757.db2.gz ZOFLVOVMIHSZEX-DEOSSOPVSA-N 2 1 391.559 3.393 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000189242496 1432070112 /nfs/dbraw/zinc/07/01/12/1432070112.db2.gz ZKDAPUQUIRIJCR-UHFFFAOYSA-N 2 1 380.492 3.169 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2ccc(SC)cc2)[C@H](C)C1 ZINC000189999725 1432301977 /nfs/dbraw/zinc/30/19/77/1432301977.db2.gz VCZXWKNVEMSBBS-FUHIMQAGSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)C(=O)Nc2ccc(SC)cc2)[C@H](C)C1 ZINC000189999725 1432301981 /nfs/dbraw/zinc/30/19/81/1432301981.db2.gz VCZXWKNVEMSBBS-FUHIMQAGSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(SC)cc2)[C@H](C)C1 ZINC000189999709 1432302033 /nfs/dbraw/zinc/30/20/33/1432302033.db2.gz VCZXWKNVEMSBBS-UWVAXJGDSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(SC)cc2)[C@H](C)C1 ZINC000189999709 1432302036 /nfs/dbraw/zinc/30/20/36/1432302036.db2.gz VCZXWKNVEMSBBS-UWVAXJGDSA-N 2 1 393.597 3.462 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2cccc(Cl)c2)[C@H](C)C1 ZINC000190000277 1432302607 /nfs/dbraw/zinc/30/26/07/1432302607.db2.gz ZVXWMIKCGNVJBV-VQIMIIECSA-N 2 1 381.948 3.395 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)c(C)c2)[C@H](C)C1 ZINC000190005046 1432303156 /nfs/dbraw/zinc/30/31/56/1432303156.db2.gz SLUGCQBBIILVJX-DYXWJJEUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2ccc(C)c(C)c2)[C@H](C)C1 ZINC000190005046 1432303162 /nfs/dbraw/zinc/30/31/62/1432303162.db2.gz SLUGCQBBIILVJX-DYXWJJEUSA-N 2 1 375.557 3.357 20 0 GGADMP CCOC(=O)C1CCC(O)(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)CC1 ZINC000190892207 1432521289 /nfs/dbraw/zinc/52/12/89/1432521289.db2.gz MJLODTVIBUGZMX-QRMBVLBGSA-N 2 1 380.573 3.057 20 0 GGADMP CCOC(=O)C1CCC(O)(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)CC1 ZINC000190892207 1432521296 /nfs/dbraw/zinc/52/12/96/1432521296.db2.gz MJLODTVIBUGZMX-QRMBVLBGSA-N 2 1 380.573 3.057 20 0 GGADMP CCOC(=O)C1CCC(O)(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)CC1 ZINC000190892207 1432521308 /nfs/dbraw/zinc/52/13/08/1432521308.db2.gz MJLODTVIBUGZMX-QRMBVLBGSA-N 2 1 380.573 3.057 20 0 GGADMP Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000190967920 1432539889 /nfs/dbraw/zinc/53/98/89/1432539889.db2.gz PCVOZEPLZACJMV-UHFFFAOYSA-N 2 1 378.875 3.431 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cn1 ZINC000191294965 1432623769 /nfs/dbraw/zinc/62/37/69/1432623769.db2.gz KTXBQVKYPGRWOQ-DENIHFKCSA-N 2 1 382.552 3.307 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cn1 ZINC000191294965 1432623787 /nfs/dbraw/zinc/62/37/87/1432623787.db2.gz KTXBQVKYPGRWOQ-DENIHFKCSA-N 2 1 382.552 3.307 20 0 GGADMP COc1ccc([C@H]2CCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)cc1OC ZINC000191391535 1432649872 /nfs/dbraw/zinc/64/98/72/1432649872.db2.gz IDWRGRURFWUEKW-HXUWFJFHSA-N 2 1 375.557 3.257 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000191395862 1432651687 /nfs/dbraw/zinc/65/16/87/1432651687.db2.gz WHWCZSWDTJCZTB-UHFFFAOYSA-N 2 1 393.019 3.264 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000191479141 1432668786 /nfs/dbraw/zinc/66/87/86/1432668786.db2.gz GIQVUOVROLYKNT-MRXNPFEDSA-N 2 1 388.512 3.202 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000191479141 1432668787 /nfs/dbraw/zinc/66/87/87/1432668787.db2.gz GIQVUOVROLYKNT-MRXNPFEDSA-N 2 1 388.512 3.202 20 0 GGADMP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000191580604 1432686892 /nfs/dbraw/zinc/68/68/92/1432686892.db2.gz XZBORHPUOMTZDH-MRXNPFEDSA-N 2 1 378.875 3.431 20 0 GGADMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000191580604 1432686895 /nfs/dbraw/zinc/68/68/95/1432686895.db2.gz XZBORHPUOMTZDH-MRXNPFEDSA-N 2 1 378.875 3.431 20 0 GGADMP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000191580623 1432687016 /nfs/dbraw/zinc/68/70/16/1432687016.db2.gz XZBORHPUOMTZDH-INIZCTEOSA-N 2 1 378.875 3.431 20 0 GGADMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000191580623 1432687019 /nfs/dbraw/zinc/68/70/19/1432687019.db2.gz XZBORHPUOMTZDH-INIZCTEOSA-N 2 1 378.875 3.431 20 0 GGADMP C[C@@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191601788 1432690022 /nfs/dbraw/zinc/69/00/22/1432690022.db2.gz KSYSQQXYCDYYPK-WMZHIEFXSA-N 2 1 392.547 3.040 20 0 GGADMP C[C@@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191601788 1432690025 /nfs/dbraw/zinc/69/00/25/1432690025.db2.gz KSYSQQXYCDYYPK-WMZHIEFXSA-N 2 1 392.547 3.040 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191601841 1432690116 /nfs/dbraw/zinc/69/01/16/1432690116.db2.gz KSYSQQXYCDYYPK-XXBNENTESA-N 2 1 392.547 3.040 20 0 GGADMP C[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191601841 1432690121 /nfs/dbraw/zinc/69/01/21/1432690121.db2.gz KSYSQQXYCDYYPK-XXBNENTESA-N 2 1 392.547 3.040 20 0 GGADMP CN(c1ccccc1C[N@@H+]1CCSC[C@H]1c1cnn(C)c1)C1CC[NH+](C)CC1 ZINC000191745251 1432716516 /nfs/dbraw/zinc/71/65/16/1432716516.db2.gz LSKHHVUKRHGVKV-QFIPXVFZSA-N 2 1 399.608 3.241 20 0 GGADMP CN(c1ccccc1C[N@H+]1CCSC[C@H]1c1cnn(C)c1)C1CC[NH+](C)CC1 ZINC000191745251 1432716518 /nfs/dbraw/zinc/71/65/18/1432716518.db2.gz LSKHHVUKRHGVKV-QFIPXVFZSA-N 2 1 399.608 3.241 20 0 GGADMP FC(F)(F)CC[NH+]1CCC(NC[C@H]2C[N@H+](Cc3ccccc3)CCCO2)CC1 ZINC000191838189 1432736782 /nfs/dbraw/zinc/73/67/82/1432736782.db2.gz ITPLOCGWZXXIKR-FQEVSTJZSA-N 2 1 399.501 3.284 20 0 GGADMP FC(F)(F)CC[NH+]1CCC(NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)CC1 ZINC000191838189 1432736786 /nfs/dbraw/zinc/73/67/86/1432736786.db2.gz ITPLOCGWZXXIKR-FQEVSTJZSA-N 2 1 399.501 3.284 20 0 GGADMP COc1cccc(C[N@@H+](CCCN2CC[NH+](C(C)C)CC2)C[C@@H]2CCCO2)c1 ZINC000192725575 1432880406 /nfs/dbraw/zinc/88/04/06/1432880406.db2.gz JJWJVILFSRHVBS-QHCPKHFHSA-N 2 1 389.584 3.092 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)CCCc2cc(-c3ccccc3)n[nH]2)CC1 ZINC000192729463 1432881054 /nfs/dbraw/zinc/88/10/54/1432881054.db2.gz VVWRZXSUZZMZFX-UHFFFAOYSA-N 2 1 383.584 3.357 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)CC1 ZINC000192759435 1432885837 /nfs/dbraw/zinc/88/58/37/1432885837.db2.gz OFDCTMKPMUBIKK-QFIPXVFZSA-N 3 1 378.649 3.379 20 0 GGADMP CC(C)[NH+]1CCN(CCCN2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000192760251 1432886149 /nfs/dbraw/zinc/88/61/49/1432886149.db2.gz YGUUTWRBJFBEJT-RPBOFIJWSA-N 2 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000192760251 1432886150 /nfs/dbraw/zinc/88/61/50/1432886150.db2.gz YGUUTWRBJFBEJT-RPBOFIJWSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000192760251 1432886151 /nfs/dbraw/zinc/88/61/51/1432886151.db2.gz YGUUTWRBJFBEJT-RPBOFIJWSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)CC1 ZINC000192760251 1432886152 /nfs/dbraw/zinc/88/61/52/1432886152.db2.gz YGUUTWRBJFBEJT-RPBOFIJWSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000192760251 1432886154 /nfs/dbraw/zinc/88/61/54/1432886154.db2.gz YGUUTWRBJFBEJT-RPBOFIJWSA-N 3 1 398.639 3.389 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)CC1 ZINC000192773244 1432888501 /nfs/dbraw/zinc/88/85/01/1432888501.db2.gz LSFVLWSROATTSI-UXHICEINSA-N 2 1 396.620 3.028 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)CC1 ZINC000192775131 1432888726 /nfs/dbraw/zinc/88/87/26/1432888726.db2.gz DVUUXOWOZICFRI-VXKWHMMOSA-N 2 1 377.548 3.130 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC000192783576 1432890321 /nfs/dbraw/zinc/89/03/21/1432890321.db2.gz CQMZMTUENNUKNM-UHFFFAOYSA-N 3 1 387.616 3.036 20 0 GGADMP CC[N@H+](CC(=O)N1CCC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1)C1CC1 ZINC000192830750 1432896260 /nfs/dbraw/zinc/89/62/60/1432896260.db2.gz RTMZXIXNQKWHJY-UHFFFAOYSA-N 2 1 383.458 3.224 20 0 GGADMP CC[N@@H+](CC(=O)N1CCC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1)C1CC1 ZINC000192830750 1432896263 /nfs/dbraw/zinc/89/62/63/1432896263.db2.gz RTMZXIXNQKWHJY-UHFFFAOYSA-N 2 1 383.458 3.224 20 0 GGADMP CC[NH+](CC(=O)N1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1)C1CC1 ZINC000192830750 1432896265 /nfs/dbraw/zinc/89/62/65/1432896265.db2.gz RTMZXIXNQKWHJY-UHFFFAOYSA-N 2 1 383.458 3.224 20 0 GGADMP CC[NH+](CC(=O)N1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2)CC1)C1CC1 ZINC000192830750 1432896266 /nfs/dbraw/zinc/89/62/66/1432896266.db2.gz RTMZXIXNQKWHJY-UHFFFAOYSA-N 2 1 383.458 3.224 20 0 GGADMP CCOC(=O)c1oc2c(c1C)[C@@H]([NH2+]C1CC[NH+](C[C@H]3CCOC3)CC1)CCC2 ZINC000192880839 1432902550 /nfs/dbraw/zinc/90/25/50/1432902550.db2.gz GQSYZMAAYKWHSD-AEFFLSMTSA-N 2 1 390.524 3.233 20 0 GGADMP COC(=O)[C@@H](C)Oc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192929966 1432909661 /nfs/dbraw/zinc/90/96/61/1432909661.db2.gz IFDITCBEDLHOOS-WIYYLYMNSA-N 2 1 382.504 3.239 20 0 GGADMP Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192932480 1432910043 /nfs/dbraw/zinc/91/00/43/1432910043.db2.gz ONIMBMZZTZTGCL-QGZVFWFLSA-N 2 1 396.457 3.281 20 0 GGADMP Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192932480 1432910044 /nfs/dbraw/zinc/91/00/44/1432910044.db2.gz ONIMBMZZTZTGCL-QGZVFWFLSA-N 2 1 396.457 3.281 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000192959267 1432913393 /nfs/dbraw/zinc/91/33/93/1432913393.db2.gz QVZACBIFDAEVLT-LPHOPBHVSA-N 2 1 386.565 3.097 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000192959276 1432913424 /nfs/dbraw/zinc/91/34/24/1432913424.db2.gz QVZACBIFDAEVLT-APWZRJJASA-N 2 1 386.565 3.097 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)[nH+]c1 ZINC000193175010 1432951120 /nfs/dbraw/zinc/95/11/20/1432951120.db2.gz JJRQFBYIAUIBHZ-KRWDZBQOSA-N 2 1 387.553 3.390 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+](C)CCOc2ccccc2)CC1 ZINC000193647985 1433033760 /nfs/dbraw/zinc/03/37/60/1433033760.db2.gz GGGQDQSGUGAKDT-UHFFFAOYSA-N 2 1 395.547 3.086 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](C)CCOc2ccccc2)CC1 ZINC000193647985 1433033763 /nfs/dbraw/zinc/03/37/63/1433033763.db2.gz GGGQDQSGUGAKDT-UHFFFAOYSA-N 2 1 395.547 3.086 20 0 GGADMP COC[C@@H]([NH2+]CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1ccc(Cl)cc1 ZINC000193684140 1433040049 /nfs/dbraw/zinc/04/00/49/1433040049.db2.gz BLCDASLPSLVXOA-WOJBJXKFSA-N 2 1 389.927 3.036 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000193719869 1433046888 /nfs/dbraw/zinc/04/68/88/1433046888.db2.gz PCMNNCSOIAXGII-VQTJNVASSA-N 2 1 386.584 3.113 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCC(C)CC1)[N@@H+]1CCc2sccc2C1 ZINC000193742039 1433050643 /nfs/dbraw/zinc/05/06/43/1433050643.db2.gz VRTROCJTCHAHHI-SFHVURJKSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@@H](CNC(=O)NCCCC[NH+]1CCC(C)CC1)[N@H+]1CCc2sccc2C1 ZINC000193742039 1433050645 /nfs/dbraw/zinc/05/06/45/1433050645.db2.gz VRTROCJTCHAHHI-SFHVURJKSA-N 2 1 392.613 3.306 20 0 GGADMP C[C@H](CNC(=O)NCCCC[N@@H+]1CCCC[C@H]1C)[NH+]1CCc2sccc2C1 ZINC000193757095 1433053523 /nfs/dbraw/zinc/05/35/23/1433053523.db2.gz YIQOGHQQLYXYLN-QZTJIDSGSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@H](CNC(=O)NCCCC[N@H+]1CCCC[C@H]1C)[NH+]1CCc2sccc2C1 ZINC000193757095 1433053524 /nfs/dbraw/zinc/05/35/24/1433053524.db2.gz YIQOGHQQLYXYLN-QZTJIDSGSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCCC[C@H]1C)[N@@H+]1CCc2sccc2C1 ZINC000193757095 1433053525 /nfs/dbraw/zinc/05/35/25/1433053525.db2.gz YIQOGHQQLYXYLN-QZTJIDSGSA-N 2 1 392.613 3.449 20 0 GGADMP C[C@H](CNC(=O)NCCCC[NH+]1CCCC[C@H]1C)[N@H+]1CCc2sccc2C1 ZINC000193757095 1433053526 /nfs/dbraw/zinc/05/35/26/1433053526.db2.gz YIQOGHQQLYXYLN-QZTJIDSGSA-N 2 1 392.613 3.449 20 0 GGADMP C[N@@H+](CCNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)Cc1ccccc1 ZINC000193857170 1433074069 /nfs/dbraw/zinc/07/40/69/1433074069.db2.gz ACLPOMGENWGIKU-UHFFFAOYSA-N 2 1 384.524 3.017 20 0 GGADMP C[N@@H+](CCNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)Cc1ccccc1 ZINC000193860587 1433074735 /nfs/dbraw/zinc/07/47/35/1433074735.db2.gz CTGAKRPKYROCPA-UHFFFAOYSA-N 2 1 394.563 3.125 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000193929704 1433086754 /nfs/dbraw/zinc/08/67/54/1433086754.db2.gz ZVJWHHCVGOHNSD-DENIHFKCSA-N 2 1 398.526 3.250 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000194020294 1433101828 /nfs/dbraw/zinc/10/18/28/1433101828.db2.gz KYOVNCGTXHYCII-QFIPXVFZSA-N 2 1 386.584 3.320 20 0 GGADMP COC[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(Cl)cc1 ZINC000194019441 1433101939 /nfs/dbraw/zinc/10/19/39/1433101939.db2.gz XCIMZGJXOBAEMD-HXUWFJFHSA-N 2 1 389.927 3.109 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000194020305 1433101957 /nfs/dbraw/zinc/10/19/57/1433101957.db2.gz KYOVNCGTXHYCII-JOCHJYFZSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000194020636 1433102222 /nfs/dbraw/zinc/10/22/22/1433102222.db2.gz LDBFMVQHRPPRIH-IRLDBZIGSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000194020636 1433102225 /nfs/dbraw/zinc/10/22/25/1433102225.db2.gz LDBFMVQHRPPRIH-IRLDBZIGSA-N 2 1 386.584 3.462 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194020636 1433102227 /nfs/dbraw/zinc/10/22/27/1433102227.db2.gz LDBFMVQHRPPRIH-IRLDBZIGSA-N 2 1 386.584 3.462 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)[nH+]c1 ZINC000194026715 1433103471 /nfs/dbraw/zinc/10/34/71/1433103471.db2.gz XORMRTNMHDCUHD-HXUWFJFHSA-N 2 1 381.524 3.013 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)[nH+]c1 ZINC000194026715 1433103473 /nfs/dbraw/zinc/10/34/73/1433103473.db2.gz XORMRTNMHDCUHD-HXUWFJFHSA-N 2 1 381.524 3.013 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)cc1F ZINC000194036949 1433105118 /nfs/dbraw/zinc/10/51/18/1433105118.db2.gz DYLIJFMMJOJHDD-UHFFFAOYSA-N 2 1 387.503 3.382 20 0 GGADMP C[C@H](NC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000194300419 1433157892 /nfs/dbraw/zinc/15/78/92/1433157892.db2.gz XTZYYOYXBKROAK-ILWGZMRPSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000194300419 1433157895 /nfs/dbraw/zinc/15/78/95/1433157895.db2.gz XTZYYOYXBKROAK-ILWGZMRPSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000194300419 1433157897 /nfs/dbraw/zinc/15/78/97/1433157897.db2.gz XTZYYOYXBKROAK-ILWGZMRPSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000194300447 1433158077 /nfs/dbraw/zinc/15/80/77/1433158077.db2.gz XTZYYOYXBKROAK-BVSLBCMMSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000194300447 1433158080 /nfs/dbraw/zinc/15/80/80/1433158080.db2.gz XTZYYOYXBKROAK-BVSLBCMMSA-N 2 1 398.595 3.461 20 0 GGADMP C[C@H](NC(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000194300447 1433158083 /nfs/dbraw/zinc/15/80/83/1433158083.db2.gz XTZYYOYXBKROAK-BVSLBCMMSA-N 2 1 398.595 3.461 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(Cl)c(OC)c1 ZINC000194402439 1433172522 /nfs/dbraw/zinc/17/25/22/1433172522.db2.gz FADAQOYFEVXQIJ-INIZCTEOSA-N 2 1 382.936 3.228 20 0 GGADMP C[N@@H+]1CCN(C(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)[C@@H](c2ccccc2)C1 ZINC000194449430 1433180089 /nfs/dbraw/zinc/18/00/89/1433180089.db2.gz SLGLNMRGRRYTCQ-JTHBVZDNSA-N 2 1 392.547 3.207 20 0 GGADMP C[N@H+]1CCN(C(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)[C@@H](c2ccccc2)C1 ZINC000194449430 1433180092 /nfs/dbraw/zinc/18/00/92/1433180092.db2.gz SLGLNMRGRRYTCQ-JTHBVZDNSA-N 2 1 392.547 3.207 20 0 GGADMP C[NH+]1CCN(C(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)[C@@H](c2ccccc2)C1 ZINC000194449430 1433180094 /nfs/dbraw/zinc/18/00/94/1433180094.db2.gz SLGLNMRGRRYTCQ-JTHBVZDNSA-N 2 1 392.547 3.207 20 0 GGADMP C[NH+]1CCN(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)[C@@H](c2ccccc2)C1 ZINC000194449430 1433180097 /nfs/dbraw/zinc/18/00/97/1433180097.db2.gz SLGLNMRGRRYTCQ-JTHBVZDNSA-N 2 1 392.547 3.207 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(CC[NH+](C)C)Cc2ccccc2F)[nH+]c1 ZINC000194475753 1433184303 /nfs/dbraw/zinc/18/43/03/1433184303.db2.gz FHSOSDBZQOJMMK-UHFFFAOYSA-N 2 1 387.503 3.105 20 0 GGADMP Cc1ccc(NCCCNC(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)[nH+]c1 ZINC000194475580 1433184336 /nfs/dbraw/zinc/18/43/36/1433184336.db2.gz ZLRNJIVTNULRDN-UHFFFAOYSA-N 2 1 399.514 3.295 20 0 GGADMP COc1ccc(C[NH+]2CCC(CNC(=O)[C@H](c3ccccc3)[NH+](C)C)CC2)cc1 ZINC000194582819 1433201589 /nfs/dbraw/zinc/20/15/89/1433201589.db2.gz BQZCIWMLWLOMML-QHCPKHFHSA-N 2 1 395.547 3.326 20 0 GGADMP O=C(N[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1)C1CC[NH+](C2CC2)CC1 ZINC000194609147 1433205003 /nfs/dbraw/zinc/20/50/03/1433205003.db2.gz GHCAOQMZXMDVDU-SFHVURJKSA-N 2 1 395.469 3.270 20 0 GGADMP O=C(N[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1)C1CC[NH+](C2CC2)CC1 ZINC000194609158 1433205046 /nfs/dbraw/zinc/20/50/46/1433205046.db2.gz GHCAOQMZXMDVDU-GOSISDBHSA-N 2 1 395.469 3.270 20 0 GGADMP C[NH+](C)CCn1ccc(NC(=O)c2cccc(C[N@@H+](C)Cc3ccccc3)c2)n1 ZINC000194677554 1433214383 /nfs/dbraw/zinc/21/43/83/1433214383.db2.gz MPOPQNMIHGWNAH-UHFFFAOYSA-N 2 1 391.519 3.329 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)C1CC[NH+](C2CC2)CC1 ZINC000194686031 1433215473 /nfs/dbraw/zinc/21/54/73/1433215473.db2.gz MQVVERXNYNWKSJ-UHFFFAOYSA-N 2 1 381.520 3.402 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)C1CC[NH+](C2CC2)CC1 ZINC000194686031 1433215475 /nfs/dbraw/zinc/21/54/75/1433215475.db2.gz MQVVERXNYNWKSJ-UHFFFAOYSA-N 2 1 381.520 3.402 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000194726670 1433220652 /nfs/dbraw/zinc/22/06/52/1433220652.db2.gz CEDBXOBYNJGQTA-HXUWFJFHSA-N 2 1 397.485 3.430 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000194900929 1433260686 /nfs/dbraw/zinc/26/06/86/1433260686.db2.gz PHZQMLSVEKDTGZ-GOSISDBHSA-N 2 1 375.561 3.125 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000194900929 1433260689 /nfs/dbraw/zinc/26/06/89/1433260689.db2.gz PHZQMLSVEKDTGZ-GOSISDBHSA-N 2 1 375.561 3.125 20 0 GGADMP CC(C)(C)[NH+]1CCC(NC(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000194925832 1433265793 /nfs/dbraw/zinc/26/57/93/1433265793.db2.gz PZQAFBRNOATMAH-SFHVURJKSA-N 2 1 375.532 3.417 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)C2CCN(c3ccc(C)c[nH+]3)CC2)c1 ZINC000194931124 1433267082 /nfs/dbraw/zinc/26/70/82/1433267082.db2.gz FNWBKOQUEQXLJJ-UHFFFAOYSA-N 2 1 380.536 3.375 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)C2CCN(c3ccc(C)c[nH+]3)CC2)c1 ZINC000194931124 1433267086 /nfs/dbraw/zinc/26/70/86/1433267086.db2.gz FNWBKOQUEQXLJJ-UHFFFAOYSA-N 2 1 380.536 3.375 20 0 GGADMP CC(C)[NH+]1CCN(c2ccc(C(=O)NC[C@H]3CCC[N@H+](C(C)C)C3)cc2)CC1 ZINC000194967637 1433274237 /nfs/dbraw/zinc/27/42/37/1433274237.db2.gz RWNGIAUBMOLKOF-HXUWFJFHSA-N 2 1 386.584 3.067 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000194982226 1433276155 /nfs/dbraw/zinc/27/61/55/1433276155.db2.gz OCRGBTHLSGILCQ-SFHVURJKSA-N 2 1 378.586 3.135 20 0 GGADMP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](c3ncc[nH]3)c3cccnc3)CC2)cc1 ZINC000195012124 1433280689 /nfs/dbraw/zinc/28/06/89/1433280689.db2.gz QJJDLJOTLALTRA-QFIPXVFZSA-N 2 1 391.519 3.405 20 0 GGADMP C[NH+](C)[C@H](C(=O)N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1ccccc1 ZINC000195315241 1433318340 /nfs/dbraw/zinc/31/83/40/1433318340.db2.gz UIYWTBRUXOZVEL-IRLDBZIGSA-N 2 1 393.531 3.394 20 0 GGADMP C[C@@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(OC2CCCC2)CC1 ZINC000195325492 1433319416 /nfs/dbraw/zinc/31/94/16/1433319416.db2.gz XIXROCWJGYVEPH-PZJWPPBQSA-N 2 1 399.579 3.189 20 0 GGADMP C[C@@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(OC2CCCC2)CC1 ZINC000195325492 1433319418 /nfs/dbraw/zinc/31/94/18/1433319418.db2.gz XIXROCWJGYVEPH-PZJWPPBQSA-N 2 1 399.579 3.189 20 0 GGADMP C[C@H](CNC(=O)c1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)[NH+]1CCC(C)CC1 ZINC000227847472 1433370623 /nfs/dbraw/zinc/37/06/23/1433370623.db2.gz QXWPHKLWCUZCEH-AABGKKOBSA-N 2 1 387.568 3.146 20 0 GGADMP CC[N@H+](C)[C@H](C(=O)Nc1cccc(C(=O)OC2CC[NH2+]CC2)c1)c1ccccc1 ZINC000236888601 1433382256 /nfs/dbraw/zinc/38/22/56/1433382256.db2.gz ORGMKUZUHZCZAX-NRFANRHFSA-N 2 1 395.503 3.227 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)Nc1cccc(C(=O)OC2CC[NH2+]CC2)c1)c1ccccc1 ZINC000236888601 1433382259 /nfs/dbraw/zinc/38/22/59/1433382259.db2.gz ORGMKUZUHZCZAX-NRFANRHFSA-N 2 1 395.503 3.227 20 0 GGADMP CC[C@H](CNC(=O)C1(c2ccccc2)CC[NH2+]CC1)[N@H+]1CCc2ccccc2C1 ZINC000236951337 1433383844 /nfs/dbraw/zinc/38/38/44/1433383844.db2.gz MXBWTFYDLMTEBM-HSZRJFAPSA-N 2 1 391.559 3.261 20 0 GGADMP CC[C@H](NC(=O)CC[C@H]([NH3+])c1ccccc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000236996524 1433385392 /nfs/dbraw/zinc/38/53/92/1433385392.db2.gz ZFWCFAUUCSRDCJ-VABKMULXSA-N 2 1 395.547 3.262 20 0 GGADMP CC[C@H](NC(=O)CC[C@H]([NH3+])c1ccccc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000236996524 1433385396 /nfs/dbraw/zinc/38/53/96/1433385396.db2.gz ZFWCFAUUCSRDCJ-VABKMULXSA-N 2 1 395.547 3.262 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C[C@@H](C)C3CC[NH2+]CC3)CC2)cs1 ZINC000237042621 1433386893 /nfs/dbraw/zinc/38/68/93/1433386893.db2.gz NVVAUBNAHDYVMJ-MRXNPFEDSA-N 2 1 392.613 3.060 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C[C@@H]([NH3+])c3ccccc3)CC2)cs1 ZINC000237042746 1433387066 /nfs/dbraw/zinc/38/70/66/1433387066.db2.gz HQVRZOVZELPHRY-LJQANCHMSA-N 2 1 386.565 3.124 20 0 GGADMP COCC[NH+]1CCC([NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1 ZINC000237126079 1433390008 /nfs/dbraw/zinc/39/00/08/1433390008.db2.gz MMVOGNIPOKYKMG-UHFFFAOYSA-N 2 1 382.430 3.092 20 0 GGADMP COc1cc(Br)c(C[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1OC ZINC000237187534 1433392006 /nfs/dbraw/zinc/39/20/06/1433392006.db2.gz JSXSLIIYULACMH-LBPRGKRZSA-N 2 1 382.302 3.397 20 0 GGADMP C[NH2+]CCCC(=O)Nc1ccccc1C[N@@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000237228481 1433393099 /nfs/dbraw/zinc/39/30/99/1433393099.db2.gz DQZDLAVKUPJYBT-UHFFFAOYSA-N 2 1 397.519 3.200 20 0 GGADMP C[NH2+]CCCC(=O)Nc1ccccc1C[N@H+]1CCc2cc(OC)c(OC)cc2C1 ZINC000237228481 1433393104 /nfs/dbraw/zinc/39/31/04/1433393104.db2.gz DQZDLAVKUPJYBT-UHFFFAOYSA-N 2 1 397.519 3.200 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)C1(c2ccccc2)CC[NH2+]CC1 ZINC000237232589 1433393278 /nfs/dbraw/zinc/39/32/78/1433393278.db2.gz UZWVDVFENKPMIP-QFIPXVFZSA-N 2 1 391.559 3.288 20 0 GGADMP COc1cccc([C@@H](C)[NH+]2CCN(C(=O)CC[C@@H]([NH3+])c3ccccc3)CC2)c1 ZINC000237280210 1433395919 /nfs/dbraw/zinc/39/59/19/1433395919.db2.gz RISITLALVAAVSR-XMSQKQJNSA-N 2 1 381.520 3.381 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000237308675 1433396489 /nfs/dbraw/zinc/39/64/89/1433396489.db2.gz FWGMRARCMSAPOZ-FQEVSTJZSA-N 2 1 383.561 3.001 20 0 GGADMP CSCC[C@H]([NH3+])C(=O)N1CC[N@@H+](Cc2ccccc2)C2(CCCCC2)C1 ZINC000237308813 1433396507 /nfs/dbraw/zinc/39/65/07/1433396507.db2.gz NWYDKKKKSOTOGQ-IBGZPJMESA-N 2 1 375.582 3.114 20 0 GGADMP C[C@@]1(C(=O)NC[C@@H](c2ccccc2)[N@@H+]2CCc3sccc3C2)CCC[NH2+]C1 ZINC000237377936 1433399754 /nfs/dbraw/zinc/39/97/54/1433399754.db2.gz VQOTXRZJRWXICU-SIKLNZKXSA-N 2 1 383.561 3.353 20 0 GGADMP C[C@@]1(C(=O)NC[C@@H](c2ccccc2)[N@H+]2CCc3sccc3C2)CCC[NH2+]C1 ZINC000237377936 1433399756 /nfs/dbraw/zinc/39/97/56/1433399756.db2.gz VQOTXRZJRWXICU-SIKLNZKXSA-N 2 1 383.561 3.353 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)C[C@H]([NH3+])c2ccccc2)C[C@@H](C)O1 ZINC000237409704 1433401559 /nfs/dbraw/zinc/40/15/59/1433401559.db2.gz XPGRIGATNADOIG-HMFYCAOWSA-N 2 1 381.520 3.002 20 0 GGADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)o1 ZINC000237468622 1433404788 /nfs/dbraw/zinc/40/47/88/1433404788.db2.gz PLKFTQKYSKPCIQ-OZOXKJRCSA-N 2 1 381.520 3.390 20 0 GGADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)o1 ZINC000237468622 1433404791 /nfs/dbraw/zinc/40/47/91/1433404791.db2.gz PLKFTQKYSKPCIQ-OZOXKJRCSA-N 2 1 381.520 3.390 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)C2(c3ccccc3)CC[NH2+]CC2)C[N@H+]1Cc1ccccc1 ZINC000237490669 1433405869 /nfs/dbraw/zinc/40/58/69/1433405869.db2.gz WIFKORJLFWQQCJ-KNQAVFIVSA-N 2 1 377.532 3.087 20 0 GGADMP C[C@H](CC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)[C@@H]1CCC[NH2+]C1 ZINC000237554509 1433409183 /nfs/dbraw/zinc/40/91/83/1433409183.db2.gz QEHREKMDBLNTAB-IEBWSBKVSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@H](CC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)[C@@H]1CCC[NH2+]C1 ZINC000237554509 1433409188 /nfs/dbraw/zinc/40/91/88/1433409188.db2.gz QEHREKMDBLNTAB-IEBWSBKVSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(N2CC[NH+](C)CC2)c(Cl)c1)[C@H]1CCC[NH2+]C1 ZINC000237556117 1433409498 /nfs/dbraw/zinc/40/94/98/1433409498.db2.gz SMBDCZCJZCKVGQ-CVEARBPZSA-N 2 1 378.948 3.056 20 0 GGADMP C[C@H](CC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[C@@H]1CCC[NH2+]C1 ZINC000237599524 1433411649 /nfs/dbraw/zinc/41/16/49/1433411649.db2.gz YOIGNGWBDAAUQX-NVXWUHKLSA-N 2 1 379.495 3.071 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)C[C@@H]([NH3+])c3ccccc3)cc2)C[C@H](C)O1 ZINC000237630736 1433413770 /nfs/dbraw/zinc/41/37/70/1433413770.db2.gz QZJRWWSFMINDJJ-KGVIQGDOSA-N 2 1 381.520 3.002 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)[C@@H]3Cc4ccccc4C[NH2+]3)cc2)C1 ZINC000237740867 1433420175 /nfs/dbraw/zinc/42/01/75/1433420175.db2.gz QGOTULVECYVZOH-MBSDFSHPSA-N 2 1 377.532 3.249 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C[NH2+]Cc3c[nH]nc3-c3cccnc3)cc2)C[C@H](C)O1 ZINC000237781096 1433423810 /nfs/dbraw/zinc/42/38/10/1433423810.db2.gz KXUCSMVEUBQIFE-HDICACEKSA-N 2 1 391.519 3.371 20 0 GGADMP Cc1ccc(COc2ccc(C[NH2+]CCC[N@H+]3CCC[C@@H](C(N)=O)C3)cc2)cc1 ZINC000237816491 1433425611 /nfs/dbraw/zinc/42/56/11/1433425611.db2.gz BHCXSGIPVWYTCQ-JOCHJYFZSA-N 2 1 395.547 3.251 20 0 GGADMP O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000237900151 1433433068 /nfs/dbraw/zinc/43/30/68/1433433068.db2.gz XCJAJXNMJPHXMX-QFIPXVFZSA-N 2 1 377.532 3.089 20 0 GGADMP O=C(NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1)[C@@H]1CC12CC[NH2+]CC2 ZINC000237976265 1433437901 /nfs/dbraw/zinc/43/79/01/1433437901.db2.gz MUZUGUIBEYFYOK-PMACEKPBSA-N 2 1 395.572 3.353 20 0 GGADMP O=C(NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1)[C@@H]1CC12CC[NH2+]CC2 ZINC000237976265 1433437906 /nfs/dbraw/zinc/43/79/06/1433437906.db2.gz MUZUGUIBEYFYOK-PMACEKPBSA-N 2 1 395.572 3.353 20 0 GGADMP [NH3+]Cc1ccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)cc1 ZINC000237985944 1433438330 /nfs/dbraw/zinc/43/83/30/1433438330.db2.gz NBISKXGUICJSID-GOSISDBHSA-N 2 1 377.410 3.168 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1(c2ccccc2)CC[NH2+]CC1 ZINC000238007056 1433439098 /nfs/dbraw/zinc/43/90/98/1433439098.db2.gz SBIKIZPTGDXBNN-LJQANCHMSA-N 2 1 397.588 3.398 20 0 GGADMP [NH3+][C@@H](CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000238008601 1433439262 /nfs/dbraw/zinc/43/92/62/1433439262.db2.gz OEKQPZIVZZAXLI-AZUAARDMSA-N 2 1 391.437 3.257 20 0 GGADMP [NH3+]Cc1nc(C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cs1 ZINC000238077434 1433442088 /nfs/dbraw/zinc/44/20/88/1433442088.db2.gz VIMSNSJLJDHERQ-UHFFFAOYSA-N 2 1 392.528 3.149 20 0 GGADMP NCc1nc(C(=O)N2CC[N@@H+](Cc3ccccc3)C3(CCCCC3)C2)cs1 ZINC000238077640 1433442132 /nfs/dbraw/zinc/44/21/32/1433442132.db2.gz PIOWZCBPBHEEEF-UHFFFAOYSA-N 2 1 384.549 3.263 20 0 GGADMP [NH3+]Cc1nc(C(=O)N2CC[N@H+](Cc3ccccc3)C3(CCCCC3)C2)cs1 ZINC000238077640 1433442135 /nfs/dbraw/zinc/44/21/35/1433442135.db2.gz PIOWZCBPBHEEEF-UHFFFAOYSA-N 2 1 384.549 3.263 20 0 GGADMP O=C(Nc1ccc(C[NH+]2CCN(Cc3ccccc3)CC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000238106954 1433443159 /nfs/dbraw/zinc/44/31/59/1433443159.db2.gz RRZGYXXQOUELFT-HSZRJFAPSA-N 2 1 392.547 3.085 20 0 GGADMP O=C(Nc1ccc(C[NH+]2CCN(Cc3ccccc3)CC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000238106792 1433443232 /nfs/dbraw/zinc/44/32/32/1433443232.db2.gz RRZGYXXQOUELFT-QHCPKHFHSA-N 2 1 392.547 3.085 20 0 GGADMP CCc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000245386246 1433456990 /nfs/dbraw/zinc/45/69/90/1433456990.db2.gz LORJHKODUVCHGQ-FHWLQOOXSA-N 2 1 387.568 3.397 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(C)[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000245440335 1433468163 /nfs/dbraw/zinc/46/81/63/1433468163.db2.gz ULKHVRXDCWFDSQ-YADHBBJMSA-N 2 1 386.584 3.413 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459817 1433472332 /nfs/dbraw/zinc/47/23/32/1433472332.db2.gz VMVGMAQIALBXEH-WOJBJXKFSA-N 2 1 384.520 3.492 20 0 GGADMP CC[N@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459817 1433472333 /nfs/dbraw/zinc/47/23/33/1433472333.db2.gz VMVGMAQIALBXEH-WOJBJXKFSA-N 2 1 384.520 3.492 20 0 GGADMP CC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459817 1433472334 /nfs/dbraw/zinc/47/23/34/1433472334.db2.gz VMVGMAQIALBXEH-WOJBJXKFSA-N 2 1 384.520 3.492 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459817 1433472335 /nfs/dbraw/zinc/47/23/35/1433472335.db2.gz VMVGMAQIALBXEH-WOJBJXKFSA-N 2 1 384.520 3.492 20 0 GGADMP CC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000245459817 1433472336 /nfs/dbraw/zinc/47/23/36/1433472336.db2.gz VMVGMAQIALBXEH-WOJBJXKFSA-N 2 1 384.520 3.492 20 0 GGADMP COc1cccc([C@H]2[C@@H](NC(=O)CCn3cc[nH+]c3C(C)C)CC[N@@H+]2C2CC2)c1 ZINC000245548195 1433483576 /nfs/dbraw/zinc/48/35/76/1433483576.db2.gz NHLRHASPOUHLII-UNMCSNQZSA-N 2 1 396.535 3.499 20 0 GGADMP COc1cccc([C@H]2[C@@H](NC(=O)CCn3cc[nH+]c3C(C)C)CC[N@H+]2C2CC2)c1 ZINC000245548195 1433483577 /nfs/dbraw/zinc/48/35/77/1433483577.db2.gz NHLRHASPOUHLII-UNMCSNQZSA-N 2 1 396.535 3.499 20 0 GGADMP COc1cccc([C@H]2[C@H](NC(=O)CCn3cc[nH+]c3C(C)C)CC[N@@H+]2C2CC2)c1 ZINC000245548193 1433483715 /nfs/dbraw/zinc/48/37/15/1433483715.db2.gz NHLRHASPOUHLII-IRLDBZIGSA-N 2 1 396.535 3.499 20 0 GGADMP COc1cccc([C@H]2[C@H](NC(=O)CCn3cc[nH+]c3C(C)C)CC[N@H+]2C2CC2)c1 ZINC000245548193 1433483718 /nfs/dbraw/zinc/48/37/18/1433483718.db2.gz NHLRHASPOUHLII-IRLDBZIGSA-N 2 1 396.535 3.499 20 0 GGADMP Cc1ccc(C[N@@H+]2CCCN(C(=O)CN(C)[C@H](C)c3ccccn3)CC2)cc1 ZINC000245548659 1433483796 /nfs/dbraw/zinc/48/37/96/1433483796.db2.gz YCPOHCCBWBRJSX-HXUWFJFHSA-N 2 1 380.536 3.117 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccccc2OCC(=O)N(C)C)C1 ZINC000245554435 1433484498 /nfs/dbraw/zinc/48/44/98/1433484498.db2.gz GWXGCLMCVPSOQE-UXHICEINSA-N 2 1 387.568 3.240 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CN[C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)C1 ZINC000245559804 1433484950 /nfs/dbraw/zinc/48/49/50/1433484950.db2.gz MIOXADDNIBJDKB-UIFIKXQLSA-N 2 1 379.976 3.422 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CN[C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)C1 ZINC000245559802 1433485108 /nfs/dbraw/zinc/48/51/08/1433485108.db2.gz MIOXADDNIBJDKB-JRGCBEDISA-N 2 1 379.976 3.422 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3F)C2=O)[C@@H](C)C1 ZINC000245572651 1433486838 /nfs/dbraw/zinc/48/68/38/1433486838.db2.gz COFVDUQPJGOAQC-IHPCNDPISA-N 2 1 391.531 3.048 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3F)C2=O)[C@@H](C)C1 ZINC000245572651 1433486840 /nfs/dbraw/zinc/48/68/40/1433486840.db2.gz COFVDUQPJGOAQC-IHPCNDPISA-N 2 1 391.531 3.048 20 0 GGADMP C[C@@H]1CC[N@H+]([C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C[C@H]1n1ccnc1 ZINC000245600636 1433489670 /nfs/dbraw/zinc/48/96/70/1433489670.db2.gz MIETWTNQLDUGIK-JEBQAFNWSA-N 2 1 376.863 3.364 20 0 GGADMP C[C@@H]1CCN([C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C[C@H]1n1ccnc1 ZINC000245600636 1433489671 /nfs/dbraw/zinc/48/96/71/1433489671.db2.gz MIETWTNQLDUGIK-JEBQAFNWSA-N 2 1 376.863 3.364 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN([C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)C1 ZINC000245610535 1433490706 /nfs/dbraw/zinc/49/07/06/1433490706.db2.gz JYXAQPOPZWCBBZ-HKUYNNGSSA-N 2 1 397.485 3.470 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)NCC[NH+]2CCCCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245645949 1433495091 /nfs/dbraw/zinc/49/50/91/1433495091.db2.gz BHRKNKINWGAQJT-VQIMIIECSA-N 2 1 396.938 3.257 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)NC[C@H]2CCC[N@@H+](C)C2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245653874 1433495799 /nfs/dbraw/zinc/49/57/99/1433495799.db2.gz CZIOBGYVZOSRPR-OGWOLHLISA-N 2 1 396.938 3.113 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[NH+]1C1CCOCC1 ZINC000245666823 1433497081 /nfs/dbraw/zinc/49/70/81/1433497081.db2.gz ASBJPQRNFCQCEB-FYYLOGMGSA-N 2 1 399.579 3.000 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[N@@H+]1C1CCOCC1 ZINC000245666823 1433497082 /nfs/dbraw/zinc/49/70/82/1433497082.db2.gz ASBJPQRNFCQCEB-FYYLOGMGSA-N 2 1 399.579 3.000 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[N@H+]1C1CCOCC1 ZINC000245666823 1433497084 /nfs/dbraw/zinc/49/70/84/1433497084.db2.gz ASBJPQRNFCQCEB-FYYLOGMGSA-N 2 1 399.579 3.000 20 0 GGADMP CC[C@H]1C[N@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)CC[C@H]1c1ccccc1 ZINC000245698699 1433502337 /nfs/dbraw/zinc/50/23/37/1433502337.db2.gz CRWUUVYUFZLMBL-RBBKRZOGSA-N 2 1 379.552 3.244 20 0 GGADMP CC[C@H]1C[N@@H+](Cc2cnc(N3CC[NH+](C)CC3)nc2)CC[C@H]1c1ccccc1 ZINC000245698699 1433502338 /nfs/dbraw/zinc/50/23/38/1433502338.db2.gz CRWUUVYUFZLMBL-RBBKRZOGSA-N 2 1 379.552 3.244 20 0 GGADMP CC[NH+](CCNC(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000245730102 1433507123 /nfs/dbraw/zinc/50/71/23/1433507123.db2.gz SUIXUSGZTPNIOH-KXBFYZLASA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+](CCNC(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1)C1CC1 ZINC000245730102 1433507126 /nfs/dbraw/zinc/50/71/26/1433507126.db2.gz SUIXUSGZTPNIOH-KXBFYZLASA-N 2 1 396.938 3.255 20 0 GGADMP COc1cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000245734028 1433507826 /nfs/dbraw/zinc/50/78/26/1433507826.db2.gz FLOJCGBZOHSDIV-AZUAARDMSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000245734028 1433507829 /nfs/dbraw/zinc/50/78/29/1433507829.db2.gz FLOJCGBZOHSDIV-AZUAARDMSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000245734028 1433507832 /nfs/dbraw/zinc/50/78/32/1433507832.db2.gz FLOJCGBZOHSDIV-AZUAARDMSA-N 2 1 384.520 3.459 20 0 GGADMP COc1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1OC(=O)C1CC1 ZINC000245734028 1433507835 /nfs/dbraw/zinc/50/78/35/1433507835.db2.gz FLOJCGBZOHSDIV-AZUAARDMSA-N 2 1 384.520 3.459 20 0 GGADMP CC(C)N(CC[NH+](C)C)C(=O)NC[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245733932 1433507918 /nfs/dbraw/zinc/50/79/18/1433507918.db2.gz UITJMLDYJFXBPJ-LPHOPBHVSA-N 2 1 398.954 3.454 20 0 GGADMP C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245813969 1433521294 /nfs/dbraw/zinc/52/12/94/1433521294.db2.gz CWWSIDVFPWZGII-HOTGVXAUSA-N 2 1 390.478 3.172 20 0 GGADMP C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245813969 1433521304 /nfs/dbraw/zinc/52/13/04/1433521304.db2.gz CWWSIDVFPWZGII-HOTGVXAUSA-N 2 1 390.478 3.172 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1)c1ccccc1 ZINC000245837210 1433524122 /nfs/dbraw/zinc/52/41/22/1433524122.db2.gz DKSMWZIZTGSMAE-GGAORHGYSA-N 2 1 379.548 3.360 20 0 GGADMP CC[NH+](C)[C@H](C(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000245837210 1433524128 /nfs/dbraw/zinc/52/41/28/1433524128.db2.gz DKSMWZIZTGSMAE-GGAORHGYSA-N 2 1 379.548 3.360 20 0 GGADMP CC[NH+](C)[C@H](C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000245837210 1433524133 /nfs/dbraw/zinc/52/41/33/1433524133.db2.gz DKSMWZIZTGSMAE-GGAORHGYSA-N 2 1 379.548 3.360 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1 ZINC000245852576 1433526556 /nfs/dbraw/zinc/52/65/56/1433526556.db2.gz MPKMAWNDAGSNQP-IFMALSPDSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCNC(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000245852576 1433526559 /nfs/dbraw/zinc/52/65/59/1433526559.db2.gz MPKMAWNDAGSNQP-IFMALSPDSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCNC(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000245852576 1433526562 /nfs/dbraw/zinc/52/65/62/1433526562.db2.gz MPKMAWNDAGSNQP-IFMALSPDSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000245919261 1433542519 /nfs/dbraw/zinc/54/25/19/1433542519.db2.gz XIBOPCWQLNCVRN-UYAOXDASSA-N 2 1 384.524 3.236 20 0 GGADMP CC[C@@H]1c2ccsc2CCN1C(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245928723 1433545634 /nfs/dbraw/zinc/54/56/34/1433545634.db2.gz ULOXINRZNPTJOD-FUHWJXTLSA-N 2 1 386.565 3.272 20 0 GGADMP CC[C@@H]1c2ccsc2CCN1C(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245928723 1433545638 /nfs/dbraw/zinc/54/56/38/1433545638.db2.gz ULOXINRZNPTJOD-FUHWJXTLSA-N 2 1 386.565 3.272 20 0 GGADMP COc1ccc(-c2noc([C@H](C)[N@H+]3CCC[C@@H](Cc4nccn4C)C3)n2)cc1 ZINC000245984944 1433553449 /nfs/dbraw/zinc/55/34/49/1433553449.db2.gz WCMPYUVFRGTTGA-HOTGVXAUSA-N 2 1 381.480 3.494 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21)c1ccsc1 ZINC000245998116 1433555933 /nfs/dbraw/zinc/55/59/33/1433555933.db2.gz RNKXBYHXUOCHRZ-QXAKKESOSA-N 2 1 378.586 3.257 20 0 GGADMP C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000246024643 1433558752 /nfs/dbraw/zinc/55/87/52/1433558752.db2.gz LSMPXYZXVDKJLW-BXWFABGCSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000246024643 1433558756 /nfs/dbraw/zinc/55/87/56/1433558756.db2.gz LSMPXYZXVDKJLW-BXWFABGCSA-N 2 1 387.474 3.395 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000246055072 1433562101 /nfs/dbraw/zinc/56/21/01/1433562101.db2.gz DYDJPPNXKZMVMM-QYZOEREBSA-N 2 1 388.556 3.322 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000246055072 1433562104 /nfs/dbraw/zinc/56/21/04/1433562104.db2.gz DYDJPPNXKZMVMM-QYZOEREBSA-N 2 1 388.556 3.322 20 0 GGADMP C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000246061627 1433562827 /nfs/dbraw/zinc/56/28/27/1433562827.db2.gz ZFMKMLBDZIHRQH-VXKWHMMOSA-N 2 1 384.568 3.298 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccccc1N(C)C ZINC000246093529 1433567647 /nfs/dbraw/zinc/56/76/47/1433567647.db2.gz IUSGZDIQJOFJTQ-GHTZIAJQSA-N 2 1 394.563 3.301 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000246139991 1433573802 /nfs/dbraw/zinc/57/38/02/1433573802.db2.gz JLMMMDIDAMSHSJ-QZTJIDSGSA-N 2 1 378.586 3.401 20 0 GGADMP CC(C)N(C(=O)[C@@H](C)[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000246149908 1433574867 /nfs/dbraw/zinc/57/48/67/1433574867.db2.gz HMTNZGJQWMOWAF-HSALFYBXSA-N 2 1 381.605 3.232 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@H]1CCSc2ccccc21 ZINC000246177417 1433578252 /nfs/dbraw/zinc/57/82/52/1433578252.db2.gz LQCITPQNKPRXIP-MJGOQNOKSA-N 2 1 390.597 3.281 20 0 GGADMP O=C(NCCC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)C(F)(F)F ZINC000246211489 1433582273 /nfs/dbraw/zinc/58/22/73/1433582273.db2.gz YSSZNDGMILAXEO-QZTJIDSGSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(NCCC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1)C(F)(F)F ZINC000246211489 1433582276 /nfs/dbraw/zinc/58/22/76/1433582276.db2.gz YSSZNDGMILAXEO-QZTJIDSGSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(NCCC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1)C(F)(F)F ZINC000246211489 1433582278 /nfs/dbraw/zinc/58/22/78/1433582278.db2.gz YSSZNDGMILAXEO-QZTJIDSGSA-N 2 1 383.458 3.042 20 0 GGADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246219997 1433583482 /nfs/dbraw/zinc/58/34/82/1433583482.db2.gz BGCCFBFQQHCBSA-XQPJFTJZSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[NH+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246219997 1433583485 /nfs/dbraw/zinc/58/34/85/1433583485.db2.gz BGCCFBFQQHCBSA-XQPJFTJZSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H](C[NH+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246219997 1433583487 /nfs/dbraw/zinc/58/34/87/1433583487.db2.gz BGCCFBFQQHCBSA-XQPJFTJZSA-N 2 1 376.589 3.011 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246226245 1433584071 /nfs/dbraw/zinc/58/40/71/1433584071.db2.gz BUJFUTWKIZUDRR-DYXWJJEUSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246226245 1433584072 /nfs/dbraw/zinc/58/40/72/1433584072.db2.gz BUJFUTWKIZUDRR-DYXWJJEUSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246226245 1433584073 /nfs/dbraw/zinc/58/40/73/1433584073.db2.gz BUJFUTWKIZUDRR-DYXWJJEUSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[NH+]1CCSCC1 ZINC000246260094 1433587216 /nfs/dbraw/zinc/58/72/16/1433587216.db2.gz KZDLQQJVUJJFIB-MSOLQXFVSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)[NH+]1CCSCC1 ZINC000246260094 1433587218 /nfs/dbraw/zinc/58/72/18/1433587218.db2.gz KZDLQQJVUJJFIB-MSOLQXFVSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[NH+]1CCSCC1 ZINC000246260115 1433587282 /nfs/dbraw/zinc/58/72/82/1433587282.db2.gz KZDLQQJVUJJFIB-ROUUACIJSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@@H](C(=O)NCc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)[NH+]1CCSCC1 ZINC000246260115 1433587284 /nfs/dbraw/zinc/58/72/84/1433587284.db2.gz KZDLQQJVUJJFIB-ROUUACIJSA-N 2 1 375.582 3.115 20 0 GGADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000246273464 1433588342 /nfs/dbraw/zinc/58/83/42/1433588342.db2.gz BFLDKNWQXIRDIL-OALUTQOASA-N 2 1 383.536 3.259 20 0 GGADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000246273464 1433588344 /nfs/dbraw/zinc/58/83/44/1433588344.db2.gz BFLDKNWQXIRDIL-OALUTQOASA-N 2 1 383.536 3.259 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000246273464 1433588346 /nfs/dbraw/zinc/58/83/46/1433588346.db2.gz BFLDKNWQXIRDIL-OALUTQOASA-N 2 1 383.536 3.259 20 0 GGADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCN2C(=O)c3ccccc3C2=O)C1 ZINC000246273464 1433588348 /nfs/dbraw/zinc/58/83/48/1433588348.db2.gz BFLDKNWQXIRDIL-OALUTQOASA-N 2 1 383.536 3.259 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000246276188 1433588723 /nfs/dbraw/zinc/58/87/23/1433588723.db2.gz HMIUKQKHZJSVJE-YLJYHZDGSA-N 2 1 378.536 3.096 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000246276168 1433588775 /nfs/dbraw/zinc/58/87/75/1433588775.db2.gz HMIUKQKHZJSVJE-FXAWDEMLSA-N 2 1 378.536 3.096 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246287827 1433589924 /nfs/dbraw/zinc/58/99/24/1433589924.db2.gz IGKFRACJKLMUDI-WSTZPKSXSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246287827 1433589925 /nfs/dbraw/zinc/58/99/25/1433589925.db2.gz IGKFRACJKLMUDI-WSTZPKSXSA-N 2 1 376.589 3.155 20 0 GGADMP C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246287827 1433589926 /nfs/dbraw/zinc/58/99/26/1433589926.db2.gz IGKFRACJKLMUDI-WSTZPKSXSA-N 2 1 376.589 3.155 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000246289133 1433590229 /nfs/dbraw/zinc/59/02/29/1433590229.db2.gz CGGQWZUJKJJIFU-UXHICEINSA-N 2 1 375.532 3.132 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)[C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)C1 ZINC000246289133 1433590232 /nfs/dbraw/zinc/59/02/32/1433590232.db2.gz CGGQWZUJKJJIFU-UXHICEINSA-N 2 1 375.532 3.132 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)[NH+](C)Cc1ccccc1 ZINC000246313190 1433593598 /nfs/dbraw/zinc/59/35/98/1433593598.db2.gz JZILQKCZPBNQQW-CBQOVEMMSA-N 2 1 384.568 3.165 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000246321043 1433594713 /nfs/dbraw/zinc/59/47/13/1433594713.db2.gz FKSJXDWPRNUAJX-MPJJRAAHSA-N 2 1 398.595 3.411 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cnn(Cc2ccccc2)c1 ZINC000246324850 1433595321 /nfs/dbraw/zinc/59/53/21/1433595321.db2.gz FQULUJVGVVFZEL-OFAXGOBFSA-N 2 1 382.552 3.350 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1cccs1 ZINC000246344817 1433598065 /nfs/dbraw/zinc/59/80/65/1433598065.db2.gz LUCGJBZNCKTONF-FGTMMUONSA-N 2 1 393.597 3.137 20 0 GGADMP C[C@@H](NC(=O)C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1cccs1 ZINC000246344817 1433598069 /nfs/dbraw/zinc/59/80/69/1433598069.db2.gz LUCGJBZNCKTONF-FGTMMUONSA-N 2 1 393.597 3.137 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cccc(N2CCCC2=O)c1 ZINC000246344857 1433598265 /nfs/dbraw/zinc/59/82/65/1433598265.db2.gz HCAYCTBMQMIFRV-BULFRSBZSA-N 2 1 385.552 3.232 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N(C)CC1CC[NH+](C)CC1 ZINC000246356070 1433599871 /nfs/dbraw/zinc/59/98/71/1433599871.db2.gz JRHKGHARORNZCH-NGRWLJPCSA-N 2 1 386.584 3.126 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCCN2Cc2ccc(F)cc2)C1 ZINC000246361892 1433600489 /nfs/dbraw/zinc/60/04/89/1433600489.db2.gz GPVHNDOTBKGLPF-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000246361892 1433600491 /nfs/dbraw/zinc/60/04/91/1433600491.db2.gz GPVHNDOTBKGLPF-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000246361892 1433600494 /nfs/dbraw/zinc/60/04/94/1433600494.db2.gz GPVHNDOTBKGLPF-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000246361892 1433600500 /nfs/dbraw/zinc/60/05/00/1433600500.db2.gz GPVHNDOTBKGLPF-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)[C@H]2CCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000246361892 1433600503 /nfs/dbraw/zinc/60/05/03/1433600503.db2.gz GPVHNDOTBKGLPF-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2CC[C@@H](C1)[NH+]2C ZINC000246373374 1433602506 /nfs/dbraw/zinc/60/25/06/1433602506.db2.gz MADGUSWQJMOWCA-UXJHKWJQSA-N 2 1 384.568 3.021 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000246373374 1433602509 /nfs/dbraw/zinc/60/25/09/1433602509.db2.gz MADGUSWQJMOWCA-UXJHKWJQSA-N 2 1 384.568 3.021 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000246373374 1433602513 /nfs/dbraw/zinc/60/25/13/1433602513.db2.gz MADGUSWQJMOWCA-UXJHKWJQSA-N 2 1 384.568 3.021 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000246376183 1433603048 /nfs/dbraw/zinc/60/30/48/1433603048.db2.gz HBFIYVRBGDEPPN-GOTSBHOMSA-N 2 1 398.595 3.211 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H]1CC[NH+](C2CC2)C1 ZINC000246389176 1433605441 /nfs/dbraw/zinc/60/54/41/1433605441.db2.gz QYSWTEDGNFFEOF-NHCUHLMSSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000246389176 1433605444 /nfs/dbraw/zinc/60/54/44/1433605444.db2.gz QYSWTEDGNFFEOF-NHCUHLMSSA-N 2 1 384.568 3.024 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000246389176 1433605448 /nfs/dbraw/zinc/60/54/48/1433605448.db2.gz QYSWTEDGNFFEOF-NHCUHLMSSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246400242 1433607488 /nfs/dbraw/zinc/60/74/88/1433607488.db2.gz PXXJQCUFDSKHGW-DYXWJJEUSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246400242 1433607494 /nfs/dbraw/zinc/60/74/94/1433607494.db2.gz PXXJQCUFDSKHGW-DYXWJJEUSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246400242 1433607499 /nfs/dbraw/zinc/60/74/99/1433607499.db2.gz PXXJQCUFDSKHGW-DYXWJJEUSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246408714 1433608387 /nfs/dbraw/zinc/60/83/87/1433608387.db2.gz BKNKEWBIGMYYQJ-LDBYXDLTSA-N 2 1 391.506 3.433 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[N@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc12 ZINC000246444777 1433614194 /nfs/dbraw/zinc/61/41/94/1433614194.db2.gz DNBJFBSHIYPIHG-LAUBAEHRSA-N 2 1 382.504 3.429 20 0 GGADMP Cc1cc(=O)oc2cc(OCC[NH+]3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)ccc12 ZINC000246444777 1433614195 /nfs/dbraw/zinc/61/41/95/1433614195.db2.gz DNBJFBSHIYPIHG-LAUBAEHRSA-N 2 1 382.504 3.429 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000246463975 1433616658 /nfs/dbraw/zinc/61/66/58/1433616658.db2.gz PLOXKBGGDZDHIP-RBBKRZOGSA-N 2 1 384.568 3.297 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000246463975 1433616660 /nfs/dbraw/zinc/61/66/60/1433616660.db2.gz PLOXKBGGDZDHIP-RBBKRZOGSA-N 2 1 384.568 3.297 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246463975 1433616663 /nfs/dbraw/zinc/61/66/63/1433616663.db2.gz PLOXKBGGDZDHIP-RBBKRZOGSA-N 2 1 384.568 3.297 20 0 GGADMP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1 ZINC000246471866 1433617539 /nfs/dbraw/zinc/61/75/39/1433617539.db2.gz QPBVDSQNBNTYHM-DCXXXQMHSA-N 2 1 375.557 3.361 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1 ZINC000246477164 1433618711 /nfs/dbraw/zinc/61/87/11/1433618711.db2.gz VPFOMMNBJJHABK-YADHBBJMSA-N 2 1 386.584 3.067 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000246477164 1433618714 /nfs/dbraw/zinc/61/87/14/1433618714.db2.gz VPFOMMNBJJHABK-YADHBBJMSA-N 2 1 386.584 3.067 20 0 GGADMP CN(CC[C@@H]1CCCC[NH+]1C)C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000246477164 1433618717 /nfs/dbraw/zinc/61/87/17/1433618717.db2.gz VPFOMMNBJJHABK-YADHBBJMSA-N 2 1 386.584 3.067 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N2CC[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC000246486243 1433619885 /nfs/dbraw/zinc/61/98/85/1433619885.db2.gz VZTNWTUVLOXWIU-QIJUGHKUSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)C1 ZINC000246486243 1433619887 /nfs/dbraw/zinc/61/98/87/1433619887.db2.gz VZTNWTUVLOXWIU-QIJUGHKUSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000246486243 1433619891 /nfs/dbraw/zinc/61/98/91/1433619891.db2.gz VZTNWTUVLOXWIU-QIJUGHKUSA-N 2 1 384.568 3.297 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246492563 1433620611 /nfs/dbraw/zinc/62/06/11/1433620611.db2.gz HFLMDVDHIBWNOJ-UWJYYQICSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246492563 1433620615 /nfs/dbraw/zinc/62/06/15/1433620615.db2.gz HFLMDVDHIBWNOJ-UWJYYQICSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246492563 1433620622 /nfs/dbraw/zinc/62/06/22/1433620622.db2.gz HFLMDVDHIBWNOJ-UWJYYQICSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246492563 1433620627 /nfs/dbraw/zinc/62/06/27/1433620627.db2.gz HFLMDVDHIBWNOJ-UWJYYQICSA-N 2 1 381.520 3.012 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCCC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246492563 1433620629 /nfs/dbraw/zinc/62/06/29/1433620629.db2.gz HFLMDVDHIBWNOJ-UWJYYQICSA-N 2 1 381.520 3.012 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000246493747 1433621101 /nfs/dbraw/zinc/62/11/01/1433621101.db2.gz RNPIBOJEKKRZER-RBUKOAKNSA-N 2 1 388.556 3.179 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000246493747 1433621103 /nfs/dbraw/zinc/62/11/03/1433621103.db2.gz RNPIBOJEKKRZER-RBUKOAKNSA-N 2 1 388.556 3.179 20 0 GGADMP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000246509157 1433623048 /nfs/dbraw/zinc/62/30/48/1433623048.db2.gz SRPWMYCJLJZRGB-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000246509157 1433623051 /nfs/dbraw/zinc/62/30/51/1433623051.db2.gz SRPWMYCJLJZRGB-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000246509157 1433623053 /nfs/dbraw/zinc/62/30/53/1433623053.db2.gz SRPWMYCJLJZRGB-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000246509157 1433623055 /nfs/dbraw/zinc/62/30/55/1433623055.db2.gz SRPWMYCJLJZRGB-PZJWPPBQSA-N 2 1 375.532 3.274 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@H](c1ncccc1C)C(C)C ZINC000246514348 1433623807 /nfs/dbraw/zinc/62/38/07/1433623807.db2.gz XDMCQTQCQHUHLP-PMACEKPBSA-N 2 1 389.588 3.145 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000246529687 1433626285 /nfs/dbraw/zinc/62/62/85/1433626285.db2.gz WJJNPNLCOPUBJS-RTBURBONSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000246529687 1433626286 /nfs/dbraw/zinc/62/62/86/1433626286.db2.gz WJJNPNLCOPUBJS-RTBURBONSA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000246529687 1433626287 /nfs/dbraw/zinc/62/62/87/1433626287.db2.gz WJJNPNLCOPUBJS-RTBURBONSA-N 2 1 392.613 3.380 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246542573 1433628028 /nfs/dbraw/zinc/62/80/28/1433628028.db2.gz JYCPHTHWAFMFGY-BKXMBWNOSA-N 2 1 384.564 3.390 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246542573 1433628029 /nfs/dbraw/zinc/62/80/29/1433628029.db2.gz JYCPHTHWAFMFGY-BKXMBWNOSA-N 2 1 384.564 3.390 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246542573 1433628030 /nfs/dbraw/zinc/62/80/30/1433628030.db2.gz JYCPHTHWAFMFGY-BKXMBWNOSA-N 2 1 384.564 3.390 20 0 GGADMP CNc1cc(N2CCC[C@@H]2CNC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)ncn1 ZINC000246553505 1433630385 /nfs/dbraw/zinc/63/03/85/1433630385.db2.gz WRQKAZWPFNHKON-YSIASYRMSA-N 3 1 386.588 3.120 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2c(F)cccc2Cl)CCO1 ZINC000246557396 1433630956 /nfs/dbraw/zinc/63/09/56/1433630956.db2.gz LOSNKHCTFFLPBH-WOCWXWTJSA-N 2 1 395.950 3.457 20 0 GGADMP C[C@@H]1CN([C@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2c(F)cccc2Cl)CCO1 ZINC000246557396 1433630958 /nfs/dbraw/zinc/63/09/58/1433630958.db2.gz LOSNKHCTFFLPBH-WOCWXWTJSA-N 2 1 395.950 3.457 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(C(=O)NCc3ccc(C[NH+]4CCCCC4)cc3)CC[C@H]21 ZINC000246560103 1433631344 /nfs/dbraw/zinc/63/13/44/1433631344.db2.gz BJIDCKCODHBNPU-FCHUYYIVSA-N 2 1 384.568 3.298 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NCc3ccc(C[NH+]4CCCCC4)cc3)CC[C@H]21 ZINC000246560112 1433631496 /nfs/dbraw/zinc/63/14/96/1433631496.db2.gz BJIDCKCODHBNPU-FGZHOGPDSA-N 2 1 384.568 3.298 20 0 GGADMP C[C@H](CCc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000246574121 1433633667 /nfs/dbraw/zinc/63/36/67/1433633667.db2.gz MOFNDJJVNAJHTB-AUSIDOKSSA-N 2 1 379.548 3.495 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@H]1C[C@@H](C)[N@@H+](C2CC2)C1 ZINC000246578443 1433634091 /nfs/dbraw/zinc/63/40/91/1433634091.db2.gz WPKOZZNRQADKBL-NRSPTQNISA-N 2 1 384.568 3.165 20 0 GGADMP CCN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000246578443 1433634097 /nfs/dbraw/zinc/63/40/97/1433634097.db2.gz WPKOZZNRQADKBL-NRSPTQNISA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000246590291 1433635458 /nfs/dbraw/zinc/63/54/58/1433635458.db2.gz PNZCVJSWESVMFR-BAGYTPMASA-N 2 1 384.568 3.309 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC[C@H](c2ccco2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000246590068 1433635489 /nfs/dbraw/zinc/63/54/89/1433635489.db2.gz UYRGTACBESCWDI-MISYRCLQSA-N 2 1 384.524 3.235 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NC[C@H](c2ccco2)[NH+](C)C)CC[N@H+]1Cc1ccccc1 ZINC000246590068 1433635491 /nfs/dbraw/zinc/63/54/91/1433635491.db2.gz UYRGTACBESCWDI-MISYRCLQSA-N 2 1 384.524 3.235 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC[C@H](c2ccco2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000246590079 1433635810 /nfs/dbraw/zinc/63/58/10/1433635810.db2.gz UYRGTACBESCWDI-YZGWKJHDSA-N 2 1 384.524 3.235 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NC[C@H](c2ccco2)[NH+](C)C)CC[N@H+]1Cc1ccccc1 ZINC000246590079 1433635813 /nfs/dbraw/zinc/63/58/13/1433635813.db2.gz UYRGTACBESCWDI-YZGWKJHDSA-N 2 1 384.524 3.235 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CCC[C@@H]([NH+]4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000246613948 1433639341 /nfs/dbraw/zinc/63/93/41/1433639341.db2.gz COXUXSOREQIGTG-ZRCGQRJVSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CCC[C@@H]([NH+]4CCCC4)CC3)cc2)C[C@H](C)O1 ZINC000246613948 1433639342 /nfs/dbraw/zinc/63/93/42/1433639342.db2.gz COXUXSOREQIGTG-ZRCGQRJVSA-N 2 1 399.579 3.386 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246636649 1433643633 /nfs/dbraw/zinc/64/36/33/1433643633.db2.gz CHBNLKBFRFWMNK-YUVXSKOASA-N 2 1 386.584 3.174 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246636649 1433643636 /nfs/dbraw/zinc/64/36/36/1433643636.db2.gz CHBNLKBFRFWMNK-YUVXSKOASA-N 2 1 386.584 3.174 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246636649 1433643638 /nfs/dbraw/zinc/64/36/38/1433643638.db2.gz CHBNLKBFRFWMNK-YUVXSKOASA-N 2 1 386.584 3.174 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1[NH2+]CCc2ccccc21 ZINC000246707409 1433653230 /nfs/dbraw/zinc/65/32/30/1433653230.db2.gz WSBXJTPZILSLPT-NFBKMPQASA-N 2 1 377.532 3.244 20 0 GGADMP CC[C@H](NC(=O)[C@H](C)[C@@H]([NH3+])c1ccccc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246714077 1433654146 /nfs/dbraw/zinc/65/41/46/1433654146.db2.gz XCUDSJFZCZNITH-YJSIEXFISA-N 2 1 395.547 3.118 20 0 GGADMP CC[C@H](NC(=O)[C@H](C)[C@@H]([NH3+])c1ccccc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246714077 1433654151 /nfs/dbraw/zinc/65/41/51/1433654151.db2.gz XCUDSJFZCZNITH-YJSIEXFISA-N 2 1 395.547 3.118 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1cccs1 ZINC000246721075 1433655066 /nfs/dbraw/zinc/65/50/66/1433655066.db2.gz VCNPGDCADNWOPN-RYQLBKOJSA-N 2 1 376.570 3.009 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000246724187 1433655576 /nfs/dbraw/zinc/65/55/76/1433655576.db2.gz VKIZAQFZIFQHRJ-RBUKOAKNSA-N 2 1 376.545 3.084 20 0 GGADMP CC1CC[NH+](Cc2ccccc2CNC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)CC1 ZINC000246755812 1433660891 /nfs/dbraw/zinc/66/08/91/1433660891.db2.gz ZTVFPEXFNHJMDL-DENIHFKCSA-N 2 1 386.584 3.400 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccc(F)cc1 ZINC000246757449 1433661386 /nfs/dbraw/zinc/66/13/86/1433661386.db2.gz XWKUUIDGOHPDMG-DZFGPLHGSA-N 2 1 388.531 3.087 20 0 GGADMP Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)C1 ZINC000246766539 1433662536 /nfs/dbraw/zinc/66/25/36/1433662536.db2.gz PRLHEZIZJPKOSZ-NHCUHLMSSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@H](O)[C@@H]1CCC[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)C1 ZINC000246766539 1433662537 /nfs/dbraw/zinc/66/25/37/1433662537.db2.gz PRLHEZIZJPKOSZ-NHCUHLMSSA-N 2 1 384.568 3.324 20 0 GGADMP Cn1ccnc1[C@H](O)[C@@H]1CCC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC000246766539 1433662538 /nfs/dbraw/zinc/66/25/38/1433662538.db2.gz PRLHEZIZJPKOSZ-NHCUHLMSSA-N 2 1 384.568 3.324 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)C1 ZINC000246778867 1433664763 /nfs/dbraw/zinc/66/47/63/1433664763.db2.gz ZFWBRQYGWPIVMV-OALUTQOASA-N 2 1 388.556 3.275 20 0 GGADMP CCC[N@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000246778867 1433664767 /nfs/dbraw/zinc/66/47/67/1433664767.db2.gz ZFWBRQYGWPIVMV-OALUTQOASA-N 2 1 388.556 3.275 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)C1 ZINC000246778867 1433664772 /nfs/dbraw/zinc/66/47/72/1433664772.db2.gz ZFWBRQYGWPIVMV-OALUTQOASA-N 2 1 388.556 3.275 20 0 GGADMP C[C@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000246783414 1433666271 /nfs/dbraw/zinc/66/62/71/1433666271.db2.gz BGWDQQGIQUBZKQ-VQTJNVASSA-N 2 1 386.584 3.413 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](N[C@H]2CCCN(c3ccc(C)cc3)C2=O)[C@@H](C)C1 ZINC000246823665 1433674298 /nfs/dbraw/zinc/67/42/98/1433674298.db2.gz ATERRRXOIBYULA-BVSLBCMMSA-N 2 1 387.568 3.217 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccc(C)cc3)C2=O)[C@@H](C)C1 ZINC000246823665 1433674304 /nfs/dbraw/zinc/67/43/04/1433674304.db2.gz ATERRRXOIBYULA-BVSLBCMMSA-N 2 1 387.568 3.217 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccc(C)cc3)C2=O)[C@@H](C)C1 ZINC000246823665 1433674310 /nfs/dbraw/zinc/67/43/10/1433674310.db2.gz ATERRRXOIBYULA-BVSLBCMMSA-N 2 1 387.568 3.217 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(OC)c1 ZINC000246859388 1433679154 /nfs/dbraw/zinc/67/91/54/1433679154.db2.gz BVZLFBFJNZHIIP-IAGOWNOFSA-N 2 1 377.529 3.131 20 0 GGADMP COc1ccc(NC(=O)C[C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(OC)c1 ZINC000246859411 1433679386 /nfs/dbraw/zinc/67/93/86/1433679386.db2.gz BVZLFBFJNZHIIP-SJORKVTESA-N 2 1 377.529 3.131 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000246900024 1433684484 /nfs/dbraw/zinc/68/44/84/1433684484.db2.gz CJKMGIZVIYLABE-UYAOXDASSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000246900024 1433684485 /nfs/dbraw/zinc/68/44/85/1433684485.db2.gz CJKMGIZVIYLABE-UYAOXDASSA-N 2 1 384.524 3.188 20 0 GGADMP COc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246928266 1433688314 /nfs/dbraw/zinc/68/83/14/1433688314.db2.gz SWCXDYAQNMSNHJ-RYLXDESZSA-N 2 1 385.552 3.210 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000247250157 1433696628 /nfs/dbraw/zinc/69/66/28/1433696628.db2.gz WCWMRTRTRGIDJR-VQIMIIECSA-N 2 1 378.948 3.118 20 0 GGADMP Cc1nccn1C[C@H](C)CNC(=O)N1CCC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000247265953 1433697943 /nfs/dbraw/zinc/69/79/43/1433697943.db2.gz RJVWKOJGPVAXST-RTBURBONSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000247265953 1433697944 /nfs/dbraw/zinc/69/79/44/1433697944.db2.gz RJVWKOJGPVAXST-RTBURBONSA-N 2 1 383.540 3.134 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C)C2)CC[N@H+]1Cc1ccccc1 ZINC000247329976 1433707704 /nfs/dbraw/zinc/70/77/04/1433707704.db2.gz WVKZTJXJFGKJTL-NMIHRBCNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)CC[NH+]1Cc1ccccc1 ZINC000247329976 1433707709 /nfs/dbraw/zinc/70/77/09/1433707709.db2.gz WVKZTJXJFGKJTL-NMIHRBCNSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)CC[NH+]1Cc1ccccc1 ZINC000247329976 1433707714 /nfs/dbraw/zinc/70/77/14/1433707714.db2.gz WVKZTJXJFGKJTL-NMIHRBCNSA-N 2 1 384.568 3.165 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(OC)c1 ZINC000247349801 1433711501 /nfs/dbraw/zinc/71/15/01/1433711501.db2.gz GPURWVWOJANTIQ-PQUYRQHNSA-N 2 1 388.552 3.276 20 0 GGADMP C/C=C/c1ccc(OC[C@H](O)C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(OC)c1 ZINC000247349801 1433711508 /nfs/dbraw/zinc/71/15/08/1433711508.db2.gz GPURWVWOJANTIQ-PQUYRQHNSA-N 2 1 388.552 3.276 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@H]1CCCC[NH+]1CC ZINC000247352606 1433711946 /nfs/dbraw/zinc/71/19/46/1433711946.db2.gz BGAHIBQDHQARIK-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@H]1CCCC[N@@H+]1CC ZINC000247352606 1433711953 /nfs/dbraw/zinc/71/19/53/1433711953.db2.gz BGAHIBQDHQARIK-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NC[C@H]1CCCC[N@H+]1CC ZINC000247352606 1433711961 /nfs/dbraw/zinc/71/19/61/1433711961.db2.gz BGAHIBQDHQARIK-FCHUYYIVSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000247374489 1433714615 /nfs/dbraw/zinc/71/46/15/1433714615.db2.gz SMJGFSLGEUNPIG-QZTJIDSGSA-N 2 1 381.586 3.242 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)NC2CC[NH+]([C@H](C)c3ccccc3)CC2)C1 ZINC000247376672 1433714678 /nfs/dbraw/zinc/71/46/78/1433714678.db2.gz PMXKPCBADFVZFO-WOJBJXKFSA-N 2 1 386.584 3.489 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCC[C@@H](C)C2)C1 ZINC000247403971 1433717446 /nfs/dbraw/zinc/71/74/46/1433717446.db2.gz XRZDMVAXRDFOIE-UXHICEINSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000247403971 1433717453 /nfs/dbraw/zinc/71/74/53/1433717453.db2.gz XRZDMVAXRDFOIE-UXHICEINSA-N 2 1 386.584 3.402 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000247403971 1433717458 /nfs/dbraw/zinc/71/74/58/1433717458.db2.gz XRZDMVAXRDFOIE-UXHICEINSA-N 2 1 386.584 3.402 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000247433102 1433721617 /nfs/dbraw/zinc/72/16/17/1433721617.db2.gz NVHYBNNPMVHHCI-MOJGAOKDSA-N 2 1 398.595 3.317 20 0 GGADMP O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247432192 1433721668 /nfs/dbraw/zinc/72/16/68/1433721668.db2.gz WOWMRZDZTQQHJO-FGZHOGPDSA-N 2 1 384.568 3.311 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+][C@H]3CCN(C(=O)OC(C)(C)C)C3)c2)CCO1 ZINC000247434577 1433721680 /nfs/dbraw/zinc/72/16/80/1433721680.db2.gz LKZHTWPUPMKKDJ-XLIONFOSSA-N 2 1 389.540 3.006 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+][C@H]3CCN(C(=O)OC(C)(C)C)C3)c2)CCO1 ZINC000247434577 1433721685 /nfs/dbraw/zinc/72/16/85/1433721685.db2.gz LKZHTWPUPMKKDJ-XLIONFOSSA-N 2 1 389.540 3.006 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N[C@H]2c3ccccc3CC[C@H]2n2ccnc2)C[N@H+]1C1CC1 ZINC000247535304 1433734557 /nfs/dbraw/zinc/73/45/57/1433734557.db2.gz POWDEXLQQLLEJA-UWGQAIRJSA-N 2 1 379.508 3.036 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000247568636 1433738161 /nfs/dbraw/zinc/73/81/61/1433738161.db2.gz SFIGFUFCYLLHAT-MXKPZRPRSA-N 2 1 398.551 3.338 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000247568636 1433738165 /nfs/dbraw/zinc/73/81/65/1433738165.db2.gz SFIGFUFCYLLHAT-MXKPZRPRSA-N 2 1 398.551 3.338 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000247568628 1433738186 /nfs/dbraw/zinc/73/81/86/1433738186.db2.gz SFIGFUFCYLLHAT-GXKRZCMTSA-N 2 1 398.551 3.338 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000247568628 1433738187 /nfs/dbraw/zinc/73/81/87/1433738187.db2.gz SFIGFUFCYLLHAT-GXKRZCMTSA-N 2 1 398.551 3.338 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000247621626 1433740663 /nfs/dbraw/zinc/74/06/63/1433740663.db2.gz TWNNQMKIXRTURE-GUDVDZBRSA-N 2 1 397.567 3.283 20 0 GGADMP C[C@@H](NCCC[N@H+]1CCCC[C@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000247890537 1433755465 /nfs/dbraw/zinc/75/54/65/1433755465.db2.gz FDYFWNYQFWHDKC-QZTJIDSGSA-N 2 1 379.570 3.142 20 0 GGADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000247890537 1433755466 /nfs/dbraw/zinc/75/54/66/1433755466.db2.gz FDYFWNYQFWHDKC-QZTJIDSGSA-N 2 1 379.570 3.142 20 0 GGADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000247890537 1433755467 /nfs/dbraw/zinc/75/54/67/1433755467.db2.gz FDYFWNYQFWHDKC-QZTJIDSGSA-N 2 1 379.570 3.142 20 0 GGADMP COc1ccccc1C[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000247937738 1433757602 /nfs/dbraw/zinc/75/76/02/1433757602.db2.gz CRXNRVSKESCNMP-PGRDOPGGSA-N 2 1 395.547 3.113 20 0 GGADMP Cc1ccccc1C[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000247956353 1433758674 /nfs/dbraw/zinc/75/86/74/1433758674.db2.gz FQOJYTPZADVCOU-AUSIDOKSSA-N 2 1 379.548 3.413 20 0 GGADMP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000247958290 1433759228 /nfs/dbraw/zinc/75/92/28/1433759228.db2.gz FWVLCBNMXSOIPA-OAOOKAIFSA-N 2 1 377.532 3.407 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCc4ccccc4C3)c2)C1 ZINC000247974826 1433760332 /nfs/dbraw/zinc/76/03/32/1433760332.db2.gz HSCVGEZPDFUTKZ-DHIUTWEWSA-N 2 1 377.532 3.031 20 0 GGADMP C[N@H+]1CCC[C@H]2CN(CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000248070116 1433767256 /nfs/dbraw/zinc/76/72/56/1433767256.db2.gz MNRQHQKEMLIPTP-AZUAARDMSA-N 2 1 375.532 3.369 20 0 GGADMP C[N@@H+]1CCC[C@H]2C[NH+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000248070116 1433767258 /nfs/dbraw/zinc/76/72/58/1433767258.db2.gz MNRQHQKEMLIPTP-AZUAARDMSA-N 2 1 375.532 3.369 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000248070116 1433767263 /nfs/dbraw/zinc/76/72/63/1433767263.db2.gz MNRQHQKEMLIPTP-AZUAARDMSA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000248070116 1433767267 /nfs/dbraw/zinc/76/72/67/1433767267.db2.gz MNRQHQKEMLIPTP-AZUAARDMSA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@H]21 ZINC000248070116 1433767271 /nfs/dbraw/zinc/76/72/71/1433767271.db2.gz MNRQHQKEMLIPTP-AZUAARDMSA-N 2 1 375.532 3.369 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248162691 1433776509 /nfs/dbraw/zinc/77/65/09/1433776509.db2.gz SKWLXUJTMAKPKK-DHIUTWEWSA-N 2 1 399.579 3.002 20 0 GGADMP O=C(CCCC[NH+]1CCOCC1)N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000248162691 1433776520 /nfs/dbraw/zinc/77/65/20/1433776520.db2.gz SKWLXUJTMAKPKK-DHIUTWEWSA-N 2 1 399.579 3.002 20 0 GGADMP OC[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000248181433 1433778699 /nfs/dbraw/zinc/77/86/99/1433778699.db2.gz WMVWPBFRPKLSOW-ZCYQVOJMSA-N 2 1 393.575 3.124 20 0 GGADMP OC[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000248181433 1433778705 /nfs/dbraw/zinc/77/87/05/1433778705.db2.gz WMVWPBFRPKLSOW-ZCYQVOJMSA-N 2 1 393.575 3.124 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCCOc4ccccc43)c2)C1 ZINC000248202879 1433780273 /nfs/dbraw/zinc/78/02/73/1433780273.db2.gz ZFZWHEXJTSKSBC-IRLDBZIGSA-N 2 1 393.531 3.387 20 0 GGADMP COc1cccc([C@@H]2CCC[N@@H+]2CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000248389786 1433792913 /nfs/dbraw/zinc/79/29/13/1433792913.db2.gz BHMPWTGJJBDBMF-VXKWHMMOSA-N 2 1 381.520 3.251 20 0 GGADMP COc1cccc([C@@H]2CCC[N@H+]2CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000248389786 1433792917 /nfs/dbraw/zinc/79/29/17/1433792917.db2.gz BHMPWTGJJBDBMF-VXKWHMMOSA-N 2 1 381.520 3.251 20 0 GGADMP NC(=O)c1cccc(CC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000248388862 1433793002 /nfs/dbraw/zinc/79/30/02/1433793002.db2.gz AGICXKDLKSHTFQ-YTFSRNRJSA-N 2 1 377.532 3.218 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248390617 1433793518 /nfs/dbraw/zinc/79/35/18/1433793518.db2.gz BKKJYRKKZQBYKF-LMVRJCEZSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248390617 1433793519 /nfs/dbraw/zinc/79/35/19/1433793519.db2.gz BKKJYRKKZQBYKF-LMVRJCEZSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248390617 1433793520 /nfs/dbraw/zinc/79/35/20/1433793520.db2.gz BKKJYRKKZQBYKF-LMVRJCEZSA-N 2 1 388.600 3.298 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000248393246 1433794771 /nfs/dbraw/zinc/79/47/71/1433794771.db2.gz DRYPZUBVQCTVNF-LNLFQRSKSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000248393246 1433794772 /nfs/dbraw/zinc/79/47/72/1433794772.db2.gz DRYPZUBVQCTVNF-LNLFQRSKSA-N 2 1 393.597 3.241 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@@H](O)COc1ccc(F)cc1 ZINC000248393200 1433794862 /nfs/dbraw/zinc/79/48/62/1433794862.db2.gz GKUUVJRIYJBCDW-JHBZICRXSA-N 2 1 386.511 3.312 20 0 GGADMP Cc1nc2c(s1)[C@H]([N@@H+](C)CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)CCC2 ZINC000248398320 1433796296 /nfs/dbraw/zinc/79/62/96/1433796296.db2.gz NFBBDXLDYFPIFX-RTBURBONSA-N 2 1 386.565 3.180 20 0 GGADMP Cc1nc2c(s1)[C@H]([N@H+](C)CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)CCC2 ZINC000248398320 1433796299 /nfs/dbraw/zinc/79/62/99/1433796299.db2.gz NFBBDXLDYFPIFX-RTBURBONSA-N 2 1 386.565 3.180 20 0 GGADMP CC(C)(C)S(=O)(=O)CC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248400196 1433797008 /nfs/dbraw/zinc/79/70/08/1433797008.db2.gz KQXKHXUEZVZUAB-XUVXKRRUSA-N 2 1 378.582 3.090 20 0 GGADMP CC(C)(C)S(=O)(=O)CC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248400196 1433797014 /nfs/dbraw/zinc/79/70/14/1433797014.db2.gz KQXKHXUEZVZUAB-XUVXKRRUSA-N 2 1 378.582 3.090 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)[NH+]1CCc2ccccc2C1 ZINC000248402323 1433797995 /nfs/dbraw/zinc/79/79/95/1433797995.db2.gz NCYSACUVMIKOTD-ZJOUEHCJSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000248402323 1433798002 /nfs/dbraw/zinc/79/80/02/1433798002.db2.gz NCYSACUVMIKOTD-ZJOUEHCJSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000248402323 1433798011 /nfs/dbraw/zinc/79/80/11/1433798011.db2.gz NCYSACUVMIKOTD-ZJOUEHCJSA-N 2 1 398.595 3.385 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000248402793 1433798897 /nfs/dbraw/zinc/79/88/97/1433798897.db2.gz NTQOREFCAJXEKV-BQFCYCMXSA-N 2 1 379.570 3.362 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)NCc1ccc(F)cc1 ZINC000248402719 1433798962 /nfs/dbraw/zinc/79/89/62/1433798962.db2.gz WCIYKPCDMCNKGL-CYGODWOOSA-N 2 1 383.511 3.188 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)NCc1ccc(F)cc1 ZINC000248402719 1433798963 /nfs/dbraw/zinc/79/89/63/1433798963.db2.gz WCIYKPCDMCNKGL-CYGODWOOSA-N 2 1 383.511 3.188 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)C1 ZINC000248408517 1433800167 /nfs/dbraw/zinc/80/01/67/1433800167.db2.gz VNZMGUVQIQXCQJ-WSTZPKSXSA-N 2 1 387.572 3.445 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000248408517 1433800168 /nfs/dbraw/zinc/80/01/68/1433800168.db2.gz VNZMGUVQIQXCQJ-WSTZPKSXSA-N 2 1 387.572 3.445 20 0 GGADMP O=C(NCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccccc1F ZINC000248409073 1433800207 /nfs/dbraw/zinc/80/02/07/1433800207.db2.gz WHOLOVCTEIMLEQ-XKCSPQBFSA-N 2 1 395.522 3.446 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248411115 1433800426 /nfs/dbraw/zinc/80/04/26/1433800426.db2.gz YTOCVRUREQPYNL-SCTDSRPQSA-N 2 1 393.597 3.241 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCC[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]21 ZINC000248411751 1433800568 /nfs/dbraw/zinc/80/05/68/1433800568.db2.gz ZPKLPHMAQHWWQW-NAVOZUGXSA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[NH+]1CCCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000248411751 1433800569 /nfs/dbraw/zinc/80/05/69/1433800569.db2.gz ZPKLPHMAQHWWQW-NAVOZUGXSA-N 3 1 385.596 3.114 20 0 GGADMP OC[C@@H]1CCC[NH+]1CCCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000248411751 1433800571 /nfs/dbraw/zinc/80/05/71/1433800571.db2.gz ZPKLPHMAQHWWQW-NAVOZUGXSA-N 3 1 385.596 3.114 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248411738 1433800593 /nfs/dbraw/zinc/80/05/93/1433800593.db2.gz ZOHDXCWBFUEBFA-NLWGTHIKSA-N 2 1 388.556 3.369 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000248435743 1433802331 /nfs/dbraw/zinc/80/23/31/1433802331.db2.gz AHLOPNYKQQTXBF-SJORKVTESA-N 2 1 386.458 3.395 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000248435743 1433802333 /nfs/dbraw/zinc/80/23/33/1433802333.db2.gz AHLOPNYKQQTXBF-SJORKVTESA-N 2 1 386.458 3.395 20 0 GGADMP CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)c1 ZINC000248439322 1433802845 /nfs/dbraw/zinc/80/28/45/1433802845.db2.gz ILJKVACNWLROTC-HXOBKFHXSA-N 2 1 381.520 3.453 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cnn(Cc2ccccc2)c1 ZINC000248449906 1433803643 /nfs/dbraw/zinc/80/36/43/1433803643.db2.gz OSWNKEGKTJVTGP-YADARESESA-N 2 1 390.531 3.349 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@H]1CCOc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248551356 1433807973 /nfs/dbraw/zinc/80/79/73/1433807973.db2.gz GQCLEYNUFOQIKX-WKRCXCSHSA-N 2 1 385.552 3.258 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@H]1CCOc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248551356 1433807974 /nfs/dbraw/zinc/80/79/74/1433807974.db2.gz GQCLEYNUFOQIKX-WKRCXCSHSA-N 2 1 385.552 3.258 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@H]1CCCc2sccc21 ZINC000248697709 1433815794 /nfs/dbraw/zinc/81/57/94/1433815794.db2.gz DWHPLMGEFJTLFD-WMZOPIPTSA-N 2 1 378.586 3.183 20 0 GGADMP C[C@@H]1C[C@@H](N[C@H](Cc2ccc(Cl)cc2)C(N)=O)CC[N@H+]1Cc1ccccc1 ZINC000248727709 1433818143 /nfs/dbraw/zinc/81/81/43/1433818143.db2.gz LKSDCMGEQHNVEI-TYCQWZJGSA-N 2 1 385.939 3.379 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+]1Cc1ccccc1 ZINC000248733728 1433818581 /nfs/dbraw/zinc/81/85/81/1433818581.db2.gz KHCMSUMYDUWTHC-DHIUTWEWSA-N 2 1 377.532 3.289 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000248733728 1433818582 /nfs/dbraw/zinc/81/85/82/1433818582.db2.gz KHCMSUMYDUWTHC-DHIUTWEWSA-N 2 1 377.532 3.289 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000248733728 1433818583 /nfs/dbraw/zinc/81/85/83/1433818583.db2.gz KHCMSUMYDUWTHC-DHIUTWEWSA-N 2 1 377.532 3.289 20 0 GGADMP C[C@H](CCc1ccc(O)cc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000248749702 1433819873 /nfs/dbraw/zinc/81/98/73/1433819873.db2.gz SWWMBUASJXQHAW-XMSQKQJNSA-N 2 1 395.547 3.200 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000248760358 1433820706 /nfs/dbraw/zinc/82/07/06/1433820706.db2.gz GNAJJGFSYZZJHX-NRSPTQNISA-N 2 1 395.551 3.313 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000248760358 1433820707 /nfs/dbraw/zinc/82/07/07/1433820707.db2.gz GNAJJGFSYZZJHX-NRSPTQNISA-N 2 1 395.551 3.313 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)C[C@H]2COCCN2C(=O)OC(C)(C)C)C1 ZINC000248770471 1433821480 /nfs/dbraw/zinc/82/14/80/1433821480.db2.gz XZHFBWIJJYYLOB-QRVBRYPASA-N 2 1 383.577 3.111 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000248770109 1433821486 /nfs/dbraw/zinc/82/14/86/1433821486.db2.gz SLLXNPMJJQPPQC-FCHUYYIVSA-N 2 1 386.584 3.176 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000248770109 1433821488 /nfs/dbraw/zinc/82/14/88/1433821488.db2.gz SLLXNPMJJQPPQC-FCHUYYIVSA-N 2 1 386.584 3.176 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000248770109 1433821490 /nfs/dbraw/zinc/82/14/90/1433821490.db2.gz SLLXNPMJJQPPQC-FCHUYYIVSA-N 2 1 386.584 3.176 20 0 GGADMP C[N@@H+]1CCN(C(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)[C@@H](c2ccccc2)C1 ZINC000248770079 1433821496 /nfs/dbraw/zinc/82/14/96/1433821496.db2.gz SLGLNMRGRRYTCQ-FYYLOGMGSA-N 2 1 392.547 3.207 20 0 GGADMP C[N@H+]1CCN(C(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)[C@@H](c2ccccc2)C1 ZINC000248770079 1433821497 /nfs/dbraw/zinc/82/14/97/1433821497.db2.gz SLGLNMRGRRYTCQ-FYYLOGMGSA-N 2 1 392.547 3.207 20 0 GGADMP C[NH+]1CCN(C(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)[C@@H](c2ccccc2)C1 ZINC000248770079 1433821500 /nfs/dbraw/zinc/82/15/00/1433821500.db2.gz SLGLNMRGRRYTCQ-FYYLOGMGSA-N 2 1 392.547 3.207 20 0 GGADMP C[NH+]1CCN(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)[C@@H](c2ccccc2)C1 ZINC000248770079 1433821503 /nfs/dbraw/zinc/82/15/03/1433821503.db2.gz SLGLNMRGRRYTCQ-FYYLOGMGSA-N 2 1 392.547 3.207 20 0 GGADMP C[N@@H+]1CCN(C(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC000248770084 1433821514 /nfs/dbraw/zinc/82/15/14/1433821514.db2.gz SLGLNMRGRRYTCQ-GGAORHGYSA-N 2 1 392.547 3.207 20 0 GGADMP C[N@H+]1CCN(C(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC000248770084 1433821515 /nfs/dbraw/zinc/82/15/15/1433821515.db2.gz SLGLNMRGRRYTCQ-GGAORHGYSA-N 2 1 392.547 3.207 20 0 GGADMP C[NH+]1CCN(C(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC000248770084 1433821517 /nfs/dbraw/zinc/82/15/17/1433821517.db2.gz SLGLNMRGRRYTCQ-GGAORHGYSA-N 2 1 392.547 3.207 20 0 GGADMP C[NH+]1CCN(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC000248770084 1433821519 /nfs/dbraw/zinc/82/15/19/1433821519.db2.gz SLGLNMRGRRYTCQ-GGAORHGYSA-N 2 1 392.547 3.207 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1ccc(C[NH+](C)C)cc1 ZINC000248806581 1433823461 /nfs/dbraw/zinc/82/34/61/1433823461.db2.gz KDZMWTWSEMNGMQ-PGRDOPGGSA-N 2 1 380.536 3.068 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CCCO2)C[C@H]1C ZINC000248831128 1433824615 /nfs/dbraw/zinc/82/46/15/1433824615.db2.gz LWFXKKXUBHKMEK-RYFAJOAYSA-N 2 1 388.552 3.235 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)C[C@H]1C ZINC000248831128 1433824616 /nfs/dbraw/zinc/82/46/16/1433824616.db2.gz LWFXKKXUBHKMEK-RYFAJOAYSA-N 2 1 388.552 3.235 20 0 GGADMP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248829349 1433824619 /nfs/dbraw/zinc/82/46/19/1433824619.db2.gz DTQOMZKAPRVFAQ-JCTONOIOSA-N 2 1 378.564 3.404 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000248852082 1433825694 /nfs/dbraw/zinc/82/56/94/1433825694.db2.gz OWKCSKXGFSJOMI-SQMBMXPBSA-N 2 1 396.579 3.165 20 0 GGADMP CC(C)O[C@@H]1C[C@H]([NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)C1(C)C ZINC000248912908 1433829244 /nfs/dbraw/zinc/82/92/44/1433829244.db2.gz VPAHZDDEQDMTTO-QHAWAJNXSA-N 2 1 387.568 3.066 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000248945943 1433830236 /nfs/dbraw/zinc/83/02/36/1433830236.db2.gz DLAKMBDRHVTVPS-DEVSCXNHSA-N 2 1 383.492 3.374 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(=O)oc3cc(OC)ccc23)[C@@H](C)C1 ZINC000248965089 1433830990 /nfs/dbraw/zinc/83/09/90/1433830990.db2.gz HBSWMUQLZFFHQC-OXJNMPFZSA-N 2 1 388.508 3.028 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(=O)oc3cc(OC)ccc23)[C@@H](C)C1 ZINC000248965089 1433830991 /nfs/dbraw/zinc/83/09/91/1433830991.db2.gz HBSWMUQLZFFHQC-OXJNMPFZSA-N 2 1 388.508 3.028 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N(C)Cc1ccccc1 ZINC000248964017 1433831005 /nfs/dbraw/zinc/83/10/05/1433831005.db2.gz GXFJJDMHEYKUBX-GZOXUSKESA-N 2 1 379.548 3.391 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N(C)Cc1ccccc1 ZINC000248964017 1433831006 /nfs/dbraw/zinc/83/10/06/1433831006.db2.gz GXFJJDMHEYKUBX-GZOXUSKESA-N 2 1 379.548 3.391 20 0 GGADMP COc1cccc2c1CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)C2 ZINC000249033995 1433832709 /nfs/dbraw/zinc/83/27/09/1433832709.db2.gz MHBHGYQTWPYNLM-VXKWHMMOSA-N 2 1 380.532 3.299 20 0 GGADMP CCN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000249274675 1433839994 /nfs/dbraw/zinc/83/99/94/1433839994.db2.gz CMUZPXRCUGJVDN-WOJBJXKFSA-N 2 1 384.524 3.188 20 0 GGADMP CCN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249274675 1433839995 /nfs/dbraw/zinc/83/99/95/1433839995.db2.gz CMUZPXRCUGJVDN-WOJBJXKFSA-N 2 1 384.524 3.188 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@@H](C)[C@@H]2CNC(=O)OC(C)(C)C)CC1 ZINC000249274899 1433840013 /nfs/dbraw/zinc/84/00/13/1433840013.db2.gz KMQOOOVKJGHXHB-UXHICEINSA-N 2 1 396.620 3.028 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)cc(C)c2)[C@@H](C)C1 ZINC000249389969 1433842400 /nfs/dbraw/zinc/84/24/00/1433842400.db2.gz RTJRFGDUHSVLRE-ZJOUEHCJSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)Nc2cc(C)cc(C)c2)[C@@H](C)C1 ZINC000249389969 1433842401 /nfs/dbraw/zinc/84/24/01/1433842401.db2.gz RTJRFGDUHSVLRE-ZJOUEHCJSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cc(C)cc(C)c2)[C@H](C)C1 ZINC000249389967 1433842417 /nfs/dbraw/zinc/84/24/17/1433842417.db2.gz RTJRFGDUHSVLRE-SBHAEUEKSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2cc(C)cc(C)c2)[C@H](C)C1 ZINC000249389967 1433842418 /nfs/dbraw/zinc/84/24/18/1433842418.db2.gz RTJRFGDUHSVLRE-SBHAEUEKSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NCc2ccccc2Cl)[C@H](C)C1 ZINC000249416508 1433843251 /nfs/dbraw/zinc/84/32/51/1433843251.db2.gz GOWQWCDNCJZXRE-HLIPFELVSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NCc2ccccc2Cl)[C@H](C)C1 ZINC000249416508 1433843252 /nfs/dbraw/zinc/84/32/52/1433843252.db2.gz GOWQWCDNCJZXRE-HLIPFELVSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2CCCc3ccccc32)[C@H](C)C1 ZINC000249447056 1433844064 /nfs/dbraw/zinc/84/40/64/1433844064.db2.gz NLFDYSMPYNDBCQ-SBHAEUEKSA-N 2 1 387.568 3.081 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2CCCc3ccccc32)[C@H](C)C1 ZINC000249447056 1433844065 /nfs/dbraw/zinc/84/40/65/1433844065.db2.gz NLFDYSMPYNDBCQ-SBHAEUEKSA-N 2 1 387.568 3.081 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)[C@@H](C)C1 ZINC000249461967 1433844389 /nfs/dbraw/zinc/84/43/89/1433844389.db2.gz QZQMFDUXDLLVRI-LEZSPFLNSA-N 2 1 381.605 3.042 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)[C@@H](C)C1 ZINC000249461967 1433844390 /nfs/dbraw/zinc/84/43/90/1433844390.db2.gz QZQMFDUXDLLVRI-LEZSPFLNSA-N 2 1 381.605 3.042 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NCC(=O)N[C@@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000249486863 1433844881 /nfs/dbraw/zinc/84/48/81/1433844881.db2.gz YITDHCUYZJMTBH-ZWOKBUDYSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000249486863 1433844882 /nfs/dbraw/zinc/84/48/82/1433844882.db2.gz YITDHCUYZJMTBH-ZWOKBUDYSA-N 2 1 395.975 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000249486863 1433844883 /nfs/dbraw/zinc/84/48/83/1433844883.db2.gz YITDHCUYZJMTBH-ZWOKBUDYSA-N 2 1 395.975 3.244 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NC[C@H]3CC[NH+](C4CC4)C3)cc2)C1 ZINC000249507639 1433845417 /nfs/dbraw/zinc/84/54/17/1433845417.db2.gz JUJFOFMUBAZLIA-WIYYLYMNSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)NC[C@H]3CC[N@@H+](C4CC4)C3)cc2)C1 ZINC000249507639 1433845419 /nfs/dbraw/zinc/84/54/19/1433845419.db2.gz JUJFOFMUBAZLIA-WIYYLYMNSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)NC[C@H]3CC[N@H+](C4CC4)C3)cc2)C1 ZINC000249507639 1433845420 /nfs/dbraw/zinc/84/54/20/1433845420.db2.gz JUJFOFMUBAZLIA-WIYYLYMNSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000249755382 1433851155 /nfs/dbraw/zinc/85/11/55/1433851155.db2.gz CTBOBKKOLOMHEL-MSOLQXFVSA-N 2 1 376.545 3.006 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@@H](C)C2)C1 ZINC000249760433 1433851330 /nfs/dbraw/zinc/85/13/30/1433851330.db2.gz XMWFWASRSKPACX-UXHICEINSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000249760433 1433851331 /nfs/dbraw/zinc/85/13/31/1433851331.db2.gz XMWFWASRSKPACX-UXHICEINSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000249760433 1433851332 /nfs/dbraw/zinc/85/13/32/1433851332.db2.gz XMWFWASRSKPACX-UXHICEINSA-N 2 1 386.584 3.450 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000249779720 1433851983 /nfs/dbraw/zinc/85/19/83/1433851983.db2.gz PCMNNCSOIAXGII-UXHICEINSA-N 2 1 386.584 3.113 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)N[C@H]2CCOc3ccccc32)CC1 ZINC000249818642 1433852700 /nfs/dbraw/zinc/85/27/00/1433852700.db2.gz MMHWELLBUMCRHV-NQIIRXRSSA-N 2 1 387.568 3.459 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)N[C@H]2CCOc3ccccc32)CC1 ZINC000249818646 1433852732 /nfs/dbraw/zinc/85/27/32/1433852732.db2.gz MMHWELLBUMCRHV-RXVVDRJESA-N 2 1 387.568 3.459 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCC[C@@H](C)C1 ZINC000250418412 1433856022 /nfs/dbraw/zinc/85/60/22/1433856022.db2.gz BPMZUODZAQYZTO-CEXWTWQISA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1)[N@@H+]1CCC[C@@H](C)C1 ZINC000250418412 1433856023 /nfs/dbraw/zinc/85/60/23/1433856023.db2.gz BPMZUODZAQYZTO-CEXWTWQISA-N 2 1 392.613 3.380 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H]1CCC[NH+](Cc2cccs2)C1)[N@H+]1CCC[C@@H](C)C1 ZINC000250418412 1433856024 /nfs/dbraw/zinc/85/60/24/1433856024.db2.gz BPMZUODZAQYZTO-CEXWTWQISA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000250479951 1433856197 /nfs/dbraw/zinc/85/61/97/1433856197.db2.gz BREFJFJZYVWGHK-QZTJIDSGSA-N 2 1 378.586 3.305 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@H]1CCC[NH+]1Cc1ccccc1 ZINC000250820097 1433857337 /nfs/dbraw/zinc/85/73/37/1433857337.db2.gz RIAYQESQFDWBOL-DNQXCXABSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000250820097 1433857338 /nfs/dbraw/zinc/85/73/38/1433857338.db2.gz RIAYQESQFDWBOL-DNQXCXABSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000250820097 1433857339 /nfs/dbraw/zinc/85/73/39/1433857339.db2.gz RIAYQESQFDWBOL-DNQXCXABSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@H]1CCC[NH+]1Cc1ccccc1 ZINC000250820094 1433857363 /nfs/dbraw/zinc/85/73/63/1433857363.db2.gz RIAYQESQFDWBOL-BJKOFHAPSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000250820094 1433857364 /nfs/dbraw/zinc/85/73/64/1433857364.db2.gz RIAYQESQFDWBOL-BJKOFHAPSA-N 2 1 391.559 3.332 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000250820094 1433857365 /nfs/dbraw/zinc/85/73/65/1433857365.db2.gz RIAYQESQFDWBOL-BJKOFHAPSA-N 2 1 391.559 3.332 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)C1CC1 ZINC000251542184 1433858806 /nfs/dbraw/zinc/85/88/06/1433858806.db2.gz GJRKXJMSRXGCRU-RBBKRZOGSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)C1 ZINC000252193457 1433862898 /nfs/dbraw/zinc/86/28/98/1433862898.db2.gz VFYJFXGHGUELER-SBHAEUEKSA-N 2 1 386.584 3.441 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC000252193457 1433862899 /nfs/dbraw/zinc/86/28/99/1433862899.db2.gz VFYJFXGHGUELER-SBHAEUEKSA-N 2 1 386.584 3.441 20 0 GGADMP COc1ccc([C@H](NC(=O)CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C(C)C)cc1 ZINC000252692404 1433864216 /nfs/dbraw/zinc/86/42/16/1433864216.db2.gz BHHANLJUAWWODG-BPUDTRNYSA-N 2 1 399.579 3.457 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)[NH+]1CCc2ccccc2C1 ZINC000252692252 1433864299 /nfs/dbraw/zinc/86/42/99/1433864299.db2.gz UDGSMZSBTXMWDN-RZFNWQHOSA-N 2 1 396.579 3.092 20 0 GGADMP CN(C(=O)Cc1noc2ccccc21)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000252726713 1433864386 /nfs/dbraw/zinc/86/43/86/1433864386.db2.gz DWKWODWJKREEJD-LEWJYISDSA-N 2 1 398.551 3.166 20 0 GGADMP C(=C\C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1)\CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000255337879 1433880830 /nfs/dbraw/zinc/88/08/30/1433880830.db2.gz IDIBDCILPUSWHZ-JYWJTCDSSA-N 3 1 388.644 3.158 20 0 GGADMP C(=C\C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1)\CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000255337879 1433880831 /nfs/dbraw/zinc/88/08/31/1433880831.db2.gz IDIBDCILPUSWHZ-JYWJTCDSSA-N 3 1 388.644 3.158 20 0 GGADMP C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(N3CC[NH+](Cc4ccccc4)CC3)cc2)C1 ZINC000261386568 1433895495 /nfs/dbraw/zinc/89/54/95/1433895495.db2.gz MMGYFIPKMVZIMJ-FQEVSTJZSA-N 2 1 392.547 3.289 20 0 GGADMP CC[C@@H](CNC(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1)[NH+]1CCc2ccccc2C1 ZINC000261479710 1433896892 /nfs/dbraw/zinc/89/68/92/1433896892.db2.gz ZXVYQMWRAZYYNP-RTWAWAEBSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@@H](CNC(=O)N[C@@H]1CC[NH+](C2CCCC2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000261479710 1433896893 /nfs/dbraw/zinc/89/68/93/1433896893.db2.gz ZXVYQMWRAZYYNP-RTWAWAEBSA-N 2 1 384.568 3.139 20 0 GGADMP CC[C@@H](CNC(=O)N[C@@H]1CC[NH+](C2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000261479710 1433896894 /nfs/dbraw/zinc/89/68/94/1433896894.db2.gz ZXVYQMWRAZYYNP-RTWAWAEBSA-N 2 1 384.568 3.139 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1)[C@@H]1CCC[NH2+]1 ZINC000261649454 1433898179 /nfs/dbraw/zinc/89/81/79/1433898179.db2.gz ALFJVIKHNRWAFG-OFNKIYASSA-N 2 1 377.532 3.434 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+](Cc2csc(C3CCCCC3)n2)C1)[C@@H]1CCC[NH2+]1 ZINC000261651449 1433898298 /nfs/dbraw/zinc/89/82/98/1433898298.db2.gz ALIANANPSCHRST-LPHOPBHVSA-N 2 1 390.597 3.271 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2csc(C3CCCCC3)n2)C1)[C@@H]1CCC[NH2+]1 ZINC000261651449 1433898300 /nfs/dbraw/zinc/89/83/00/1433898300.db2.gz ALIANANPSCHRST-LPHOPBHVSA-N 2 1 390.597 3.271 20 0 GGADMP CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000261743221 1433901317 /nfs/dbraw/zinc/90/13/17/1433901317.db2.gz PIHVZFMQAHTIPE-XMMPIXPASA-N 2 1 395.547 3.285 20 0 GGADMP CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)C[N@H+]1CC[C@](C)(C[NH3+])C1 ZINC000261743221 1433901322 /nfs/dbraw/zinc/90/13/22/1433901322.db2.gz PIHVZFMQAHTIPE-XMMPIXPASA-N 2 1 395.547 3.285 20 0 GGADMP Cc1cc(OCC[N@H+]2CCC[C@H](CNC(=O)[C@@H]3CCC[NH2+]3)C2)ccc1C(C)C ZINC000261794640 1433904594 /nfs/dbraw/zinc/90/45/94/1433904594.db2.gz ILWVOICRHXMTCN-KNQAVFIVSA-N 2 1 387.568 3.077 20 0 GGADMP Cc1cc(NC(=O)C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)ccc1Br ZINC000261825172 1433905834 /nfs/dbraw/zinc/90/58/34/1433905834.db2.gz WZSPEAIVECSYQP-KRWDZBQOSA-N 2 1 380.330 3.160 20 0 GGADMP O=C(CC[C@@H]1CC[NH2+]C1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000261852548 1433907172 /nfs/dbraw/zinc/90/71/72/1433907172.db2.gz NGQQSUFCDMSWGI-HXUWFJFHSA-N 2 1 377.532 3.310 20 0 GGADMP O=C(CC[C@H]1CC[NH2+]C1)N1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000261877556 1433908818 /nfs/dbraw/zinc/90/88/18/1433908818.db2.gz SLBSGMVHCARWNN-INIZCTEOSA-N 2 1 383.458 3.129 20 0 GGADMP Cc1ccc(-c2nc(C[N@@H+]3CCC[C@H](CNC(=O)[C@H]4CCC[NH2+]4)C3)cs2)cc1 ZINC000261897603 1433910732 /nfs/dbraw/zinc/91/07/32/1433910732.db2.gz REZGFOCDMZESPJ-YLJYHZDGSA-N 2 1 398.576 3.199 20 0 GGADMP Cc1ccc(-c2nc(C[N@H+]3CCC[C@H](CNC(=O)[C@H]4CCC[NH2+]4)C3)cs2)cc1 ZINC000261897603 1433910739 /nfs/dbraw/zinc/91/07/39/1433910739.db2.gz REZGFOCDMZESPJ-YLJYHZDGSA-N 2 1 398.576 3.199 20 0 GGADMP O=C(NC[C@H]1CCC[N@H+](Cc2ccc(SC(F)F)cc2)C1)[C@@H]1CCC[NH2+]1 ZINC000261921108 1433913087 /nfs/dbraw/zinc/91/30/87/1433913087.db2.gz UYOKGPSLVMEQAR-WBVHZDCISA-N 2 1 383.508 3.082 20 0 GGADMP [NH3+]CCC(=O)NC[C@@H]1CCCC[N@H+]1Cc1cccc(OCc2ccccc2)c1 ZINC000261927940 1433913936 /nfs/dbraw/zinc/91/39/36/1433913936.db2.gz CKPGITLJZCBSAZ-NRFANRHFSA-N 2 1 381.520 3.085 20 0 GGADMP Cc1cccn2cc(COc3ccc(C[N@@H+]4CC[C@]5(CC[NH2+]C5)C4)cc3)nc12 ZINC000261936387 1433914315 /nfs/dbraw/zinc/91/43/15/1433914315.db2.gz DGVKRPVKLBSQQQ-QHCPKHFHSA-N 2 1 376.504 3.407 20 0 GGADMP Cc1cccn2cc(COc3ccc(C[N@H+]4CC[C@]5(CC[NH2+]C5)C4)cc3)nc12 ZINC000261936387 1433914316 /nfs/dbraw/zinc/91/43/16/1433914316.db2.gz DGVKRPVKLBSQQQ-QHCPKHFHSA-N 2 1 376.504 3.407 20 0 GGADMP Clc1ccc(C[N@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)c(-n2cncn2)c1 ZINC000261941753 1433914922 /nfs/dbraw/zinc/91/49/22/1433914922.db2.gz MTOZQWNTAJDAEB-HXUWFJFHSA-N 2 1 396.926 3.460 20 0 GGADMP Clc1ccc(C[N@@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)c(-n2cncn2)c1 ZINC000261941753 1433914927 /nfs/dbraw/zinc/91/49/27/1433914927.db2.gz MTOZQWNTAJDAEB-HXUWFJFHSA-N 2 1 396.926 3.460 20 0 GGADMP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000261981104 1433919294 /nfs/dbraw/zinc/91/92/94/1433919294.db2.gz RIRWOMXKOBDWFA-MAUKXSAKSA-N 2 1 383.458 3.094 20 0 GGADMP C[NH2+]CCC1CC[NH+](CC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)CC1 ZINC000261994502 1433920165 /nfs/dbraw/zinc/92/01/65/1433920165.db2.gz NGHCSRKFCGUYLG-OAQYLSRUSA-N 2 1 389.540 3.414 20 0 GGADMP C[NH2+]CCC1CC[NH+]([C@@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)CC1 ZINC000262014368 1433922106 /nfs/dbraw/zinc/92/21/06/1433922106.db2.gz VKVGLOOEFGBENM-SFHVURJKSA-N 2 1 383.540 3.138 20 0 GGADMP [NH3+]CCC(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccc(OCc2ccccc2)cc1 ZINC000262015019 1433922274 /nfs/dbraw/zinc/92/22/74/1433922274.db2.gz MQUIIOWOIMPGQE-NRFANRHFSA-N 2 1 381.520 3.085 20 0 GGADMP FC(F)(F)c1ccc(-c2nc(C[N@@H+]3CC[C@H](N4CC[NH2+]CC4)C3)cs2)cc1 ZINC000262110213 1433927329 /nfs/dbraw/zinc/92/73/29/1433927329.db2.gz KIPKANZZJKEIEU-KRWDZBQOSA-N 2 1 396.482 3.308 20 0 GGADMP FC(F)(F)c1ccc(-c2nc(C[N@H+]3CC[C@H](N4CC[NH2+]CC4)C3)cs2)cc1 ZINC000262110213 1433927333 /nfs/dbraw/zinc/92/73/33/1433927333.db2.gz KIPKANZZJKEIEU-KRWDZBQOSA-N 2 1 396.482 3.308 20 0 GGADMP CCCN(C(=O)c1csc(CC[NH3+])n1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000262433644 1433938786 /nfs/dbraw/zinc/93/87/86/1433938786.db2.gz WYGHJHJDKBRQFQ-GOSISDBHSA-N 2 1 386.565 3.161 20 0 GGADMP C[C@H](C(=O)N(Cc1ccccn1)[C@@H]1CCC[NH2+]CC1)[N@@H+](C)Cc1ccccc1 ZINC000262438601 1433939012 /nfs/dbraw/zinc/93/90/12/1433939012.db2.gz UQSYHTNFHOHQLE-DENIHFKCSA-N 2 1 380.536 3.073 20 0 GGADMP C[C@@H](C(=O)N(Cc1ccccn1)[C@@H]1CCC[NH2+]CC1)[N@@H+](C)Cc1ccccc1 ZINC000262438607 1433939166 /nfs/dbraw/zinc/93/91/66/1433939166.db2.gz UQSYHTNFHOHQLE-SIKLNZKXSA-N 2 1 380.536 3.073 20 0 GGADMP C[N@@H+](Cc1ccccc1CNC(=O)c1csc(CC[NH3+])n1)C1CCCCC1 ZINC000262448341 1433939583 /nfs/dbraw/zinc/93/95/83/1433939583.db2.gz ZAYIYOJECLJXAJ-UHFFFAOYSA-N 2 1 386.565 3.339 20 0 GGADMP [NH3+][C@H](CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000262585102 1433944726 /nfs/dbraw/zinc/94/47/26/1433944726.db2.gz OEKQPZIVZZAXLI-UYAOXDASSA-N 2 1 391.437 3.257 20 0 GGADMP [NH3+]CCCOC1CCN(C(=O)C[NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC000262589212 1433945068 /nfs/dbraw/zinc/94/50/68/1433945068.db2.gz BYVUTNKZOQGSGM-UHFFFAOYSA-N 2 1 395.547 3.045 20 0 GGADMP C[C@H]([NH3+])[C@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000262652769 1433948210 /nfs/dbraw/zinc/94/82/10/1433948210.db2.gz YPFYULLFKARISZ-IEZWGBDMSA-N 2 1 383.458 3.027 20 0 GGADMP C[C@H](CC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)[C@H]1CCC[NH2+]C1 ZINC000262673607 1433949330 /nfs/dbraw/zinc/94/93/30/1433949330.db2.gz QEHREKMDBLNTAB-MJGOQNOKSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@H](CC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)[C@H]1CCC[NH2+]C1 ZINC000262673607 1433949335 /nfs/dbraw/zinc/94/93/35/1433949335.db2.gz QEHREKMDBLNTAB-MJGOQNOKSA-N 2 1 377.960 3.400 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(-c3nnc(C[NH3+])[nH]3)cc2)cc1)C(C)C ZINC000262738515 1433953206 /nfs/dbraw/zinc/95/32/06/1433953206.db2.gz DAGSBQRHUISXJD-UHFFFAOYSA-N 2 1 392.507 3.413 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C[NH3+])n3)cc2)cc1)C(C)C ZINC000262738515 1433953211 /nfs/dbraw/zinc/95/32/11/1433953211.db2.gz DAGSBQRHUISXJD-UHFFFAOYSA-N 2 1 392.507 3.413 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C[NH3+])n3)cc2)cc1)C(C)C ZINC000262738515 1433953215 /nfs/dbraw/zinc/95/32/15/1433953215.db2.gz DAGSBQRHUISXJD-UHFFFAOYSA-N 2 1 392.507 3.413 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1(C)C ZINC000262752390 1433953466 /nfs/dbraw/zinc/95/34/66/1433953466.db2.gz ACTVHYKREJXHJN-LLBVYWAGSA-N 2 1 387.568 3.067 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1ccn([C@@H]2CCC[NH2+]C2)n1 ZINC000262832917 1433959777 /nfs/dbraw/zinc/95/97/77/1433959777.db2.gz SEYVPSXPDVGUTA-GHTZIAJQSA-N 2 1 395.551 3.112 20 0 GGADMP Cc1cccc(C)c1NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000263789195 1434034321 /nfs/dbraw/zinc/03/43/21/1434034321.db2.gz XJFHUCCAIONZNF-UFYCRDLUSA-N 2 1 387.568 3.452 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)CC1 ZINC000264597900 1434132628 /nfs/dbraw/zinc/13/26/28/1434132628.db2.gz ASGOHGQNGGRVLI-SFHVURJKSA-N 2 1 388.556 3.322 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCCCCC[NH+]1CCCCC1 ZINC000264695886 1434145144 /nfs/dbraw/zinc/14/51/44/1434145144.db2.gz FTJVWLGXLZEVLN-UHFFFAOYSA-N 2 1 384.528 3.031 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@H]([NH+]3CCCCC3)C2)cc1)[NH+]1CCOCC1 ZINC000265359585 1434224229 /nfs/dbraw/zinc/22/42/29/1434224229.db2.gz FZFALZNZFYTAJV-NQIIRXRSSA-N 2 1 386.540 3.172 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000265771564 1434263863 /nfs/dbraw/zinc/26/38/63/1434263863.db2.gz SSLBRUQSATWIGB-NQIIRXRSSA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000265771564 1434263866 /nfs/dbraw/zinc/26/38/66/1434263866.db2.gz SSLBRUQSATWIGB-NQIIRXRSSA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000265771560 1434263924 /nfs/dbraw/zinc/26/39/24/1434263924.db2.gz SSLBRUQSATWIGB-GHTZIAJQSA-N 2 1 383.540 3.276 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000265771560 1434263926 /nfs/dbraw/zinc/26/39/26/1434263926.db2.gz SSLBRUQSATWIGB-GHTZIAJQSA-N 2 1 383.540 3.276 20 0 GGADMP C[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)C2CC[NH+](C)CC2)CC1 ZINC000266177380 1434308322 /nfs/dbraw/zinc/30/83/22/1434308322.db2.gz UNVNCMXQWFOXFL-UHFFFAOYSA-N 2 1 397.485 3.470 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)C1 ZINC000266426781 1434334803 /nfs/dbraw/zinc/33/48/03/1434334803.db2.gz RFVVGWWUFMPIMS-AZUAARDMSA-N 2 1 397.485 3.241 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)[C@@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)C1 ZINC000266426781 1434334804 /nfs/dbraw/zinc/33/48/04/1434334804.db2.gz RFVVGWWUFMPIMS-AZUAARDMSA-N 2 1 397.485 3.241 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000266426781 1434334806 /nfs/dbraw/zinc/33/48/06/1434334806.db2.gz RFVVGWWUFMPIMS-AZUAARDMSA-N 2 1 397.485 3.241 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CC[C@@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC000266521460 1434346116 /nfs/dbraw/zinc/34/61/16/1434346116.db2.gz NQWQRMWKFCWRAS-LJQANCHMSA-N 2 1 383.540 3.278 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000266521460 1434346119 /nfs/dbraw/zinc/34/61/19/1434346119.db2.gz NQWQRMWKFCWRAS-LJQANCHMSA-N 2 1 383.540 3.278 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000266608847 1434353998 /nfs/dbraw/zinc/35/39/98/1434353998.db2.gz AOEASSKHGNVHNB-UHFFFAOYSA-N 2 1 394.519 3.425 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)[C@H](c2ccccc2)N2CCOCC2)cn1 ZINC000267285591 1434419399 /nfs/dbraw/zinc/41/93/99/1434419399.db2.gz WJXBILSLBIWAKL-WZONZLPQSA-N 2 1 391.519 3.127 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000267359280 1434425565 /nfs/dbraw/zinc/42/55/65/1434425565.db2.gz IYMWDTFGONLGOZ-UGKGYDQZSA-N 2 1 386.584 3.270 20 0 GGADMP Cc1cc(N2CCC(NC(=O)c3ccc(C[NH+]4CCCC4)cc3)CC2)nc(C)[nH+]1 ZINC000267427953 1434431734 /nfs/dbraw/zinc/43/17/34/1434431734.db2.gz YFNCQDWRWMTXLL-UHFFFAOYSA-N 2 1 393.535 3.088 20 0 GGADMP Cc1ccc2nc(C[NH2+]Cc3ccccc3N(C)C3CC[NH+](C)CC3)cn2c1 ZINC000268358347 1434515247 /nfs/dbraw/zinc/51/52/47/1434515247.db2.gz OZPUWTFQOOSMDO-UHFFFAOYSA-N 2 1 377.536 3.463 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]C(C)(C)c3cccc(C(F)(F)F)c3)cn2)CC1 ZINC000268519888 1434529609 /nfs/dbraw/zinc/52/96/09/1434529609.db2.gz FQSBLQPVXRQRMR-UHFFFAOYSA-N 2 1 393.457 3.272 20 0 GGADMP Cc1[nH+]ccn1CCCNC(=O)NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000268556812 1434533317 /nfs/dbraw/zinc/53/33/17/1434533317.db2.gz JLJURRHVFCDJDE-QZTJIDSGSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1ccc(CNC(=O)C2CC[NH+](CC[C@H]3CCCC[N@@H+]3C)CC2)cc1F ZINC000268569013 1434535019 /nfs/dbraw/zinc/53/50/19/1434535019.db2.gz QUFWTOYATGOZFV-HXUWFJFHSA-N 2 1 375.532 3.337 20 0 GGADMP c1ncn(Cc2ccc(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)cc2)n1 ZINC000268754141 1434553230 /nfs/dbraw/zinc/55/32/30/1434553230.db2.gz KZZOQXFYPFJWTK-UHFFFAOYSA-N 2 1 375.520 3.123 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)[C@H](C)C3)cn2)CCO1 ZINC000268761546 1434554111 /nfs/dbraw/zinc/55/41/11/1434554111.db2.gz HMEDEIIUMSAQMP-TXTKFYIRSA-N 2 1 394.563 3.449 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](Cc4ccccc4)[C@H](C)C3)cn2)CCO1 ZINC000268761546 1434554114 /nfs/dbraw/zinc/55/41/14/1434554114.db2.gz HMEDEIIUMSAQMP-TXTKFYIRSA-N 2 1 394.563 3.449 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccnc2N2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000268761821 1434554140 /nfs/dbraw/zinc/55/41/40/1434554140.db2.gz LUOXWWZUSFWLBH-KNQAVFIVSA-N 2 1 380.536 3.061 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccnc2N2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000268761821 1434554145 /nfs/dbraw/zinc/55/41/45/1434554145.db2.gz LUOXWWZUSFWLBH-KNQAVFIVSA-N 2 1 380.536 3.061 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000268770891 1434555386 /nfs/dbraw/zinc/55/53/86/1434555386.db2.gz SLCGIONEMPONKH-BULFRSBZSA-N 2 1 384.520 3.237 20 0 GGADMP CC[N@H+](C)[C@@H](C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1ccccc1 ZINC000268776572 1434556022 /nfs/dbraw/zinc/55/60/22/1434556022.db2.gz UAGYAQYLPUBPDZ-JOCHJYFZSA-N 2 1 395.551 3.244 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1ccccc1 ZINC000268776572 1434556023 /nfs/dbraw/zinc/55/60/23/1434556023.db2.gz UAGYAQYLPUBPDZ-JOCHJYFZSA-N 2 1 395.551 3.244 20 0 GGADMP CC[C@@H]([NH2+]Cc1ccc(C(=O)N2CC[NH+](C)CC2)cc1)c1ccc(OC)cc1 ZINC000268797669 1434558368 /nfs/dbraw/zinc/55/83/68/1434558368.db2.gz GSBSQGRGFYHKCR-JOCHJYFZSA-N 2 1 381.520 3.324 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2ccc(OC(F)F)c(OC)c2)CC1 ZINC000268801453 1434558579 /nfs/dbraw/zinc/55/85/79/1434558579.db2.gz HOVYWRTWYUHJDP-MRXNPFEDSA-N 2 1 385.499 3.365 20 0 GGADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(N2CCOCC2)c1 ZINC000268805817 1434559327 /nfs/dbraw/zinc/55/93/27/1434559327.db2.gz HHPUMPYDGOGQPD-ZCNNSNEGSA-N 2 1 375.557 3.063 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000268808429 1434559900 /nfs/dbraw/zinc/55/99/00/1434559900.db2.gz LMMSHKOKQOVHQC-NFBKMPQASA-N 3 1 384.612 3.188 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000268808429 1434559906 /nfs/dbraw/zinc/55/99/06/1434559906.db2.gz LMMSHKOKQOVHQC-NFBKMPQASA-N 3 1 384.612 3.188 20 0 GGADMP C[C@H]([NH2+]C[C@H](O)C[NH+]1CCCC1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000268826556 1434561475 /nfs/dbraw/zinc/56/14/75/1434561475.db2.gz JBGBLYVXHCFWRR-RXVVDRJESA-N 2 1 394.519 3.021 20 0 GGADMP C[C@@H]([NH2+]C[C@H](O)C[NH+]1CCCC1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000268825518 1434561614 /nfs/dbraw/zinc/56/16/14/1434561614.db2.gz JBGBLYVXHCFWRR-NQIIRXRSSA-N 2 1 394.519 3.021 20 0 GGADMP c1ccc(CC[NH+]2CCC([NH2+]CCCc3nnc4n3CCCCC4)CC2)cc1 ZINC000268837837 1434562774 /nfs/dbraw/zinc/56/27/74/1434562774.db2.gz LYYNFCVPCUTTQS-UHFFFAOYSA-N 2 1 381.568 3.234 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(NS(C)(=O)=O)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268839553 1434563246 /nfs/dbraw/zinc/56/32/46/1434563246.db2.gz QMSRHMPWNJLMAT-UWJYYQICSA-N 2 1 387.549 3.201 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC2CC[NH+](CCc3ccccc3)CC2)[C@@H](C)C1 ZINC000268859376 1434565447 /nfs/dbraw/zinc/56/54/47/1434565447.db2.gz YIHXAJVLCSATDH-URXFXBBRSA-N 2 1 387.612 3.420 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(N3CCOCC3)c2)[C@H](C)C1 ZINC000268881648 1434567533 /nfs/dbraw/zinc/56/75/33/1434567533.db2.gz HZQRUJGLAUILMO-VIZSFHNOSA-N 2 1 389.584 3.311 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(N3CCOCC3)c2)[C@@H](C)C1 ZINC000268881637 1434567672 /nfs/dbraw/zinc/56/76/72/1434567672.db2.gz HZQRUJGLAUILMO-JTAQYXEDSA-N 2 1 389.584 3.311 20 0 GGADMP O[C@H]1CCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccccc2OCc2cccnc2)CC1 ZINC000268995136 1434579535 /nfs/dbraw/zinc/57/95/35/1434579535.db2.gz XHRAPYUADWKTJW-VXKWHMMOSA-N 2 1 381.520 3.128 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000269441455 1434646215 /nfs/dbraw/zinc/64/62/15/1434646215.db2.gz BKVJAMOQVPHIBR-WIYYLYMNSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000269441455 1434646218 /nfs/dbraw/zinc/64/62/18/1434646218.db2.gz BKVJAMOQVPHIBR-WIYYLYMNSA-N 2 1 383.540 3.134 20 0 GGADMP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000269704639 1434670784 /nfs/dbraw/zinc/67/07/84/1434670784.db2.gz QJYSRBCGWRDHGF-JTHBVZDNSA-N 2 1 381.564 3.374 20 0 GGADMP Cc1[nH+]ccn1CCC[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1 ZINC000270616577 1434750998 /nfs/dbraw/zinc/75/09/98/1434750998.db2.gz JHCIVJUUXDAEBO-UHFFFAOYSA-N 2 1 376.888 3.291 20 0 GGADMP CC[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000270703754 1434764043 /nfs/dbraw/zinc/76/40/43/1434764043.db2.gz JDOLHMDSUSOOOD-KXBFYZLASA-N 2 1 396.938 3.255 20 0 GGADMP CC[NH+]1CCC(NC(=O)NC[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000270703750 1434764163 /nfs/dbraw/zinc/76/41/63/1434764163.db2.gz JDOLHMDSUSOOOD-BEFAXECRSA-N 2 1 396.938 3.255 20 0 GGADMP Cn1c2cc(Cl)ccc2nc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000271183554 1434806734 /nfs/dbraw/zinc/80/67/34/1434806734.db2.gz LFXOCILEPQOFPP-UHFFFAOYSA-N 2 1 376.932 3.304 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cscn1 ZINC000271184650 1434806770 /nfs/dbraw/zinc/80/67/70/1434806770.db2.gz WMWJFDBOHFTZHW-MRXNPFEDSA-N 2 1 375.538 3.484 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1cscn1 ZINC000271184650 1434806771 /nfs/dbraw/zinc/80/67/71/1434806771.db2.gz WMWJFDBOHFTZHW-MRXNPFEDSA-N 2 1 375.538 3.484 20 0 GGADMP CC(C)[NH+]1CCN(C2CC[NH+](Cc3ccc(OC(F)F)c(F)c3)CC2)CC1 ZINC000271194544 1434807405 /nfs/dbraw/zinc/80/74/05/1434807405.db2.gz HDAQRPQIOPJRAY-UHFFFAOYSA-N 2 1 385.474 3.418 20 0 GGADMP C[C@@H](CC[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1)[NH+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000271217733 1434808905 /nfs/dbraw/zinc/80/89/05/1434808905.db2.gz JEFXBRUQUOUFRN-CTWRKMMKSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[NH+]1CC[C@@H](C)[C@H](n2ccnc2)C1)[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000271217733 1434808907 /nfs/dbraw/zinc/80/89/07/1434808907.db2.gz JEFXBRUQUOUFRN-CTWRKMMKSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[NH+]1CC[C@@H](C)[C@H](n2ccnc2)C1)[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000271217733 1434808908 /nfs/dbraw/zinc/80/89/08/1434808908.db2.gz JEFXBRUQUOUFRN-CTWRKMMKSA-N 2 1 384.572 3.324 20 0 GGADMP COc1cc(OC)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1Cl ZINC000271515248 1434831055 /nfs/dbraw/zinc/83/10/55/1434831055.db2.gz OLYQTYLWKFSFPR-VHSSKADRSA-N 2 1 382.932 3.386 20 0 GGADMP C[NH+](CCCn1ccnc1)Cc1ccccc1C[N@@H+](C)CCCn1ccnc1 ZINC000271726380 1434846473 /nfs/dbraw/zinc/84/64/73/1434846473.db2.gz SNLOGZIZWCDQLB-UHFFFAOYSA-N 2 1 380.540 3.124 20 0 GGADMP C[C@@H](NC(=O)NC1CC[NH+](C(C)(C)C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272212419 1434878308 /nfs/dbraw/zinc/87/83/08/1434878308.db2.gz QJJNJXTXVZUVQT-QUCCMNQESA-N 2 1 386.584 3.459 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272270336 1434882987 /nfs/dbraw/zinc/88/29/87/1434882987.db2.gz CZDGXYOEPOWNKE-RXVVDRJESA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272270336 1434882989 /nfs/dbraw/zinc/88/29/89/1434882989.db2.gz CZDGXYOEPOWNKE-RXVVDRJESA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272270345 1434883053 /nfs/dbraw/zinc/88/30/53/1434883053.db2.gz CZDGXYOEPOWNKE-WIYYLYMNSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)N[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272270345 1434883055 /nfs/dbraw/zinc/88/30/55/1434883055.db2.gz CZDGXYOEPOWNKE-WIYYLYMNSA-N 2 1 383.540 3.134 20 0 GGADMP C[C@H]([NH2+]C1CCN(C(=O)c2ccoc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272307547 1434885969 /nfs/dbraw/zinc/88/59/69/1434885969.db2.gz IDQGIOIDJWCVLW-ICSRJNTNSA-N 2 1 381.520 3.384 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000272316912 1434886835 /nfs/dbraw/zinc/88/68/35/1434886835.db2.gz KDAFHASKTJBAPK-QZTJIDSGSA-N 2 1 389.590 3.044 20 0 GGADMP CSCC[C@@H]([NH3+])C(=O)NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000272316912 1434886836 /nfs/dbraw/zinc/88/68/36/1434886836.db2.gz KDAFHASKTJBAPK-QZTJIDSGSA-N 2 1 389.590 3.044 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272400180 1434894021 /nfs/dbraw/zinc/89/40/21/1434894021.db2.gz YSPHCUZGOQVKFJ-AJSBUHFISA-N 2 1 398.595 3.270 20 0 GGADMP c1ccc([C@H](NCCC[NH+]2CCN(c3cc[nH+]cc3)CC2)c2ccccn2)cc1 ZINC000272424070 1434895262 /nfs/dbraw/zinc/89/52/62/1434895262.db2.gz MFMSSXVEFUGJRK-DEOSSOPVSA-N 2 1 387.531 3.368 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272447589 1434897006 /nfs/dbraw/zinc/89/70/06/1434897006.db2.gz MDERSAGXOVDMSK-SXLOBPIMSA-N 2 1 384.524 3.092 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272447589 1434897007 /nfs/dbraw/zinc/89/70/07/1434897007.db2.gz MDERSAGXOVDMSK-SXLOBPIMSA-N 2 1 384.524 3.092 20 0 GGADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000272447865 1434897040 /nfs/dbraw/zinc/89/70/40/1434897040.db2.gz PENYTFWLAHGNQF-NRFANRHFSA-N 2 1 383.517 3.283 20 0 GGADMP C[N@H+]1CC[C@H]2CCN(C(=O)Nc3ccc(OCC[NH+]4CCCCC4)cc3)[C@H]2C1 ZINC000272449719 1434897201 /nfs/dbraw/zinc/89/72/01/1434897201.db2.gz PLOGFYPPXJBGNS-RXVVDRJESA-N 2 1 386.540 3.109 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000272468114 1434898327 /nfs/dbraw/zinc/89/83/27/1434898327.db2.gz HYGUMRCJLBXPML-JKLQHZFJSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272468114 1434898329 /nfs/dbraw/zinc/89/83/29/1434898329.db2.gz HYGUMRCJLBXPML-JKLQHZFJSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272468114 1434898330 /nfs/dbraw/zinc/89/83/30/1434898330.db2.gz HYGUMRCJLBXPML-JKLQHZFJSA-N 2 1 384.568 3.023 20 0 GGADMP COCC[C@@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000272508000 1434901792 /nfs/dbraw/zinc/90/17/92/1434901792.db2.gz VOKJADPDHVNYIL-GHTZIAJQSA-N 2 1 399.535 3.116 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000272534809 1434904814 /nfs/dbraw/zinc/90/48/14/1434904814.db2.gz PDWOYLSULQSAJV-UVUJQTEASA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@@H]21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272534809 1434904816 /nfs/dbraw/zinc/90/48/16/1434904816.db2.gz PDWOYLSULQSAJV-UVUJQTEASA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@@H]21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272534809 1434904819 /nfs/dbraw/zinc/90/48/19/1434904819.db2.gz PDWOYLSULQSAJV-UVUJQTEASA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H](NC(=O)N1CCC(CC[NH+](C)C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272543423 1434906128 /nfs/dbraw/zinc/90/61/28/1434906128.db2.gz QDTYTHULIFLKAY-DENIHFKCSA-N 2 1 386.584 3.270 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000272553214 1434907079 /nfs/dbraw/zinc/90/70/79/1434907079.db2.gz SWTQIEULIJWCBK-LRXVAGHRSA-N 2 1 384.520 3.237 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000272569586 1434908809 /nfs/dbraw/zinc/90/88/09/1434908809.db2.gz SWJJUWZIMRMVHY-FPOVZHCZSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@H]2C[NH+](C)CC[C@@H]21 ZINC000272579346 1434910406 /nfs/dbraw/zinc/91/04/06/1434910406.db2.gz MGKNYCNIVWVGLJ-GBAJDQEWSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@@H]21 ZINC000272579346 1434910408 /nfs/dbraw/zinc/91/04/08/1434910408.db2.gz MGKNYCNIVWVGLJ-GBAJDQEWSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21 ZINC000272579346 1434910410 /nfs/dbraw/zinc/91/04/10/1434910410.db2.gz MGKNYCNIVWVGLJ-GBAJDQEWSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(N2CCO[C@H](C)C2)nc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272691945 1434923269 /nfs/dbraw/zinc/92/32/69/1434923269.db2.gz WBSJSBDAYPEPIE-ZRCGQRJVSA-N 2 1 394.563 3.307 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(N2CCO[C@H](C)C2)nc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272691943 1434923389 /nfs/dbraw/zinc/92/33/89/1434923389.db2.gz WBSJSBDAYPEPIE-TXTKFYIRSA-N 2 1 394.563 3.307 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(N2CCO[C@H](C)C2)nc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272691944 1434923421 /nfs/dbraw/zinc/92/34/21/1434923421.db2.gz WBSJSBDAYPEPIE-VIZSFHNOSA-N 2 1 394.563 3.307 20 0 GGADMP C[C@H](C[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)NC(=O)OC(C)(C)C ZINC000272711615 1434925216 /nfs/dbraw/zinc/92/52/16/1434925216.db2.gz BKACLGMSDYPASL-HLIPFELVSA-N 2 1 391.556 3.035 20 0 GGADMP CCNC(=O)COc1cccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000272762071 1434929105 /nfs/dbraw/zinc/92/91/05/1434929105.db2.gz LTRDNKFNUNGJGV-UGKGYDQZSA-N 2 1 395.547 3.202 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(-n2cccn2)cc1 ZINC000272794030 1434931538 /nfs/dbraw/zinc/93/15/38/1434931538.db2.gz YAEIIKGCTRRMOR-MBSDFSHPSA-N 2 1 376.504 3.290 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000272822292 1434933821 /nfs/dbraw/zinc/93/38/21/1434933821.db2.gz NIIFECLSNOXPIQ-HSZRJFAPSA-N 2 1 395.547 3.025 20 0 GGADMP C[C@H](NC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272837638 1434935003 /nfs/dbraw/zinc/93/50/03/1434935003.db2.gz QUKWBPMHLISRJB-SJROBZAFSA-N 2 1 385.596 3.255 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272837638 1434935004 /nfs/dbraw/zinc/93/50/04/1434935004.db2.gz QUKWBPMHLISRJB-SJROBZAFSA-N 3 1 385.596 3.255 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272837638 1434935007 /nfs/dbraw/zinc/93/50/07/1434935007.db2.gz QUKWBPMHLISRJB-SJROBZAFSA-N 3 1 385.596 3.255 20 0 GGADMP C[C@H](NC1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272837634 1434935085 /nfs/dbraw/zinc/93/50/85/1434935085.db2.gz QUKWBPMHLISRJB-NAMDQGSHSA-N 2 1 385.596 3.255 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272837634 1434935088 /nfs/dbraw/zinc/93/50/88/1434935088.db2.gz QUKWBPMHLISRJB-NAMDQGSHSA-N 3 1 385.596 3.255 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272837634 1434935091 /nfs/dbraw/zinc/93/50/91/1434935091.db2.gz QUKWBPMHLISRJB-NAMDQGSHSA-N 3 1 385.596 3.255 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272846133 1434935666 /nfs/dbraw/zinc/93/56/66/1434935666.db2.gz SWOBNNIWAXVZIA-APWZRJJASA-N 2 1 396.539 3.028 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000272846133 1434935668 /nfs/dbraw/zinc/93/56/68/1434935668.db2.gz SWOBNNIWAXVZIA-APWZRJJASA-N 2 1 396.539 3.028 20 0 GGADMP C[C@H]([NH2+]CCCc1nnc2n1CCCCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272875616 1434938083 /nfs/dbraw/zinc/93/80/83/1434938083.db2.gz WWZPBDASHHZFQZ-FPOVZHCZSA-N 2 1 381.568 3.437 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccsc1)[NH+](C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000272889596 1434938993 /nfs/dbraw/zinc/93/89/93/1434938993.db2.gz YZWBOGPJGQKCOS-FCEWJHQRSA-N 2 1 378.586 3.303 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1)C1=CC[NH+](C)CC1 ZINC000272963378 1434944785 /nfs/dbraw/zinc/94/47/85/1434944785.db2.gz NRGXXKXVEKXJSB-WWPVKYPJSA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)C1=CC[N@H+](C)CC1 ZINC000272963378 1434944786 /nfs/dbraw/zinc/94/47/86/1434944786.db2.gz NRGXXKXVEKXJSB-WWPVKYPJSA-N 2 1 396.579 3.333 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)C1=CC[N@@H+](C)CC1 ZINC000272963378 1434944787 /nfs/dbraw/zinc/94/47/87/1434944787.db2.gz NRGXXKXVEKXJSB-WWPVKYPJSA-N 2 1 396.579 3.333 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)N[C@@H](C)C1=CC[NH+](C)CC1 ZINC000272994101 1434947711 /nfs/dbraw/zinc/94/77/11/1434947711.db2.gz QKBKVZATCHXSDA-FPOVZHCZSA-N 2 1 384.568 3.190 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@@H](C)C1=CC[N@H+](C)CC1 ZINC000272994101 1434947714 /nfs/dbraw/zinc/94/77/14/1434947714.db2.gz QKBKVZATCHXSDA-FPOVZHCZSA-N 2 1 384.568 3.190 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000272994101 1434947718 /nfs/dbraw/zinc/94/77/18/1434947718.db2.gz QKBKVZATCHXSDA-FPOVZHCZSA-N 2 1 384.568 3.190 20 0 GGADMP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000273418947 1434987680 /nfs/dbraw/zinc/98/76/80/1434987680.db2.gz KKWRSAUCMWYLLG-DXIQSLLYSA-N 2 1 386.584 3.269 20 0 GGADMP COC(=O)CCCN1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000274215648 1435051982 /nfs/dbraw/zinc/05/19/82/1435051982.db2.gz OOWGXTIBQVSACN-KNQAVFIVSA-N 2 1 387.568 3.047 20 0 GGADMP COC(=O)CCCN1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000274215648 1435051985 /nfs/dbraw/zinc/05/19/85/1435051985.db2.gz OOWGXTIBQVSACN-KNQAVFIVSA-N 2 1 387.568 3.047 20 0 GGADMP COC(=O)CCCN1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000274215653 1435052187 /nfs/dbraw/zinc/05/21/87/1435052187.db2.gz OOWGXTIBQVSACN-SIKLNZKXSA-N 2 1 387.568 3.047 20 0 GGADMP COC(=O)CCCN1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000274215653 1435052189 /nfs/dbraw/zinc/05/21/89/1435052189.db2.gz OOWGXTIBQVSACN-SIKLNZKXSA-N 2 1 387.568 3.047 20 0 GGADMP CC[NH+](CC)[C@H](CNC1CC[NH+](CCCC(=O)OC)CC1)c1ccsc1 ZINC000274247772 1435054562 /nfs/dbraw/zinc/05/45/62/1435054562.db2.gz XWIWVNYTQDYFFS-LJQANCHMSA-N 2 1 381.586 3.138 20 0 GGADMP COc1ccc(-c2ccncc2)cc1C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1 ZINC000274759517 1435090305 /nfs/dbraw/zinc/09/03/05/1435090305.db2.gz GMGLYLUCORXNLA-VXKWHMMOSA-N 2 1 381.520 3.225 20 0 GGADMP CC(=O)c1cccc(OC[C@H](O)C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000274784940 1435092282 /nfs/dbraw/zinc/09/22/82/1435092282.db2.gz AQUHYMPEIDBYHM-ANJVHQHFSA-N 2 1 396.531 3.129 20 0 GGADMP CC(=O)c1cccc(OC[C@H](O)C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000274784948 1435092335 /nfs/dbraw/zinc/09/23/35/1435092335.db2.gz AQUHYMPEIDBYHM-XANCMCCPSA-N 2 1 396.531 3.129 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NC[C@H](C)c2ccccc2)[C@@H](C)C1 ZINC000274821178 1435095393 /nfs/dbraw/zinc/09/53/93/1435095393.db2.gz GXTBTBKFUKNMCY-KEZQHZCBSA-N 2 1 389.584 3.021 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NC[C@H](C)c2ccccc2)[C@@H](C)C1 ZINC000274821178 1435095395 /nfs/dbraw/zinc/09/53/95/1435095395.db2.gz GXTBTBKFUKNMCY-KEZQHZCBSA-N 2 1 389.584 3.021 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+]Cc2ccc(-c3ccc(C(=O)OC)cc3)o2)CC1 ZINC000274836539 1435096808 /nfs/dbraw/zinc/09/68/08/1435096808.db2.gz LDBXBGPSWPIQOW-UHFFFAOYSA-N 2 1 399.535 3.241 20 0 GGADMP COc1ccccc1COC[C@H](O)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000274854454 1435098134 /nfs/dbraw/zinc/09/81/34/1435098134.db2.gz RXDVFZRFYRWGEQ-UEVCKROQSA-N 2 1 398.547 3.073 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(OCC(=O)N(C)C)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274892437 1435101655 /nfs/dbraw/zinc/10/16/55/1435101655.db2.gz JPHSBFPRKKCBMV-KNQAVFIVSA-N 2 1 395.547 3.154 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1Cn1cncn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274894724 1435101779 /nfs/dbraw/zinc/10/17/79/1435101779.db2.gz JZQIFEHTJSAMRW-UGKGYDQZSA-N 2 1 375.520 3.327 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000274927823 1435104078 /nfs/dbraw/zinc/10/40/78/1435104078.db2.gz QFMRSGQCVFQHMV-GEQKSPFYSA-N 2 1 384.520 3.237 20 0 GGADMP Cn1cncc1[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)CCO1 ZINC000275399706 1435136707 /nfs/dbraw/zinc/13/67/07/1435136707.db2.gz CJSMYNBCYKSRNQ-VZWAGXQNSA-N 2 1 380.536 3.140 20 0 GGADMP Cc1ccc2cc(C[NH2+]Cc3ccc(C(=O)N4CC[NH+](C)CC4)cc3)ccc2n1 ZINC000275571779 1435149496 /nfs/dbraw/zinc/14/94/96/1435149496.db2.gz GNBDERWJLNTDHT-UHFFFAOYSA-N 2 1 388.515 3.221 20 0 GGADMP Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000275606927 1435152413 /nfs/dbraw/zinc/15/24/13/1435152413.db2.gz QSNYFGVXMXJGPA-GMAHTHKFSA-N 2 1 382.552 3.164 20 0 GGADMP C[NH+]1CCN(C(=O)c2ccc(C[NH2+][C@H]3CCC[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000275685681 1435159518 /nfs/dbraw/zinc/15/95/18/1435159518.db2.gz ZVMMFHNVBDOWKU-ROUUACIJSA-N 2 1 383.458 3.285 20 0 GGADMP C[NH+]1CCN(C(=O)c2ccc(C[NH2+][C@@H]3CCC[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000275685683 1435159548 /nfs/dbraw/zinc/15/95/48/1435159548.db2.gz ZVMMFHNVBDOWKU-ZWKOTPCHSA-N 2 1 383.458 3.285 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NC(=O)Nc2ccccc2CC[NH+](C)C)[C@H](C)C1 ZINC000275716917 1435162409 /nfs/dbraw/zinc/16/24/09/1435162409.db2.gz VKSXNZVBLPGPOM-UYAOXDASSA-N 2 1 390.572 3.049 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC(=O)Nc2ccccc2CC[NH+](C)C)[C@@H](C)C1 ZINC000275716912 1435162447 /nfs/dbraw/zinc/16/24/47/1435162447.db2.gz VKSXNZVBLPGPOM-ICSRJNTNSA-N 2 1 390.572 3.049 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NC(=O)Nc2ccccc2CC[NH+](C)C)[C@@H](C)C1 ZINC000275716908 1435162515 /nfs/dbraw/zinc/16/25/15/1435162515.db2.gz VKSXNZVBLPGPOM-AZUAARDMSA-N 2 1 390.572 3.049 20 0 GGADMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)Nc3ccc(C[NH+](C)C)cc3)c2C1 ZINC000275725669 1435163205 /nfs/dbraw/zinc/16/32/05/1435163205.db2.gz OUVQPIGKAXIEJZ-UHFFFAOYSA-N 2 1 380.492 3.051 20 0 GGADMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)Nc3ccc(C[NH+](C)C)cc3)c2C1 ZINC000275725669 1435163207 /nfs/dbraw/zinc/16/32/07/1435163207.db2.gz OUVQPIGKAXIEJZ-UHFFFAOYSA-N 2 1 380.492 3.051 20 0 GGADMP C[NH+](C)CCc1ccccc1NC(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000275736368 1435163922 /nfs/dbraw/zinc/16/39/22/1435163922.db2.gz YEDPJMYOMSFSGC-UHFFFAOYSA-N 2 1 380.536 3.183 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N(C)Cc2ccccc2C)[C@H](C)C1 ZINC000276286944 1435202520 /nfs/dbraw/zinc/20/25/20/1435202520.db2.gz VBPUUWHMQBJGQP-URVUXULASA-N 2 1 389.584 3.069 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)N(C)Cc2ccccc2C)[C@H](C)C1 ZINC000276286944 1435202524 /nfs/dbraw/zinc/20/25/24/1435202524.db2.gz VBPUUWHMQBJGQP-URVUXULASA-N 2 1 389.584 3.069 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc2c(c1)CC[NH2+]CC2 ZINC000276600597 1435220067 /nfs/dbraw/zinc/22/00/67/1435220067.db2.gz KGFKUVSHBROSQZ-KRWDZBQOSA-N 2 1 383.561 3.078 20 0 GGADMP C[C@H](c1ccc(NC(=O)c2ccc3c(c2)CC[NH2+]CC3)cc1)[NH+]1CCOCC1 ZINC000276671662 1435224301 /nfs/dbraw/zinc/22/43/01/1435224301.db2.gz RUPTZXWLJWNBHM-QGZVFWFLSA-N 2 1 379.504 3.020 20 0 GGADMP O=C(Nc1ccccc1C[NH+]1CCSCC1)c1ccc2c(c1)CC[NH2+]CC2 ZINC000276735081 1435228821 /nfs/dbraw/zinc/22/88/21/1435228821.db2.gz YUOLUILDMNPOJK-UHFFFAOYSA-N 2 1 381.545 3.176 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccn([C@H]3CCC[NH2+]C3)n2)cc1 ZINC000276737757 1435228968 /nfs/dbraw/zinc/22/89/68/1435228968.db2.gz AKWNZCPJFIKJIR-XLIONFOSSA-N 2 1 381.524 3.434 20 0 GGADMP COc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1O ZINC000276968384 1435248166 /nfs/dbraw/zinc/24/81/66/1435248166.db2.gz CMIXURSQFVQSLC-LAUBAEHRSA-N 2 1 384.520 3.078 20 0 GGADMP COc1ccc(CC[C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1O ZINC000276968380 1435248188 /nfs/dbraw/zinc/24/81/88/1435248188.db2.gz CMIXURSQFVQSLC-DYESRHJHSA-N 2 1 384.520 3.078 20 0 GGADMP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]C4CCN(c5cccnn5)CC4)[C@@H]3C2)cc1 ZINC000277032549 1435254155 /nfs/dbraw/zinc/25/41/55/1435254155.db2.gz FKSKHDDEQRLMQU-MDNUFGMLSA-N 2 1 391.563 3.336 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)C(=O)N[C@H](C)c1ccccc1OC ZINC000277223930 1435281035 /nfs/dbraw/zinc/28/10/35/1435281035.db2.gz OFEQOQQVUSWKPR-QZTJIDSGSA-N 2 1 386.540 3.432 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)C(=O)N[C@H](C)c1ccccc1OC ZINC000277223930 1435281042 /nfs/dbraw/zinc/28/10/42/1435281042.db2.gz OFEQOQQVUSWKPR-QZTJIDSGSA-N 2 1 386.540 3.432 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000277364737 1435298973 /nfs/dbraw/zinc/29/89/73/1435298973.db2.gz UZOKOXUAUXVUAV-QUCCMNQESA-N 2 1 397.485 3.384 20 0 GGADMP COc1cc2c(cc1OC)C[N@H+](Cc1ccccc1NC(=O)CC[C@H](C)[NH3+])CC2 ZINC000277430228 1435304098 /nfs/dbraw/zinc/30/40/98/1435304098.db2.gz CDYXIMLOXJGYRR-INIZCTEOSA-N 2 1 397.519 3.328 20 0 GGADMP COc1cc2c(cc1OC)C[N@@H+](Cc1ccccc1NC(=O)CC[C@H](C)[NH3+])CC2 ZINC000277430228 1435304103 /nfs/dbraw/zinc/30/41/03/1435304103.db2.gz CDYXIMLOXJGYRR-INIZCTEOSA-N 2 1 397.519 3.328 20 0 GGADMP COc1ccc(C[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1OCc1cccnc1 ZINC000277646365 1435318740 /nfs/dbraw/zinc/31/87/40/1435318740.db2.gz DGZVMGWWCMUOSO-IBGZPJMESA-N 2 1 399.535 3.260 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000278082095 1435357298 /nfs/dbraw/zinc/35/72/98/1435357298.db2.gz PEKPYXOYFZURCZ-WIYYLYMNSA-N 2 1 384.568 3.213 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)NCC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000278082064 1435357351 /nfs/dbraw/zinc/35/73/51/1435357351.db2.gz PEKPYXOYFZURCZ-NQIIRXRSSA-N 2 1 384.568 3.213 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(OCc2nccn2C)cc1 ZINC000278363127 1435383970 /nfs/dbraw/zinc/38/39/70/1435383970.db2.gz BMDUAHMERJCHLX-MOPGFXCFSA-N 2 1 386.540 3.151 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1Cn1cccn1 ZINC000278371587 1435384883 /nfs/dbraw/zinc/38/48/83/1435384883.db2.gz BZGHCNPNMKHCLI-OALUTQOASA-N 2 1 386.540 3.092 20 0 GGADMP Cn1nccc1N1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000278506206 1435395709 /nfs/dbraw/zinc/39/57/09/1435395709.db2.gz QXSGYZRRQOKWSR-YSFYHYPLSA-N 2 1 379.552 3.174 20 0 GGADMP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)c(Cl)c1 ZINC000278611097 1435405282 /nfs/dbraw/zinc/40/52/82/1435405282.db2.gz RGGBWKAPYOAMCX-SJORKVTESA-N 2 1 381.948 3.456 20 0 GGADMP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)c(Cl)c1 ZINC000278611097 1435405283 /nfs/dbraw/zinc/40/52/83/1435405283.db2.gz RGGBWKAPYOAMCX-SJORKVTESA-N 2 1 381.948 3.456 20 0 GGADMP COC(=O)c1coc([C@@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)c1 ZINC000278839666 1435429406 /nfs/dbraw/zinc/42/94/06/1435429406.db2.gz UTGLUPBDEGBQBP-CQSZACIVSA-N 2 1 375.469 3.234 20 0 GGADMP O=C(CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)N1CCc2ccccc21 ZINC000278860135 1435432172 /nfs/dbraw/zinc/43/21/72/1435432172.db2.gz LBNYXEBSIGXRHA-UHFFFAOYSA-N 2 1 378.520 3.378 20 0 GGADMP O=C(CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)Nc1ccc2c(c1)OCO2 ZINC000278901030 1435437419 /nfs/dbraw/zinc/43/74/19/1435437419.db2.gz PIRBEEGAFDNCEV-UHFFFAOYSA-N 2 1 396.491 3.156 20 0 GGADMP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2CCc3[nH+]ccn3C2)cc1 ZINC000278943237 1435443024 /nfs/dbraw/zinc/44/30/24/1435443024.db2.gz KLTZIXKTILLHEV-YZGWKJHDSA-N 2 1 387.549 3.129 20 0 GGADMP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2[NH2+]C[C@@H]2CCc3[nH+]ccn3C2)cc1 ZINC000278943234 1435443077 /nfs/dbraw/zinc/44/30/77/1435443077.db2.gz KLTZIXKTILLHEV-YSIASYRMSA-N 2 1 387.549 3.129 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)[C@H]2CCC[NH+]2C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000279862197 1435554386 /nfs/dbraw/zinc/55/43/86/1435554386.db2.gz MPNYQNKEGAYMQG-NIKGAXFTSA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)[C@H]2CCC[N@@H+]2C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000279862197 1435554390 /nfs/dbraw/zinc/55/43/90/1435554390.db2.gz MPNYQNKEGAYMQG-NIKGAXFTSA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)[C@H]2CCC[N@H+]2C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000279862197 1435554394 /nfs/dbraw/zinc/55/43/94/1435554394.db2.gz MPNYQNKEGAYMQG-NIKGAXFTSA-N 2 1 379.907 3.215 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H](c3cccnc3)C3CCC3)c2)C1 ZINC000280923690 1435742152 /nfs/dbraw/zinc/74/21/52/1435742152.db2.gz RFTQNJXVYLGTLR-PKTZIBPZSA-N 2 1 392.547 3.410 20 0 GGADMP Cc1noc(C2CCC([NH2+]Cc3cccc(C[N@@H+]4CCO[C@@H](C)C4)c3)CC2)n1 ZINC000280929240 1435743458 /nfs/dbraw/zinc/74/34/58/1435743458.db2.gz HBHCGCFKFLSBIT-ATIQYGATSA-N 2 1 384.524 3.415 20 0 GGADMP Cc1noc(C2CCC([NH2+]Cc3cccc(C[N@H+]4CCO[C@@H](C)C4)c3)CC2)n1 ZINC000280929240 1435743464 /nfs/dbraw/zinc/74/34/64/1435743464.db2.gz HBHCGCFKFLSBIT-ATIQYGATSA-N 2 1 384.524 3.415 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H](c3cncc(F)c3)C3CC3)c2)C1 ZINC000281172531 1435788935 /nfs/dbraw/zinc/78/89/35/1435788935.db2.gz HYZKTSQETQFGID-KNQAVFIVSA-N 2 1 396.510 3.159 20 0 GGADMP [NH3+]CC[C@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000281611025 1435815610 /nfs/dbraw/zinc/81/56/10/1435815610.db2.gz BFFJHSUGVAMFHP-IEBWSBKVSA-N 2 1 383.458 3.028 20 0 GGADMP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000282149940 1435836487 /nfs/dbraw/zinc/83/64/87/1435836487.db2.gz LBWQBPHGTAXGJZ-OFNKIYASSA-N 2 1 390.568 3.471 20 0 GGADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000282149935 1435836577 /nfs/dbraw/zinc/83/65/77/1435836577.db2.gz LBWQBPHGTAXGJZ-NZQKXSOJSA-N 2 1 390.568 3.471 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1=CC[NH+](C)CC1 ZINC000282703432 1435857012 /nfs/dbraw/zinc/85/70/12/1435857012.db2.gz JMGXBFCCQFVFIH-GHTZIAJQSA-N 2 1 384.568 3.237 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)CC1(C)C)C1=CC[N@H+](C)CC1 ZINC000282703432 1435857013 /nfs/dbraw/zinc/85/70/13/1435857013.db2.gz JMGXBFCCQFVFIH-GHTZIAJQSA-N 2 1 384.568 3.237 20 0 GGADMP C[C@H](NC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)CC1(C)C)C1=CC[N@@H+](C)CC1 ZINC000282703432 1435857014 /nfs/dbraw/zinc/85/70/14/1435857014.db2.gz JMGXBFCCQFVFIH-GHTZIAJQSA-N 2 1 384.568 3.237 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825296 1435861879 /nfs/dbraw/zinc/86/18/79/1435861879.db2.gz JGVMXJCKXNWRSU-SFTDATJTSA-N 2 1 386.584 3.270 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825296 1435861880 /nfs/dbraw/zinc/86/18/80/1435861880.db2.gz JGVMXJCKXNWRSU-SFTDATJTSA-N 2 1 386.584 3.270 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000282825296 1435861881 /nfs/dbraw/zinc/86/18/81/1435861881.db2.gz JGVMXJCKXNWRSU-SFTDATJTSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)N[C@H]1CC[NH+](Cc2ccccc2)CC1(C)C ZINC000282998262 1435869647 /nfs/dbraw/zinc/86/96/47/1435869647.db2.gz QWYVNRFNBRMGNW-NRSPTQNISA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@H]1N(C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000282998262 1435869648 /nfs/dbraw/zinc/86/96/48/1435869648.db2.gz QWYVNRFNBRMGNW-NRSPTQNISA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@H]1N(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282998262 1435869649 /nfs/dbraw/zinc/86/96/49/1435869649.db2.gz QWYVNRFNBRMGNW-NRSPTQNISA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[NH2+]C1CCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000283098693 1435874367 /nfs/dbraw/zinc/87/43/67/1435874367.db2.gz ZQUPLZOCMSVFDS-NRFANRHFSA-N 2 1 386.584 3.459 20 0 GGADMP CCOC(=O)[C@H]1CC[C@@H]([NH2+]CCCCN2CC[NH+](CC)CC2)c2ccccc21 ZINC000283167089 1435877555 /nfs/dbraw/zinc/87/75/55/1435877555.db2.gz IXNXUQPMDIGDBX-FCHUYYIVSA-N 2 1 387.568 3.176 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]CCCCN2CC[NH+](CC)CC2)c2ccccc21 ZINC000283167093 1435877571 /nfs/dbraw/zinc/87/75/71/1435877571.db2.gz IXNXUQPMDIGDBX-FGZHOGPDSA-N 2 1 387.568 3.176 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)c2ccccc21 ZINC000283189470 1435878437 /nfs/dbraw/zinc/87/84/37/1435878437.db2.gz KLKHDXBMGSRYEZ-NHCUHLMSSA-N 2 1 386.536 3.403 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000283248539 1435881147 /nfs/dbraw/zinc/88/11/47/1435881147.db2.gz JSPWOJNINZTCSZ-FIDNPTQWSA-N 2 1 386.628 3.149 20 0 GGADMP CC(C)[NH+]1CCN(CCC[NH2+][C@H]2[C@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1 ZINC000283248539 1435881148 /nfs/dbraw/zinc/88/11/48/1435881148.db2.gz JSPWOJNINZTCSZ-FIDNPTQWSA-N 2 1 386.628 3.149 20 0 GGADMP O[C@@H]1[C@H](C[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CCC12CCOCC2 ZINC000283468539 1435891246 /nfs/dbraw/zinc/89/12/46/1435891246.db2.gz WAVSNMQABCCXSI-LHGONGGSSA-N 2 1 384.564 3.054 20 0 GGADMP Cc1ccc(NC(=O)c2ccc3c[nH+]cn3c2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000283936835 1435956555 /nfs/dbraw/zinc/95/65/55/1435956555.db2.gz MOUSEAJNOIGTIS-UHFFFAOYSA-N 2 1 391.475 3.319 20 0 GGADMP c1ccc(C[N@H+]2CCCO[C@H](CN3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)C2)cc1 ZINC000284104625 1435990944 /nfs/dbraw/zinc/99/09/44/1435990944.db2.gz MSIQCXNVTXSKLY-NHTMILBNSA-N 2 1 383.580 3.226 20 0 GGADMP CCc1nn(C)c(Cl)c1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000284115967 1435993508 /nfs/dbraw/zinc/99/35/08/1435993508.db2.gz SXLHQTOWVJJEOU-UHFFFAOYSA-N 2 1 376.932 3.399 20 0 GGADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000284293453 1436010706 /nfs/dbraw/zinc/01/07/06/1436010706.db2.gz YDGVYGDMIBRDLZ-UYAOXDASSA-N 2 1 387.568 3.396 20 0 GGADMP C(c1nc2sc3c(c2c(N2CC[C@H]4[NH2+]CC[C@H]42)n1)CCCC3)[NH+]1CCCCC1 ZINC001164411260 718875760 /nfs/dbraw/zinc/87/57/60/718875760.db2.gz OZBJAJFHJOTZCQ-IAGOWNOFSA-N 2 1 397.592 3.497 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CC[C@H]5[NH2+]CC[C@@H]54)c23)C1 ZINC001164412793 718876241 /nfs/dbraw/zinc/87/62/41/718876241.db2.gz ZFGJHHATWNICON-OIISXLGYSA-N 2 1 397.592 3.353 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CC[C@@H]3[NH2+]CC[C@@H]32)n1 ZINC001164411750 718876569 /nfs/dbraw/zinc/87/65/69/718876569.db2.gz RZISNGYJPGJGDZ-IRXDYDNUSA-N 2 1 379.533 3.361 20 0 GGADMP [NH3+][C@]12C[C@H]1CCN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164421081 718896273 /nfs/dbraw/zinc/89/62/73/718896273.db2.gz PKUQUEOAANHINH-QRQCRPRQSA-N 2 1 397.592 3.484 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CC[C@H]5C[C@@]5([NH3+])C3)n2)CCC4)CC1 ZINC001164418236 718896335 /nfs/dbraw/zinc/89/63/35/718896335.db2.gz CJEYAHAKAQOOCU-OYHNWAKOSA-N 2 1 397.592 3.339 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CC[C@H]5C[C@@]5([NH3+])C4)c23)C1 ZINC001164418596 718896474 /nfs/dbraw/zinc/89/64/74/718896474.db2.gz DJKRJIVQBIENQV-ZCCHDVMBSA-N 2 1 397.592 3.339 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CC[C@@H]5C[C@]5([NH3+])C4)c23)C1 ZINC001164418595 718896523 /nfs/dbraw/zinc/89/65/23/718896523.db2.gz DJKRJIVQBIENQV-HLFMIMNKSA-N 2 1 397.592 3.339 20 0 GGADMP c1ccc(C[N@@H+]2CCc3c(ncnc3N3C[C@H]4[NH2+]Cc5ccccc5[C@H]4C3)C2)cc1 ZINC001164425176 718941998 /nfs/dbraw/zinc/94/19/98/718941998.db2.gz SRKLKARVFQRBLE-ISKFKSNPSA-N 2 1 397.526 3.111 20 0 GGADMP c1ccc(C[N@H+]2CCc3c(ncnc3N3C[C@H]4[NH2+]Cc5ccccc5[C@H]4C3)C2)cc1 ZINC001164425176 718942000 /nfs/dbraw/zinc/94/20/00/718942000.db2.gz SRKLKARVFQRBLE-ISKFKSNPSA-N 2 1 397.526 3.111 20 0 GGADMP c1ccc(C[N@@H+]2CCc3c(ncnc3N3C[C@@H]4[NH2+]Cc5ccccc5[C@@H]4C3)C2)cc1 ZINC001164425178 718942090 /nfs/dbraw/zinc/94/20/90/718942090.db2.gz SRKLKARVFQRBLE-UPVQGACJSA-N 2 1 397.526 3.111 20 0 GGADMP c1ccc(C[N@H+]2CCc3c(ncnc3N3C[C@@H]4[NH2+]Cc5ccccc5[C@@H]4C3)C2)cc1 ZINC001164425178 718942091 /nfs/dbraw/zinc/94/20/91/718942091.db2.gz SRKLKARVFQRBLE-UPVQGACJSA-N 2 1 397.526 3.111 20 0 GGADMP C[C@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4C[C@@H]5[C@@H]([NH3+])[C@@H]5C4)c23)C1 ZINC001164440934 718986252 /nfs/dbraw/zinc/98/62/52/718986252.db2.gz SWSFOAMQAJXRNR-WBZSCFCESA-N 2 1 397.592 3.195 20 0 GGADMP C(c1nc2sc3c(c2c(N2CCC[C@@H]4[NH2+]C[C@H]42)n1)CCC3)[NH+]1CCCCC1 ZINC001164448434 718999722 /nfs/dbraw/zinc/99/97/22/718999722.db2.gz IBYJTXTZQQFBRE-JKSUJKDBSA-N 2 1 383.565 3.107 20 0 GGADMP C[NH+](C)Cc1nc2scc(-c3ccccc3)c2c(N2CCC[C@H]3[NH2+]C[C@H]32)n1 ZINC001164448265 719001977 /nfs/dbraw/zinc/00/19/77/719001977.db2.gz GQNTVUHDTUNOQP-IAGOWNOFSA-N 2 1 379.533 3.361 20 0 GGADMP CCOC(=O)C1CC[NH+](C2CCN(c3[nH+]ccc4cc(OC)ccc43)CC2)CC1 ZINC001164613781 719023185 /nfs/dbraw/zinc/02/31/85/719023185.db2.gz DMPPKNNALPDLHC-UHFFFAOYSA-N 2 1 397.519 3.487 20 0 GGADMP C[NH+]1CCC(Oc2ccnc(N3CC[C@@]4(C[NH2+]C[C@@H]4c4ccccc4)C3)c2)CC1 ZINC001164619621 719048826 /nfs/dbraw/zinc/04/88/26/719048826.db2.gz CZBKUUWMIDMURJ-ISKFKSNPSA-N 2 1 392.547 3.138 20 0 GGADMP Clc1cc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c2c(n1)C[NH2+]CC2 ZINC001164629893 719093432 /nfs/dbraw/zinc/09/34/32/719093432.db2.gz UCNHHZGWWCFZSM-DYESRHJHSA-N 2 1 382.939 3.482 20 0 GGADMP Clc1cc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c2c(n1)C[NH2+]CC2 ZINC001164629895 719094443 /nfs/dbraw/zinc/09/44/43/719094443.db2.gz UCNHHZGWWCFZSM-LAUBAEHRSA-N 2 1 382.939 3.482 20 0 GGADMP COc1ccc2nc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)c(C)cc2c1 ZINC001164683245 719602621 /nfs/dbraw/zinc/60/26/21/719602621.db2.gz HXOXOKLIAFKJME-UHFFFAOYSA-N 2 1 379.508 3.223 20 0 GGADMP COc1ccc2nc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)c(C)cc2c1 ZINC001164683245 719602630 /nfs/dbraw/zinc/60/26/30/719602630.db2.gz HXOXOKLIAFKJME-UHFFFAOYSA-N 2 1 379.508 3.223 20 0 GGADMP Cc1cc(C(F)(F)n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)cc(Cl)n1 ZINC001164686209 719606210 /nfs/dbraw/zinc/60/62/10/719606210.db2.gz ZIRTVOVOKPGJPL-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP Cc1cc(C(F)(F)n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)cc(Cl)n1 ZINC001164686209 719606216 /nfs/dbraw/zinc/60/62/16/719606216.db2.gz ZIRTVOVOKPGJPL-UHFFFAOYSA-N 2 1 383.874 3.323 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2ccc(-c3ccc(Cl)cc3)nn2)c2c1CC[NH2+]C2 ZINC001164683221 719606916 /nfs/dbraw/zinc/60/69/16/719606916.db2.gz HUOWLUWMWZIORA-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2ccc(-c3ccc(Cl)cc3)nn2)c2c1CC[NH2+]C2 ZINC001164683221 719606935 /nfs/dbraw/zinc/60/69/35/719606935.db2.gz HUOWLUWMWZIORA-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)c2ccc(F)c(Cl)n2)c2c1CC[NH2+]C2 ZINC001164683039 719608166 /nfs/dbraw/zinc/60/81/66/719608166.db2.gz HFVQMTYHLNVTNW-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)c2ccc(F)c(Cl)n2)c2c1CC[NH2+]C2 ZINC001164683039 719608174 /nfs/dbraw/zinc/60/81/74/719608174.db2.gz HFVQMTYHLNVTNW-UHFFFAOYSA-N 2 1 387.837 3.154 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2cc(-c3ccnc(Cl)c3)ccn2)c2c1CC[NH2+]C2 ZINC001164685896 719612576 /nfs/dbraw/zinc/61/25/76/719612576.db2.gz WZNDYNIEQXZPMW-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2cc(-c3ccnc(Cl)c3)ccn2)c2c1CC[NH2+]C2 ZINC001164685896 719612585 /nfs/dbraw/zinc/61/25/85/719612585.db2.gz WZNDYNIEQXZPMW-UHFFFAOYSA-N 2 1 396.926 3.469 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2csc3ncnc(Cl)c23)c2c1CC[NH2+]C2 ZINC001164685019 719616871 /nfs/dbraw/zinc/61/68/71/719616871.db2.gz QDWGUIXEWJLPKP-UHFFFAOYSA-N 2 1 376.917 3.016 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2csc3ncnc(Cl)c23)c2c1CC[NH2+]C2 ZINC001164685019 719616872 /nfs/dbraw/zinc/61/68/72/719616872.db2.gz QDWGUIXEWJLPKP-UHFFFAOYSA-N 2 1 376.917 3.016 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(C(F)(F)COc2ccnc(Cl)c2)c2c1CC[NH2+]C2 ZINC001164684875 719619500 /nfs/dbraw/zinc/61/95/00/719619500.db2.gz YKCKOFXEZIUEPP-UHFFFAOYSA-N 2 1 399.873 3.046 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(C(F)(F)COc2ccnc(Cl)c2)c2c1CC[NH2+]C2 ZINC001164684875 719619511 /nfs/dbraw/zinc/61/95/11/719619511.db2.gz YKCKOFXEZIUEPP-UHFFFAOYSA-N 2 1 399.873 3.046 20 0 GGADMP COc1ccc(C(F)(F)n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1Cl ZINC001164684665 719628396 /nfs/dbraw/zinc/62/83/96/719628396.db2.gz WANGAWWXQSMRDZ-UHFFFAOYSA-N 2 1 399.873 3.024 20 0 GGADMP COc1ccc(C(F)(F)n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)nc1Cl ZINC001164684665 719628407 /nfs/dbraw/zinc/62/84/07/719628407.db2.gz WANGAWWXQSMRDZ-UHFFFAOYSA-N 2 1 399.873 3.024 20 0 GGADMP Cc1nc2c3ccccc3oc2c(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164684687 719628923 /nfs/dbraw/zinc/62/89/23/719628923.db2.gz WGDIGGDCCIUXER-UHFFFAOYSA-N 2 1 390.491 3.356 20 0 GGADMP Cc1nc2c3ccccc3oc2c(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164684687 719628931 /nfs/dbraw/zinc/62/89/31/719628931.db2.gz WGDIGGDCCIUXER-UHFFFAOYSA-N 2 1 390.491 3.356 20 0 GGADMP Cc1nc(C(F)(F)n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)nc(Cl)c1C ZINC001164683415 719629718 /nfs/dbraw/zinc/62/97/18/719629718.db2.gz SHGKYJDMDCCXPU-UHFFFAOYSA-N 2 1 398.889 3.027 20 0 GGADMP Cc1nc(C(F)(F)n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)nc(Cl)c1C ZINC001164683415 719629730 /nfs/dbraw/zinc/62/97/30/719629730.db2.gz SHGKYJDMDCCXPU-UHFFFAOYSA-N 2 1 398.889 3.027 20 0 GGADMP CCc1ccc(-c2ccc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)nn2)cc1 ZINC001164679601 719644773 /nfs/dbraw/zinc/64/47/73/719644773.db2.gz ILKLILFRDKNYKV-UHFFFAOYSA-N 2 1 390.535 3.378 20 0 GGADMP CCc1ccc(-c2ccc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)nn2)cc1 ZINC001164679601 719644791 /nfs/dbraw/zinc/64/47/91/719644791.db2.gz ILKLILFRDKNYKV-UHFFFAOYSA-N 2 1 390.535 3.378 20 0 GGADMP COc1cc2ccnc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)c2cc1F ZINC001164680355 719649103 /nfs/dbraw/zinc/64/91/03/719649103.db2.gz FZAUVTMMDWPNDE-UHFFFAOYSA-N 2 1 383.471 3.054 20 0 GGADMP COc1cc2ccnc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)c2cc1F ZINC001164680355 719649108 /nfs/dbraw/zinc/64/91/08/719649108.db2.gz FZAUVTMMDWPNDE-UHFFFAOYSA-N 2 1 383.471 3.054 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2c(Cl)nc(Cl)nc2C2CC2)c2c1CC[NH2+]C2 ZINC001164681366 719651808 /nfs/dbraw/zinc/65/18/08/719651808.db2.gz MNJMNJRPOLZTCX-UHFFFAOYSA-N 2 1 395.338 3.332 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2c(Cl)nc(Cl)nc2C2CC2)c2c1CC[NH2+]C2 ZINC001164681366 719651821 /nfs/dbraw/zinc/65/18/21/719651821.db2.gz MNJMNJRPOLZTCX-UHFFFAOYSA-N 2 1 395.338 3.332 20 0 GGADMP CC[C@H](C)c1nc2[nH]ccc2c(-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164680999 719654506 /nfs/dbraw/zinc/65/45/06/719654506.db2.gz LAMSGUPAKHXDAL-AWEZNQCLSA-N 2 1 381.528 3.143 20 0 GGADMP CC[C@H](C)c1nc2[nH]ccc2c(-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)n1 ZINC001164680999 719654511 /nfs/dbraw/zinc/65/45/11/719654511.db2.gz LAMSGUPAKHXDAL-AWEZNQCLSA-N 2 1 381.528 3.143 20 0 GGADMP COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cccc(N(C)C)[nH+]1)CC2 ZINC001164711053 720099233 /nfs/dbraw/zinc/09/92/33/720099233.db2.gz NPRWTUXWNQDJLU-FQEVSTJZSA-N 2 1 395.551 3.050 20 0 GGADMP COC[C@H]1CC2(C[N@@H+]1Cc1ccccn1)CCN(c1ccc3c([nH+]1)CCC3)CC2 ZINC001164714822 720112700 /nfs/dbraw/zinc/11/27/00/720112700.db2.gz CFCGNFQAQQEYRP-OAQYLSRUSA-N 2 1 392.547 3.473 20 0 GGADMP COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc3c([nH+]1)CCC3)CC2 ZINC001164714822 720112704 /nfs/dbraw/zinc/11/27/04/720112704.db2.gz CFCGNFQAQQEYRP-OAQYLSRUSA-N 2 1 392.547 3.473 20 0 GGADMP CCOc1cc[nH+]c(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)c1 ZINC001164715569 720116363 /nfs/dbraw/zinc/11/63/63/720116363.db2.gz IAQILOUSFKOKRS-HXUWFJFHSA-N 2 1 396.535 3.383 20 0 GGADMP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1cc(OC)c3ccccc3[nH+]1)C2 ZINC001164809052 720146725 /nfs/dbraw/zinc/14/67/25/720146725.db2.gz GJBGCZITGCVECV-WZONZLPQSA-N 2 1 381.520 3.428 20 0 GGADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(OC)c3ccccc3[nH+]1)C2 ZINC001164809052 720146735 /nfs/dbraw/zinc/14/67/35/720146735.db2.gz GJBGCZITGCVECV-WZONZLPQSA-N 2 1 381.520 3.428 20 0 GGADMP Cc1cccc2cc[nH+]c(N3CC[C@H]4[C@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c12 ZINC001164830738 720347436 /nfs/dbraw/zinc/34/74/36/720347436.db2.gz WTRSCSVPJFKKOY-RTWAWAEBSA-N 2 1 392.547 3.455 20 0 GGADMP CC(C)Oc1cc[nH+]c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164834286 720555829 /nfs/dbraw/zinc/55/58/29/720555829.db2.gz DGZCJYOUKGRDOO-IRFCIJBXSA-N 2 1 383.540 3.443 20 0 GGADMP C[N@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(NC3CC3)cc[nH+]1)CC2 ZINC001164841741 720654862 /nfs/dbraw/zinc/65/48/62/720654862.db2.gz PTXDIRORAQNIFR-HXUWFJFHSA-N 2 1 393.535 3.311 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(NC3CC3)cc[nH+]1)CC2 ZINC001164841741 720654877 /nfs/dbraw/zinc/65/48/77/720654877.db2.gz PTXDIRORAQNIFR-HXUWFJFHSA-N 2 1 393.535 3.311 20 0 GGADMP CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ccc(C[NH+]3CCCC3)cn1)[C@@H]2C ZINC001164857226 720999807 /nfs/dbraw/zinc/99/98/07/720999807.db2.gz DSSQXJRMYFAOQJ-GOSISDBHSA-N 2 1 382.556 3.295 20 0 GGADMP Cc1ccc(C[NH+]2CCC3(CCN(c4ncnc5c4C[NH2+]C5)CC3)CC2)cc1 ZINC001164760529 721043442 /nfs/dbraw/zinc/04/34/42/721043442.db2.gz VJPZVDISYYUISC-UHFFFAOYSA-N 2 1 377.536 3.271 20 0 GGADMP COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(C)cc(C)[nH+]1)CC2 ZINC001164790583 721450740 /nfs/dbraw/zinc/45/07/40/721450740.db2.gz ZUIWTSPKNQVOKF-NRFANRHFSA-N 2 1 387.568 3.432 20 0 GGADMP Cc1cc2[nH]ccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)[nH+]1 ZINC001164806723 721559746 /nfs/dbraw/zinc/55/97/46/721559746.db2.gz RFZJRMJEWNNNSS-QHAWAJNXSA-N 2 1 377.492 3.135 20 0 GGADMP CCN(C)c1cc[nH+]c(N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165021465 721798142 /nfs/dbraw/zinc/79/81/42/721798142.db2.gz HBXVRBKCYHPHNV-DFQSSKMNSA-N 2 1 380.540 3.065 20 0 GGADMP CCN(C)c1cc[nH+]c(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165021465 721798143 /nfs/dbraw/zinc/79/81/43/721798143.db2.gz HBXVRBKCYHPHNV-DFQSSKMNSA-N 2 1 380.540 3.065 20 0 GGADMP CCN(C)c1cc(C)[nH+]c(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165020424 721798249 /nfs/dbraw/zinc/79/82/49/721798249.db2.gz FRPKDGPQBVYFMU-SESVDKBCSA-N 2 1 394.567 3.373 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1C[C@H]2[C@@H](C1)CCC[C@H]2[N@H+](C)Cc1ccccn1 ZINC001165017779 721804282 /nfs/dbraw/zinc/80/42/82/721804282.db2.gz APJLCWFPQZLHEV-LSTHTHJFSA-N 2 1 376.508 3.100 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1C[C@H]2[C@@H](C1)CCC[C@H]2[N@@H+](C)Cc1ccccn1 ZINC001165017779 721804285 /nfs/dbraw/zinc/80/42/85/721804285.db2.gz APJLCWFPQZLHEV-LSTHTHJFSA-N 2 1 376.508 3.100 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[NH+](CCc3ccccn3)CC2)nc1 ZINC001165054890 722020007 /nfs/dbraw/zinc/02/00/07/722020007.db2.gz IJYYYQDAWSVBSC-JOCHJYFZSA-N 2 1 379.552 3.388 20 0 GGADMP Clc1cc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c2c(n1)C[NH2+]CC2 ZINC001164955835 722021133 /nfs/dbraw/zinc/02/11/33/722021133.db2.gz OKENQAWSULPJGB-UHFFFAOYSA-N 2 1 397.954 3.268 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3C[NH+](CC4CC4)C[C@H](C2)O3)nc1 ZINC001164968092 722077358 /nfs/dbraw/zinc/07/73/58/722077358.db2.gz QCAOAUMQXGRQKI-BHIFYINESA-N 2 1 384.568 3.318 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3C[N@@H+](CC4CC4)C[C@H](C2)O3)nc1 ZINC001164968092 722077360 /nfs/dbraw/zinc/07/73/60/722077360.db2.gz QCAOAUMQXGRQKI-BHIFYINESA-N 2 1 384.568 3.318 20 0 GGADMP CCC[NH+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)nc1 ZINC001164968092 722077361 /nfs/dbraw/zinc/07/73/61/722077361.db2.gz QCAOAUMQXGRQKI-BHIFYINESA-N 2 1 384.568 3.318 20 0 GGADMP c1cncc(C[N@@H+]2CCO[C@@H]3CN(c4ccc5c([nH+]4)CCCC5)CC[C@@H]3C2)c1 ZINC001164981503 722111445 /nfs/dbraw/zinc/11/14/45/722111445.db2.gz UHEPKSULNJXMOS-IFMALSPDSA-N 2 1 378.520 3.083 20 0 GGADMP c1cncc(C[N@H+]2CCO[C@@H]3CN(c4ccc5c([nH+]4)CCCC5)CC[C@@H]3C2)c1 ZINC001164981503 722111447 /nfs/dbraw/zinc/11/14/47/722111447.db2.gz UHEPKSULNJXMOS-IFMALSPDSA-N 2 1 378.520 3.083 20 0 GGADMP Fc1cccc(C[N@H+]2CC[C@@]23CCCN(c2nccc(C4CC[NH2+]CC4)n2)C3)c1 ZINC001164993764 722204996 /nfs/dbraw/zinc/20/49/96/722204996.db2.gz ASQOSEOMFTZEAI-HSZRJFAPSA-N 2 1 395.526 3.328 20 0 GGADMP Fc1cccc(C[N@@H+]2CC[C@]23CCCN(c2cccc(N4CCOCC4)[nH+]2)C3)c1 ZINC001164995671 722205432 /nfs/dbraw/zinc/20/54/32/722205432.db2.gz PAKNTTFOGXNWFI-QHCPKHFHSA-N 2 1 396.510 3.302 20 0 GGADMP Fc1cccc(C[N@H+]2CC[C@]23CCCN(c2cccc(N4CCOCC4)[nH+]2)C3)c1 ZINC001164995671 722205433 /nfs/dbraw/zinc/20/54/33/722205433.db2.gz PAKNTTFOGXNWFI-QHCPKHFHSA-N 2 1 396.510 3.302 20 0 GGADMP Cc1ccc2cc[nH+]c(N3CCCn4cnc(COCC[NH+](C)C)c4C3)c2c1 ZINC001165002281 722253238 /nfs/dbraw/zinc/25/32/38/722253238.db2.gz MZGDGJSFNIMZIL-UHFFFAOYSA-N 2 1 379.508 3.228 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(-c2nn[nH]n2)c1 ZINC000824530412 946767339 /nfs/dbraw/zinc/76/73/39/946767339.db2.gz KXBWNFPLIKVOSC-FIKGOQFSSA-N 2 1 376.508 3.428 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(-c2nn[nH]n2)c1 ZINC000824577288 946820796 /nfs/dbraw/zinc/82/07/96/946820796.db2.gz JGBPOSVJFKABQS-JKSUJKDBSA-N 2 1 382.537 3.491 20 0 GGADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(-c2nn[nH]n2)c1 ZINC000824577288 946820804 /nfs/dbraw/zinc/82/08/04/946820804.db2.gz JGBPOSVJFKABQS-JKSUJKDBSA-N 2 1 382.537 3.491 20 0 GGADMP C[C@@H](c1cccc(-c2nn[nH]n2)c1)[N@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001575508988 949107445 /nfs/dbraw/zinc/10/74/45/949107445.db2.gz AVHTWQKXHRVCSD-WTOYTKOKSA-N 2 1 388.519 3.382 20 0 GGADMP C[C@@H](c1cccc(-c2nn[nH]n2)c1)[NH+]1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001575508988 949107457 /nfs/dbraw/zinc/10/74/57/949107457.db2.gz AVHTWQKXHRVCSD-WTOYTKOKSA-N 2 1 388.519 3.382 20 0 GGADMP C[C@@H](c1cccc(-c2nn[nH]n2)c1)[NH+]1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001575508988 949107469 /nfs/dbraw/zinc/10/74/69/949107469.db2.gz AVHTWQKXHRVCSD-WTOYTKOKSA-N 2 1 388.519 3.382 20 0 GGADMP CC(C)(C)[C@]1(C[NH2+]C2CC[NH+](CC(=O)[O-])CC2)CC[N@H+](Cc2ccccc2)C1 ZINC001588640337 959682856 /nfs/dbraw/zinc/68/28/56/959682856.db2.gz VVGPMWNUJAAECV-QHCPKHFHSA-N 2 1 387.568 3.063 20 0 GGADMP CC(C)(C)[C@]1(C[NH2+]C2CC[NH+](CC(=O)[O-])CC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001588640337 959682867 /nfs/dbraw/zinc/68/28/67/959682867.db2.gz VVGPMWNUJAAECV-QHCPKHFHSA-N 2 1 387.568 3.063 20 0 GGADMP Clc1ccc(-c2nnc(C[NH+]3CCC(CC[NH+]4CCOCC4)CC3)o2)cc1 ZINC000359957037 212127971 /nfs/dbraw/zinc/12/79/71/212127971.db2.gz NARRXZWDCMPITE-UHFFFAOYSA-N 2 1 390.915 3.324 20 0 GGADMP CCOc1c(Br)cc(C[NH2+]CCC[NH2+]C)cc1Br ZINC000010435504 221102858 /nfs/dbraw/zinc/10/28/58/221102858.db2.gz RDIPAYITJPBBGB-UHFFFAOYSA-N 2 1 380.124 3.309 20 0 GGADMP COc1ccc(CCNC(=[NH2+])NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000058326814 222049374 /nfs/dbraw/zinc/04/93/74/222049374.db2.gz HQUNBMLYNZYJSQ-SFHVURJKSA-N 2 1 386.565 3.325 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]Cc1cc(Br)c(Cl)s1 ZINC000190991839 565576406 /nfs/dbraw/zinc/57/64/06/565576406.db2.gz OPBDRFDPPCRORV-LLVKDONJSA-N 2 1 381.767 3.491 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000119426066 564270335 /nfs/dbraw/zinc/27/03/35/564270335.db2.gz FVZNLLPLOJHXDD-ZIAGYGMSSA-N 2 1 380.330 3.240 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000119425710 564270428 /nfs/dbraw/zinc/27/04/28/564270428.db2.gz FVZNLLPLOJHXDD-KBPBESRZSA-N 2 1 380.330 3.240 20 0 GGADMP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119643887 564281160 /nfs/dbraw/zinc/28/11/60/564281160.db2.gz BDMLKPAGTWXXST-ZDUSSCGKSA-N 2 1 380.330 3.383 20 0 GGADMP C[N@@H+](Cc1ccc(-n2ccnc2)nc1)[C@H](CO)c1cccc(Br)c1 ZINC000125830786 564527982 /nfs/dbraw/zinc/52/79/82/564527982.db2.gz NVBNSCAZTNAAJI-QGZVFWFLSA-N 2 1 387.281 3.195 20 0 GGADMP CN(Cc1ccc(-n2ccnc2)nc1)[C@H](CO)c1cccc(Br)c1 ZINC000125830786 564527985 /nfs/dbraw/zinc/52/79/85/564527985.db2.gz NVBNSCAZTNAAJI-QGZVFWFLSA-N 2 1 387.281 3.195 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC[N@@H+]1C ZINC000127480308 564585281 /nfs/dbraw/zinc/58/52/81/564585281.db2.gz CWPUTIQYUZDUCO-DNVCBOLYSA-N 2 1 380.374 3.486 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC[N@H+]1C ZINC000127480308 564585286 /nfs/dbraw/zinc/58/52/86/564585286.db2.gz CWPUTIQYUZDUCO-DNVCBOLYSA-N 2 1 380.374 3.486 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@@H]2CCCOc3c(Br)cccc32)CC1 ZINC000128348162 564615515 /nfs/dbraw/zinc/61/55/15/564615515.db2.gz INHXUSCQNMPMDN-GOSISDBHSA-N 2 1 396.373 3.280 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000130856956 564694546 /nfs/dbraw/zinc/69/45/46/564694546.db2.gz DXHJLDFFMDWLHF-CYBMUJFWSA-N 2 1 379.302 3.303 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000130856956 564694551 /nfs/dbraw/zinc/69/45/51/564694551.db2.gz DXHJLDFFMDWLHF-CYBMUJFWSA-N 2 1 379.302 3.303 20 0 GGADMP COc1ccc(Br)c(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c1 ZINC000134093535 564793214 /nfs/dbraw/zinc/79/32/14/564793214.db2.gz SPITYZVETGCBLB-UHFFFAOYSA-N 2 1 383.330 3.002 20 0 GGADMP C[NH+]1CCN(CCCC[NH2+][C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000134315988 564800223 /nfs/dbraw/zinc/80/02/23/564800223.db2.gz OWTAZETXZCIDNV-QGZVFWFLSA-N 2 1 384.337 3.193 20 0 GGADMP Brc1cc(C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc2c1OCCCO2 ZINC000071939936 564858901 /nfs/dbraw/zinc/85/89/01/564858901.db2.gz IGRSGDCGYOTRPI-CYBMUJFWSA-N 2 1 381.314 3.184 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3ccccc3Br)CC[C@@H]21 ZINC000139914972 564869929 /nfs/dbraw/zinc/86/99/29/564869929.db2.gz FWAZLEPUTIDJEE-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CCC(=O)Nc3ccccc3Br)CC[C@@H]21 ZINC000139914972 564869934 /nfs/dbraw/zinc/86/99/34/564869934.db2.gz FWAZLEPUTIDJEE-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCC(=O)Nc3ccccc3Br)CC[C@@H]21 ZINC000139914972 564869939 /nfs/dbraw/zinc/86/99/39/564869939.db2.gz FWAZLEPUTIDJEE-PBHICJAKSA-N 2 1 380.330 3.194 20 0 GGADMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000097162629 564905995 /nfs/dbraw/zinc/90/59/95/564905995.db2.gz JIKJGURCMYGTDN-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000097162629 564905999 /nfs/dbraw/zinc/90/59/99/564905999.db2.gz JIKJGURCMYGTDN-HNNXBMFYSA-N 2 1 377.330 3.375 20 0 GGADMP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](CCOc3cc(Cl)ccc3Cl)C2)CC1 ZINC000369446188 565092457 /nfs/dbraw/zinc/09/24/57/565092457.db2.gz YALCNJPLBLBCRJ-KRWDZBQOSA-N 2 1 386.367 3.473 20 0 GGADMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cncc(Br)c1 ZINC000183765560 565093898 /nfs/dbraw/zinc/09/38/98/565093898.db2.gz AMPVYTHXDOVZCJ-IBGZPJMESA-N 2 1 390.325 3.091 20 0 GGADMP O[C@@H](COc1ccc(Br)cc1)C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157405950 565130510 /nfs/dbraw/zinc/13/05/10/565130510.db2.gz APKUENZVYRUKQN-ZWKOTPCHSA-N 2 1 397.357 3.139 20 0 GGADMP O[C@@H](COc1ccc(Br)cc1)C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157405950 565130515 /nfs/dbraw/zinc/13/05/15/565130515.db2.gz APKUENZVYRUKQN-ZWKOTPCHSA-N 2 1 397.357 3.139 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(Cc3cc4c(cc3Br)OCCO4)CC[C@@H]21 ZINC000158860029 565184283 /nfs/dbraw/zinc/18/42/83/565184283.db2.gz SXMLGPCKBIIEJE-CJNGLKHVSA-N 2 1 381.314 3.136 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000371437062 565193701 /nfs/dbraw/zinc/19/37/01/565193701.db2.gz ARODPEXNZIBZQB-KBRIMQKVSA-N 2 1 380.330 3.383 20 0 GGADMP C[C@@H]1C[N@H+](CCCc2ccccc2Br)CC[C@H]1N1CC[NH+](C)CC1 ZINC000371697396 565206205 /nfs/dbraw/zinc/20/62/05/565206205.db2.gz VWOREGZSTATGFK-YLJYHZDGSA-N 2 1 394.401 3.340 20 0 GGADMP C[C@@H]1C[N@@H+](CCCc2ccccc2Br)CC[C@H]1N1CC[NH+](C)CC1 ZINC000371697396 565206208 /nfs/dbraw/zinc/20/62/08/565206208.db2.gz VWOREGZSTATGFK-YLJYHZDGSA-N 2 1 394.401 3.340 20 0 GGADMP Cc1c([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)nnn1-c1cccc(Br)c1 ZINC000271812292 565268419 /nfs/dbraw/zinc/26/84/19/565268419.db2.gz AWVIFIWYZAVRFZ-ZDUSSCGKSA-N 2 1 390.329 3.251 20 0 GGADMP Cc1c([C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)nnn1-c1cccc(Br)c1 ZINC000271812292 565268425 /nfs/dbraw/zinc/26/84/25/565268425.db2.gz AWVIFIWYZAVRFZ-ZDUSSCGKSA-N 2 1 390.329 3.251 20 0 GGADMP Cc1c([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)nnn1-c1cccc(Br)c1 ZINC000271812289 565268899 /nfs/dbraw/zinc/26/88/99/565268899.db2.gz AWVIFIWYZAVRFZ-CYBMUJFWSA-N 2 1 390.329 3.251 20 0 GGADMP Cc1c([C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)nnn1-c1cccc(Br)c1 ZINC000271812289 565268903 /nfs/dbraw/zinc/26/89/03/565268903.db2.gz AWVIFIWYZAVRFZ-CYBMUJFWSA-N 2 1 390.329 3.251 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271842432 565269768 /nfs/dbraw/zinc/26/97/68/565269768.db2.gz RCWDRKXSUOKZTN-UHFFFAOYSA-N 2 1 383.330 3.216 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3cncc(Br)c3)c2)CCO1 ZINC000186605700 565272392 /nfs/dbraw/zinc/27/23/92/565272392.db2.gz JXZVNEKJRVPALQ-HNNXBMFYSA-N 2 1 390.325 3.355 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3cncc(Br)c3)c2)CCO1 ZINC000186605700 565272398 /nfs/dbraw/zinc/27/23/98/565272398.db2.gz JXZVNEKJRVPALQ-HNNXBMFYSA-N 2 1 390.325 3.355 20 0 GGADMP C[C@H](C[NH+](C)CCOCC[N@H+](C)C[C@@H](C)c1nccs1)c1nccs1 ZINC000273090919 565306776 /nfs/dbraw/zinc/30/67/76/565306776.db2.gz SOTKZVPYJRYUNS-HZPDHXFCSA-N 2 1 382.599 3.387 20 0 GGADMP C[C@@H](C[NH+](C)CCOCC[N@H+](C)C[C@H](C)c1nccs1)c1nccs1 ZINC000273090917 565306994 /nfs/dbraw/zinc/30/69/94/565306994.db2.gz SOTKZVPYJRYUNS-HOTGVXAUSA-N 2 1 382.599 3.387 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCSCCOc1cccc(Br)c1 ZINC000162157068 565307867 /nfs/dbraw/zinc/30/78/67/565307867.db2.gz ZGEXFCJLSJTZQM-PBHICJAKSA-N 2 1 387.387 3.491 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)nc12 ZINC000273433600 565319710 /nfs/dbraw/zinc/31/97/10/565319710.db2.gz LKTWBOSGRWNOGX-GRDNDAEWSA-N 3 1 379.346 3.266 20 0 GGADMP Cc1cc(Br)cn2cc(CC[NH2+][C@@H]3C[C@H](C)N(C)C[C@@H]3C)nc12 ZINC000273433600 565319718 /nfs/dbraw/zinc/31/97/18/565319718.db2.gz LKTWBOSGRWNOGX-GRDNDAEWSA-N 3 1 379.346 3.266 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)Cc2ccc(Br)cc2)CC1 ZINC000188121594 565381408 /nfs/dbraw/zinc/38/14/08/565381408.db2.gz QYTZBCROQTUWNM-KRWDZBQOSA-N 2 1 382.390 3.387 20 0 GGADMP C[C@@H]([NH2+]CCCCN1CC[NH+](CCO)CC1)c1cc(Cl)sc1Cl ZINC000168918306 565381856 /nfs/dbraw/zinc/38/18/56/565381856.db2.gz MMNJDZXLCHPXPG-CYBMUJFWSA-N 2 1 380.385 3.096 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ncc(Br)cc1Br ZINC000274831848 565382857 /nfs/dbraw/zinc/38/28/57/565382857.db2.gz JULRDUBQNDSMSK-UHFFFAOYSA-N 2 1 388.107 3.291 20 0 GGADMP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C[C@@H]1CCc2[nH+]ccn2C1 ZINC000275540205 565416874 /nfs/dbraw/zinc/41/68/74/565416874.db2.gz MPURBMVSOKBHBV-KBPBESRZSA-N 2 1 391.313 3.215 20 0 GGADMP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C[C@@H]1CCc2[nH+]ccn2C1 ZINC000275540209 565416908 /nfs/dbraw/zinc/41/69/08/565416908.db2.gz MPURBMVSOKBHBV-KGLIPLIRSA-N 2 1 391.313 3.215 20 0 GGADMP C[C@H](C[NH2+]Cc1ccc(Br)cc1N1CCOCC1)C[NH+]1CCCC1 ZINC000188700292 565418172 /nfs/dbraw/zinc/41/81/72/565418172.db2.gz RSFLFFXOUHPCAG-MRXNPFEDSA-N 2 1 396.373 3.107 20 0 GGADMP Brc1ccc(C[NH2+]CCC[NH+]2CCCCC2)c(N2CCOCC2)c1 ZINC000188690804 565418520 /nfs/dbraw/zinc/41/85/20/565418520.db2.gz LMHXGSQGVUCKSR-UHFFFAOYSA-N 2 1 396.373 3.251 20 0 GGADMP C[N@@H+](CCC(=O)Nc1ccccc1Br)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000298540756 565418788 /nfs/dbraw/zinc/41/87/88/565418788.db2.gz NBCDTKZNXWMNDH-YIONKMFJSA-N 2 1 380.330 3.335 20 0 GGADMP C[NH+](CCC(=O)Nc1ccccc1Br)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000298540756 565418793 /nfs/dbraw/zinc/41/87/93/565418793.db2.gz NBCDTKZNXWMNDH-YIONKMFJSA-N 2 1 380.330 3.335 20 0 GGADMP C[NH+](CCC(=O)Nc1ccccc1Br)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000298540756 565418795 /nfs/dbraw/zinc/41/87/95/565418795.db2.gz NBCDTKZNXWMNDH-YIONKMFJSA-N 2 1 380.330 3.335 20 0 GGADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000188706974 565419206 /nfs/dbraw/zinc/41/92/06/565419206.db2.gz UHRNWOSPNODJGG-INIZCTEOSA-N 2 1 396.373 3.107 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000188706974 565419211 /nfs/dbraw/zinc/41/92/11/565419211.db2.gz UHRNWOSPNODJGG-INIZCTEOSA-N 2 1 396.373 3.107 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)CC(=O)Nc1ccc(Br)cc1 ZINC000298689061 565424827 /nfs/dbraw/zinc/42/48/27/565424827.db2.gz JYGBCBQUHUEICW-CYBMUJFWSA-N 2 1 379.302 3.351 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCC(=O)Nc1ccccc1Br ZINC000299184693 565441924 /nfs/dbraw/zinc/44/19/24/565441924.db2.gz ADZYZDZDUHYUSB-UHFFFAOYSA-N 2 1 379.302 3.305 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)CCC(=O)Nc1ccccc1Br ZINC000299184693 565441929 /nfs/dbraw/zinc/44/19/29/565441929.db2.gz ADZYZDZDUHYUSB-UHFFFAOYSA-N 2 1 379.302 3.305 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(Br)c2c(c1)OCCO2 ZINC000171764699 565449010 /nfs/dbraw/zinc/44/90/10/565449010.db2.gz JGJWFKRLUZTUPO-LBPRGKRZSA-N 2 1 380.286 3.151 20 0 GGADMP C[N@@H+]1CCC[C@H](N2CCN(c3cc[nH+]c4cc(Br)ccc43)CC2)C1 ZINC000301309368 565478289 /nfs/dbraw/zinc/47/82/89/565478289.db2.gz DXPCKKZNCCBQCG-INIZCTEOSA-N 2 1 389.341 3.214 20 0 GGADMP C[N@H+]1CCC[C@H](N2CCN(c3cc[nH+]c4cc(Br)ccc43)CC2)C1 ZINC000301309368 565478295 /nfs/dbraw/zinc/47/82/95/565478295.db2.gz DXPCKKZNCCBQCG-INIZCTEOSA-N 2 1 389.341 3.214 20 0 GGADMP Brc1ccc2[nH+]ccc(N3CC[C@@H](C[NH+]4CCOCC4)C3)c2c1 ZINC000301468648 565488079 /nfs/dbraw/zinc/48/80/79/565488079.db2.gz RJPLKLOLVJCICW-AWEZNQCLSA-N 2 1 376.298 3.156 20 0 GGADMP COc1c(Br)cccc1C[N@H+](C)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000377627375 565490427 /nfs/dbraw/zinc/49/04/27/565490427.db2.gz NGZMONWHUOJBLM-KRWDZBQOSA-N 2 1 396.373 3.058 20 0 GGADMP COc1c(Br)cccc1C[N@@H+](C)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000377627375 565490429 /nfs/dbraw/zinc/49/04/29/565490429.db2.gz NGZMONWHUOJBLM-KRWDZBQOSA-N 2 1 396.373 3.058 20 0 GGADMP Brc1ccc2c(c1)[nH+]ccc2N1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000301563418 565496349 /nfs/dbraw/zinc/49/63/49/565496349.db2.gz PEZCJMTVWCMKIN-AWEZNQCLSA-N 2 1 376.298 3.156 20 0 GGADMP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](CCOc3cc(Cl)cc(Cl)c3)C2)CC1 ZINC000377920988 565505761 /nfs/dbraw/zinc/50/57/61/565505761.db2.gz WXGRTKCCJKQFSI-GOSISDBHSA-N 2 1 386.367 3.473 20 0 GGADMP COc1sc(C[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1Br ZINC000277646313 565512276 /nfs/dbraw/zinc/51/22/76/565512276.db2.gz DGKFUNPKBRUQLD-GFCCVEGCSA-N 2 1 377.348 3.110 20 0 GGADMP COc1sc(C[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1Br ZINC000277646313 565512283 /nfs/dbraw/zinc/51/22/83/565512283.db2.gz DGKFUNPKBRUQLD-GFCCVEGCSA-N 2 1 377.348 3.110 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]Cc1cc(Br)c(Cl)s1 ZINC000190991855 565575920 /nfs/dbraw/zinc/57/59/20/565575920.db2.gz OPBDRFDPPCRORV-NSHDSACASA-N 2 1 381.767 3.491 20 0 GGADMP C[C@H](NC(=O)C[N@@H+]1CCC[C@H](C)[C@@H]1CC[NH3+])c1ccc(Br)cc1 ZINC000404285064 565583219 /nfs/dbraw/zinc/58/32/19/565583219.db2.gz RNFTZVYHUQJCQJ-ZQIUZPCESA-N 2 1 382.346 3.076 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@H](C)[C@@H]1CC[NH3+])c1ccc(Br)cc1 ZINC000404285064 565583221 /nfs/dbraw/zinc/58/32/21/565583221.db2.gz RNFTZVYHUQJCQJ-ZQIUZPCESA-N 2 1 382.346 3.076 20 0 GGADMP Brc1ccc([C@H]([NH2+]C[C@@H]2CCc3[nH+]ccn3C2)c2cncnc2)cc1 ZINC000278910167 565585606 /nfs/dbraw/zinc/58/56/06/565585606.db2.gz GUDNUJKSSYKIFB-LIRRHRJNSA-N 2 1 398.308 3.377 20 0 GGADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000319966766 565601078 /nfs/dbraw/zinc/60/10/78/565601078.db2.gz BUQWCBVNFXVWHA-AWEZNQCLSA-N 2 1 383.330 3.430 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000319966766 565601082 /nfs/dbraw/zinc/60/10/82/565601082.db2.gz BUQWCBVNFXVWHA-AWEZNQCLSA-N 2 1 383.330 3.430 20 0 GGADMP COCC[N@@H+](C)CCC[NH2+][C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000191494952 565607722 /nfs/dbraw/zinc/60/77/22/565607722.db2.gz VEIWUVZIUYNYND-IBGZPJMESA-N 2 1 399.373 3.475 20 0 GGADMP CC[N@@H+](C)C[C@H]1CCN(Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000191696330 565621820 /nfs/dbraw/zinc/62/18/20/565621820.db2.gz KABATYGYVOBGPQ-MRXNPFEDSA-N 2 1 396.373 3.059 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000174956790 565670042 /nfs/dbraw/zinc/67/00/42/565670042.db2.gz HZALUTDGUFYUJO-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000174956790 565670044 /nfs/dbraw/zinc/67/00/44/565670044.db2.gz HZALUTDGUFYUJO-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000174956790 565670047 /nfs/dbraw/zinc/67/00/47/565670047.db2.gz HZALUTDGUFYUJO-OAHLLOKOSA-N 2 1 382.346 3.441 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CCc3c(Br)cccc3C2)CC1 ZINC000192728578 565707512 /nfs/dbraw/zinc/70/75/12/565707512.db2.gz CGLRVLGQWYGIOF-UHFFFAOYSA-N 2 1 380.374 3.223 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCc3c(Br)cccc3C2)CC1 ZINC000192728578 565707518 /nfs/dbraw/zinc/70/75/18/565707518.db2.gz CGLRVLGQWYGIOF-UHFFFAOYSA-N 2 1 380.374 3.223 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)CCOc2ccc(Br)cc2)CC1 ZINC000192719913 565707693 /nfs/dbraw/zinc/70/76/93/565707693.db2.gz FEBRZILCUBSLQW-UHFFFAOYSA-N 2 1 398.389 3.176 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000176275200 565762343 /nfs/dbraw/zinc/76/23/43/565762343.db2.gz IOMNVVMVBAVMOJ-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000176275200 565762345 /nfs/dbraw/zinc/76/23/45/565762345.db2.gz IOMNVVMVBAVMOJ-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000176275200 565762347 /nfs/dbraw/zinc/76/23/47/565762347.db2.gz IOMNVVMVBAVMOJ-HNNXBMFYSA-N 2 1 382.346 3.441 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCc3ccc(Br)cc32)CC1 ZINC000193974413 565787091 /nfs/dbraw/zinc/78/70/91/565787091.db2.gz CWIDICNOLAIQGF-LJQANCHMSA-N 2 1 380.374 3.444 20 0 GGADMP CC[N@H+](CC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1)C1CC1 ZINC000412967947 565824480 /nfs/dbraw/zinc/82/44/80/565824480.db2.gz GMSBQAKXFUQCNW-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP CC[N@@H+](CC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1)C1CC1 ZINC000412967947 565824487 /nfs/dbraw/zinc/82/44/87/565824487.db2.gz GMSBQAKXFUQCNW-UHFFFAOYSA-N 2 1 394.357 3.014 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H](CO)Cc1cc(F)cc(Br)c1 ZINC000414170356 565900831 /nfs/dbraw/zinc/90/08/31/565900831.db2.gz BYNFMUKSACAMEK-ACXGAUJLSA-N 2 1 387.337 3.058 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H](CO)Cc1cc(F)cc(Br)c1 ZINC000414170360 565900874 /nfs/dbraw/zinc/90/08/74/565900874.db2.gz BYNFMUKSACAMEK-HOPMXRPOSA-N 2 1 387.337 3.058 20 0 GGADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000414182569 565901606 /nfs/dbraw/zinc/90/16/06/565901606.db2.gz MVTLQBGUQKSODF-RYUDHWBXSA-N 2 1 394.368 3.023 20 0 GGADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000414182568 565901723 /nfs/dbraw/zinc/90/17/23/565901723.db2.gz MVTLQBGUQKSODF-NWDGAFQWSA-N 2 1 394.368 3.023 20 0 GGADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000414182567 565901769 /nfs/dbraw/zinc/90/17/69/565901769.db2.gz MVTLQBGUQKSODF-NEPJUHHUSA-N 2 1 394.368 3.023 20 0 GGADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000414182570 565901855 /nfs/dbraw/zinc/90/18/55/565901855.db2.gz MVTLQBGUQKSODF-VXGBXAGGSA-N 2 1 394.368 3.023 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C1CCN(Cc2cccc(Br)c2)CC1 ZINC000414351241 565913879 /nfs/dbraw/zinc/91/38/79/565913879.db2.gz MWMIVWZLDCMAAW-DNVCBOLYSA-N 2 1 380.374 3.343 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]C1CCN(Cc2cccc(Br)c2)CC1 ZINC000414351241 565913887 /nfs/dbraw/zinc/91/38/87/565913887.db2.gz MWMIVWZLDCMAAW-DNVCBOLYSA-N 2 1 380.374 3.343 20 0 GGADMP Brc1ccc2oc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)nc2c1 ZINC000285967700 565936504 /nfs/dbraw/zinc/93/65/04/565936504.db2.gz LDPGUXJLOKBZEV-UHFFFAOYSA-N 2 1 394.313 3.135 20 0 GGADMP C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2cscc2Br)c1 ZINC000286328796 565954074 /nfs/dbraw/zinc/95/40/74/565954074.db2.gz DQKJSRVOKYZNJB-UHFFFAOYSA-N 2 1 396.354 3.092 20 0 GGADMP CCCC[C@H](C[NH3+])[NH2+]C1CCN(C(=O)c2ccc(Br)cc2C)CC1 ZINC000414817760 565962993 /nfs/dbraw/zinc/96/29/93/565962993.db2.gz SYVMYNPHPFLEAG-QGZVFWFLSA-N 2 1 396.373 3.469 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414829679 565963004 /nfs/dbraw/zinc/96/30/04/565963004.db2.gz NXURFYBFAPLBIJ-OAHLLOKOSA-N 2 1 377.330 3.341 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414849628 565963640 /nfs/dbraw/zinc/96/36/40/565963640.db2.gz HKIIDALVTLUUAY-UKRRQHHQSA-N 2 1 377.330 3.421 20 0 GGADMP [NH3+]C1(C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)CCCCC1 ZINC000414846480 565963808 /nfs/dbraw/zinc/96/38/08/565963808.db2.gz SPDNLNOQHARNBL-UHFFFAOYSA-N 2 1 382.346 3.037 20 0 GGADMP C[C@@]1(C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CCC[NH2+]C1 ZINC000237571421 565964075 /nfs/dbraw/zinc/96/40/75/565964075.db2.gz LOIUTWUUOVNWJX-LJQANCHMSA-N 2 1 384.351 3.464 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000414978691 565968195 /nfs/dbraw/zinc/96/81/95/565968195.db2.gz UGHMYASDCIHCJJ-QGZVFWFLSA-N 2 1 377.330 3.421 20 0 GGADMP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+]Cc2cncc(Br)c2)cc1 ZINC000414999499 565969478 /nfs/dbraw/zinc/96/94/78/565969478.db2.gz JDRIQSYTLPKXLX-QAPCUYQASA-N 2 1 378.289 3.466 20 0 GGADMP COc1cc(C[NH2+]CCC[NH2+]C2CC2)cc(Br)c1OC(F)F ZINC000415065418 565972060 /nfs/dbraw/zinc/97/20/60/565972060.db2.gz GGRCHOUAFRQYCS-UHFFFAOYSA-N 2 1 379.245 3.291 20 0 GGADMP [NH3+]C1(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)CCCCC1 ZINC000237907096 565974126 /nfs/dbraw/zinc/97/41/26/565974126.db2.gz JUJPHRLCENQYFC-UHFFFAOYSA-N 2 1 394.357 3.191 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H](C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)C1 ZINC000237866063 565974231 /nfs/dbraw/zinc/97/42/31/565974231.db2.gz GLNJOCLLFYULJD-NVXWUHKLSA-N 2 1 394.357 3.047 20 0 GGADMP C[N@H+](Cc1cnn(-c2ccc(Br)cc2)c1)CC1CC[NH+](C)CC1 ZINC000179447848 565981019 /nfs/dbraw/zinc/98/10/19/565981019.db2.gz ISYXUUGNCORLAS-UHFFFAOYSA-N 2 1 377.330 3.408 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cn2)cc1 ZINC000363016169 565987150 /nfs/dbraw/zinc/98/71/50/565987150.db2.gz RHAHWCDAAWUNCM-FUHWJXTLSA-N 2 1 375.314 3.351 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)cn2)cc1 ZINC000363016169 565987154 /nfs/dbraw/zinc/98/71/54/565987154.db2.gz RHAHWCDAAWUNCM-FUHWJXTLSA-N 2 1 375.314 3.351 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cn2)cc1 ZINC000363016171 565987403 /nfs/dbraw/zinc/98/74/03/565987403.db2.gz RHAHWCDAAWUNCM-WMZOPIPTSA-N 2 1 375.314 3.351 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)cn2)cc1 ZINC000363016171 565987406 /nfs/dbraw/zinc/98/74/06/565987406.db2.gz RHAHWCDAAWUNCM-WMZOPIPTSA-N 2 1 375.314 3.351 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1c(Br)ccc2F ZINC000245550391 565996028 /nfs/dbraw/zinc/99/60/28/565996028.db2.gz HQGANOXLTQRRKS-GUYCJALGSA-N 2 1 385.321 3.402 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](C[C@H](C)c3cccc(Br)c3)C2)CC1 ZINC000245770640 566006815 /nfs/dbraw/zinc/00/68/15/566006815.db2.gz RSQYZQCFIDXMBV-LPHOPBHVSA-N 2 1 380.374 3.264 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172540 566019787 /nfs/dbraw/zinc/01/97/87/566019787.db2.gz JFWUTMGBZXRONG-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172540 566019792 /nfs/dbraw/zinc/01/97/92/566019792.db2.gz JFWUTMGBZXRONG-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172540 566019797 /nfs/dbraw/zinc/01/97/97/566019797.db2.gz JFWUTMGBZXRONG-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172540 566019801 /nfs/dbraw/zinc/01/98/01/566019801.db2.gz JFWUTMGBZXRONG-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000246172540 566019807 /nfs/dbraw/zinc/01/98/07/566019807.db2.gz JFWUTMGBZXRONG-GDBMZVCRSA-N 2 1 375.340 3.397 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@H]2CCCOc3c(Br)cccc32)CC1 ZINC000246954013 566047258 /nfs/dbraw/zinc/04/72/58/566047258.db2.gz INHXUSCQNMPMDN-SFHVURJKSA-N 2 1 396.373 3.280 20 0 GGADMP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(Br)cs3)CC2)CC1 ZINC000364653605 566062422 /nfs/dbraw/zinc/06/24/22/566062422.db2.gz RUDNQTADEQVHDV-UHFFFAOYSA-N 2 1 386.403 3.360 20 0 GGADMP COc1cc(Br)c(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1OC ZINC000247922488 566068407 /nfs/dbraw/zinc/06/84/07/566068407.db2.gz BIFKXCNFXSVJIB-XJKSGUPXSA-N 2 1 383.330 3.382 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@H]1CCCOc2cc(Br)ccc21 ZINC000248002008 566071279 /nfs/dbraw/zinc/07/12/79/566071279.db2.gz KMJBFJMQNLCUHS-WMZOPIPTSA-N 2 1 397.357 3.489 20 0 GGADMP C[C@H](N[C@@H](C(N)=O)c1ccc(Br)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248620011 566083679 /nfs/dbraw/zinc/08/36/79/566083679.db2.gz ZYFDXMKHLRDCOG-DHSIGJKJSA-N 2 1 394.357 3.218 20 0 GGADMP Cc1ccc(Br)cc1NC(=O)CC[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000180829061 566092654 /nfs/dbraw/zinc/09/26/54/566092654.db2.gz YYYZJLBSGQDHLL-HZPDHXFCSA-N 2 1 380.330 3.303 20 0 GGADMP CC[N@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2cc(Br)ccc2C)[C@H](C)C1 ZINC000180829188 566093320 /nfs/dbraw/zinc/09/33/20/566093320.db2.gz MIDNOJQOAQNVNZ-GDBMZVCRSA-N 2 1 382.346 3.406 20 0 GGADMP Cc1ccc(Br)cc1NC(=O)CC[NH2+][C@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000180829908 566093436 /nfs/dbraw/zinc/09/34/36/566093436.db2.gz QRMGUPHIGVOTFX-DZKIICNBSA-N 2 1 382.346 3.404 20 0 GGADMP CN1CC[NH+](CC2CC[NH+](Cc3cc(F)ccc3Br)CC2)CC1 ZINC000289178052 566110703 /nfs/dbraw/zinc/11/07/03/566110703.db2.gz AEUGJAIPBRKUAL-UHFFFAOYSA-N 2 1 384.337 3.048 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cn(-c2ccccc2Br)nn1 ZINC000289505371 566125882 /nfs/dbraw/zinc/12/58/82/566125882.db2.gz MLTZYPMTCKYUBI-UHFFFAOYSA-N 2 1 389.301 3.105 20 0 GGADMP Brc1cccc(-c2noc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)n2)c1 ZINC000261696387 566129300 /nfs/dbraw/zinc/12/93/00/566129300.db2.gz OEBWMHJKCPIMIA-MRXNPFEDSA-N 2 1 391.313 3.463 20 0 GGADMP CCC[N@H+](CC(=O)N[C@H](C)c1ccc(Br)cc1)C1CC[NH2+]CC1 ZINC000261690195 566129427 /nfs/dbraw/zinc/12/94/27/566129427.db2.gz IXZOTWVZCMOOCC-CQSZACIVSA-N 2 1 382.346 3.090 20 0 GGADMP CCC[N@@H+](CC(=O)N[C@H](C)c1ccc(Br)cc1)C1CC[NH2+]CC1 ZINC000261690195 566129430 /nfs/dbraw/zinc/12/94/30/566129430.db2.gz IXZOTWVZCMOOCC-CQSZACIVSA-N 2 1 382.346 3.090 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+](CCSc2ccc(Cl)cc2)C1)[C@H]1CCC[NH2+]1 ZINC000261845754 566137601 /nfs/dbraw/zinc/13/76/01/566137601.db2.gz LYGFQDRQVTXANR-MAUKXSAKSA-N 2 1 381.973 3.012 20 0 GGADMP Brc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(N2CCOCC2)c1 ZINC000181457792 566141937 /nfs/dbraw/zinc/14/19/37/566141937.db2.gz JURVEHIWXFKLIR-QZTJIDSGSA-N 2 1 394.357 3.002 20 0 GGADMP Brc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(N2CCOCC2)c1 ZINC000181457792 566141943 /nfs/dbraw/zinc/14/19/43/566141943.db2.gz JURVEHIWXFKLIR-QZTJIDSGSA-N 2 1 394.357 3.002 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3nc(-c4cccc(Br)c4)no3)C[C@@H]21 ZINC000261969028 566143018 /nfs/dbraw/zinc/14/30/18/566143018.db2.gz YUBTZPRPTVIWQZ-VHDGCEQUSA-N 2 1 377.286 3.058 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4cccc(Br)c4)no3)C[C@@H]21 ZINC000261969028 566143023 /nfs/dbraw/zinc/14/30/23/566143023.db2.gz YUBTZPRPTVIWQZ-VHDGCEQUSA-N 2 1 377.286 3.058 20 0 GGADMP C[NH2+]CCC1CC[NH+](Cc2nc(-c3ccc(Br)s3)no2)CC1 ZINC000262004481 566144177 /nfs/dbraw/zinc/14/41/77/566144177.db2.gz QZUNKSOOGVTVFV-UHFFFAOYSA-N 2 1 385.331 3.382 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000262148323 566147309 /nfs/dbraw/zinc/14/73/09/566147309.db2.gz ZRTTWJABSAHCKN-IBGZPJMESA-N 2 1 389.341 3.437 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000262148323 566147310 /nfs/dbraw/zinc/14/73/10/566147310.db2.gz ZRTTWJABSAHCKN-IBGZPJMESA-N 2 1 389.341 3.437 20 0 GGADMP CCC[C@](C)([NH3+])C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000262334808 566150910 /nfs/dbraw/zinc/15/09/10/566150910.db2.gz WPDLJIPSRZLPKW-SFHVURJKSA-N 2 1 382.346 3.047 20 0 GGADMP COc1ccc([C@H](C)[NH2+]CC2CCN(CC[NH+](C)C)CC2)c(Br)c1 ZINC000181696939 566159902 /nfs/dbraw/zinc/15/99/02/566159902.db2.gz GXCPCGMZCOBLRX-HNNXBMFYSA-N 2 1 398.389 3.382 20 0 GGADMP C[N@@H+](CCCn1ccnc1)Cc1ccc(Br)cc1N1CCOCC1 ZINC000290420029 566171272 /nfs/dbraw/zinc/17/12/72/566171272.db2.gz KQXONVHRFNEXNS-UHFFFAOYSA-N 2 1 393.329 3.004 20 0 GGADMP C[C@H](CCC[NH3+])NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000417988782 566186068 /nfs/dbraw/zinc/18/60/68/566186068.db2.gz ISZUAPKPISAOOR-CYBMUJFWSA-N 2 1 387.355 3.384 20 0 GGADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(Br)nc1 ZINC000290762144 566187368 /nfs/dbraw/zinc/18/73/68/566187368.db2.gz ROZFWTCLABNCDI-JQFCIGGWSA-N 2 1 382.346 3.263 20 0 GGADMP CCC[N@@H+](C)[C@H](CNC(=O)N[C@@H](CC[NH3+])C(F)F)c1ccc(Cl)cc1 ZINC000418186121 566202373 /nfs/dbraw/zinc/20/23/73/566202373.db2.gz RNYMVCJLOFQEMX-LSDHHAIUSA-N 2 1 376.879 3.005 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000575124177 566252778 /nfs/dbraw/zinc/25/27/78/566252778.db2.gz RJVBWHWMHNRGMY-CABCVRRESA-N 2 1 380.330 3.018 20 0 GGADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)C1 ZINC000481928896 566264603 /nfs/dbraw/zinc/26/46/03/566264603.db2.gz SVVUHEJQUVRBBQ-WMLDXEAASA-N 2 1 387.977 3.021 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)C1 ZINC000481928896 566264613 /nfs/dbraw/zinc/26/46/13/566264613.db2.gz SVVUHEJQUVRBBQ-WMLDXEAASA-N 2 1 387.977 3.021 20 0 GGADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)C1 ZINC000481928893 566265489 /nfs/dbraw/zinc/26/54/89/566265489.db2.gz SVVUHEJQUVRBBQ-PBHICJAKSA-N 2 1 387.977 3.021 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)C1 ZINC000481928893 566265492 /nfs/dbraw/zinc/26/54/92/566265492.db2.gz SVVUHEJQUVRBBQ-PBHICJAKSA-N 2 1 387.977 3.021 20 0 GGADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)C1 ZINC000481928895 566265823 /nfs/dbraw/zinc/26/58/23/566265823.db2.gz SVVUHEJQUVRBBQ-RHSMWYFYSA-N 2 1 387.977 3.021 20 0 GGADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)C1 ZINC000481928895 566265828 /nfs/dbraw/zinc/26/58/28/566265828.db2.gz SVVUHEJQUVRBBQ-RHSMWYFYSA-N 2 1 387.977 3.021 20 0 GGADMP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc(Br)cn1 ZINC000482155231 566287065 /nfs/dbraw/zinc/28/70/65/566287065.db2.gz HRTMECVOPTUKIT-ZBFHGGJFSA-N 2 1 397.361 3.273 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN([C@H]3CCc4cc(Br)ccc4NC3=O)CC[C@@H]21 ZINC000625221492 566290340 /nfs/dbraw/zinc/29/03/40/566290340.db2.gz AYIXLZJVFAAOGN-JLSDUUJJSA-N 2 1 392.341 3.119 20 0 GGADMP CC1CC[NH+]([C@H](CNC(=O)C[N@@H+](C)[C@H]2CCSC2)c2cccs2)CC1 ZINC000535317049 566296625 /nfs/dbraw/zinc/29/66/25/566296625.db2.gz CDVWTTXIVRGLHM-DLBZAZTESA-N 2 1 381.611 3.075 20 0 GGADMP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000482463316 566308715 /nfs/dbraw/zinc/30/87/15/566308715.db2.gz MWGZEYXIZSRKMT-NSHDSACASA-N 2 1 378.731 3.462 20 0 GGADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1 ZINC000482539752 566315938 /nfs/dbraw/zinc/31/59/38/566315938.db2.gz SLBSYBXPBFOSSE-WBVHZDCISA-N 2 1 383.989 3.388 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2cccc(I)c2)C1 ZINC000556601622 566316457 /nfs/dbraw/zinc/31/64/57/566316457.db2.gz QTDWKBDNIRYVPR-MRXNPFEDSA-N 2 1 384.305 3.455 20 0 GGADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1 ZINC000482539750 566316547 /nfs/dbraw/zinc/31/65/47/566316547.db2.gz SLBSYBXPBFOSSE-NVXWUHKLSA-N 2 1 383.989 3.388 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]CCC[N@H+]2CCC[C@@H](C(N)=O)C2)c2cccc(Br)c21 ZINC000482568305 566318400 /nfs/dbraw/zinc/31/84/00/566318400.db2.gz XKMJGUANRHPDIV-CKEIUWERSA-N 2 1 394.357 3.174 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+]1CCCN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000482641869 566322796 /nfs/dbraw/zinc/32/27/96/566322796.db2.gz LDQOHHLLZASIAO-NWDGAFQWSA-N 2 1 376.353 3.362 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+]1CCCN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000482641869 566322801 /nfs/dbraw/zinc/32/28/01/566322801.db2.gz LDQOHHLLZASIAO-NWDGAFQWSA-N 2 1 376.353 3.362 20 0 GGADMP C[N@H+]1CCC[C@]2(CCN([C@@H]3CCc4cc(Br)ccc4NC3=O)C2)C1 ZINC000625448443 566323335 /nfs/dbraw/zinc/32/33/35/566323335.db2.gz LHUCRPCERZIIKQ-MJGOQNOKSA-N 2 1 392.341 3.120 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+]1CCCN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000482641871 566323420 /nfs/dbraw/zinc/32/34/20/566323420.db2.gz LDQOHHLLZASIAO-VXGBXAGGSA-N 2 1 376.353 3.362 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+]1CCCN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000482641871 566323426 /nfs/dbraw/zinc/32/34/26/566323426.db2.gz LDQOHHLLZASIAO-VXGBXAGGSA-N 2 1 376.353 3.362 20 0 GGADMP C[N@H+]1CCC[C@@]2(CCN([C@@H]3CCc4cc(Br)ccc4NC3=O)C2)C1 ZINC000625448441 566323498 /nfs/dbraw/zinc/32/34/98/566323498.db2.gz LHUCRPCERZIIKQ-IEBWSBKVSA-N 2 1 392.341 3.120 20 0 GGADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1cc(Br)cc2F ZINC000482882201 566340604 /nfs/dbraw/zinc/34/06/04/566340604.db2.gz AFESODZPLCNHAB-KBXCAEBGSA-N 2 1 385.321 3.402 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCSCCOc1cccc(Br)c1 ZINC000482897385 566340787 /nfs/dbraw/zinc/34/07/87/566340787.db2.gz ZGEXFCJLSJTZQM-RHSMWYFYSA-N 2 1 387.387 3.491 20 0 GGADMP Cc1[nH+]c2ccc(Br)cc2c(NC[C@H]2C[N@@H+](C3CC3)CCO2)c1C ZINC000462826151 566356913 /nfs/dbraw/zinc/35/69/13/566356913.db2.gz KQWUWMGRCAWJCX-INIZCTEOSA-N 2 1 390.325 3.311 20 0 GGADMP Cc1[nH+]c2ccc(Br)cc2c(NC[C@H]2C[N@H+](C3CC3)CCO2)c1C ZINC000462826151 566356917 /nfs/dbraw/zinc/35/69/17/566356917.db2.gz KQWUWMGRCAWJCX-INIZCTEOSA-N 2 1 390.325 3.311 20 0 GGADMP C[C@@H]1CC[NH2+][C@@H](C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000649330288 566360942 /nfs/dbraw/zinc/36/09/42/566360942.db2.gz NLZXPYHHZVXVGG-FZKQIMNGSA-N 2 1 384.351 3.462 20 0 GGADMP C[C@@H]1CC[NH2+][C@H](C(=O)NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000649330287 566361865 /nfs/dbraw/zinc/36/18/65/566361865.db2.gz NLZXPYHHZVXVGG-ACJLOTCBSA-N 2 1 384.351 3.462 20 0 GGADMP [NH3+][C@@H](C(=O)NCC1([NH+]2CCSCC2)CCCCC1)c1cccc(Cl)c1 ZINC000649334233 566361889 /nfs/dbraw/zinc/36/18/89/566361889.db2.gz VKOVJRXLEQCESL-QGZVFWFLSA-N 2 1 381.973 3.208 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)C[C@H]1C)c1ccc(Br)cc1OCCCO ZINC000462964460 566371077 /nfs/dbraw/zinc/37/10/77/566371077.db2.gz MVDIFZNUPOPWDG-KEYYUXOJSA-N 2 1 385.346 3.201 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C[C@H]1C)c1ccc(Br)cc1OCCCO ZINC000462964460 566371083 /nfs/dbraw/zinc/37/10/83/566371083.db2.gz MVDIFZNUPOPWDG-KEYYUXOJSA-N 2 1 385.346 3.201 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1OCCCO ZINC000462949650 566371198 /nfs/dbraw/zinc/37/11/98/566371198.db2.gz YSQLOGFUPVMEFZ-USXIJHARSA-N 2 1 397.357 3.488 20 0 GGADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1OCCCO ZINC000462949650 566371207 /nfs/dbraw/zinc/37/12/07/566371207.db2.gz YSQLOGFUPVMEFZ-USXIJHARSA-N 2 1 397.357 3.488 20 0 GGADMP Cc1cc(C[N@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)sc1Br ZINC000536663572 566390160 /nfs/dbraw/zinc/39/01/60/566390160.db2.gz MLDKGMMPDFKEFH-HNNXBMFYSA-N 2 1 386.403 3.419 20 0 GGADMP Cc1cc(C[N@@H+]2CC[C@H](N3CC[NH+](C(C)C)CC3)C2)sc1Br ZINC000536663572 566390168 /nfs/dbraw/zinc/39/01/68/566390168.db2.gz MLDKGMMPDFKEFH-HNNXBMFYSA-N 2 1 386.403 3.419 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cnc(-c3ccsc3)s2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000536664624 566392075 /nfs/dbraw/zinc/39/20/75/566392075.db2.gz RKQOYOUCQJFIKK-QAPCUYQASA-N 2 1 376.595 3.329 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cnc(-c3ccsc3)s2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000536664624 566392078 /nfs/dbraw/zinc/39/20/78/566392078.db2.gz RKQOYOUCQJFIKK-QAPCUYQASA-N 2 1 376.595 3.329 20 0 GGADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(Br)cc1OCCCO ZINC000463373895 566405826 /nfs/dbraw/zinc/40/58/26/566405826.db2.gz YWOQJMKNNXRBPM-GDBMZVCRSA-N 2 1 385.346 3.345 20 0 GGADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Br)cc1OCCCO ZINC000463373895 566405830 /nfs/dbraw/zinc/40/58/30/566405830.db2.gz YWOQJMKNNXRBPM-GDBMZVCRSA-N 2 1 385.346 3.345 20 0 GGADMP CN(C(=O)Cc1c(Cl)cccc1Cl)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000601474821 566407899 /nfs/dbraw/zinc/40/78/99/566407899.db2.gz SMWZSNZVVNFHDI-OAHLLOKOSA-N 2 1 384.351 3.163 20 0 GGADMP CN(C(=O)Cc1c(Cl)cccc1Cl)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000601474817 566408358 /nfs/dbraw/zinc/40/83/58/566408358.db2.gz SMWZSNZVVNFHDI-HNNXBMFYSA-N 2 1 384.351 3.163 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1NCc1ccc(Cl)cc1I ZINC000447566702 566416235 /nfs/dbraw/zinc/41/62/35/566416235.db2.gz VTQIEHZMPYPOLR-IINYFYTJSA-N 2 1 378.685 3.374 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1cccc(Br)c1C ZINC000463619505 566422041 /nfs/dbraw/zinc/42/20/41/566422041.db2.gz RGOUCYMKKRYTEA-INIZCTEOSA-N 2 1 396.373 3.246 20 0 GGADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+][C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000484515645 566434128 /nfs/dbraw/zinc/43/41/28/566434128.db2.gz HWQUQKVRXROOFP-UXIGCNINSA-N 2 1 376.854 3.262 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+][C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000484515645 566434133 /nfs/dbraw/zinc/43/41/33/566434133.db2.gz HWQUQKVRXROOFP-UXIGCNINSA-N 2 1 376.854 3.262 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1ccc(C(F)(F)F)s1 ZINC000671683345 566438349 /nfs/dbraw/zinc/43/83/49/566438349.db2.gz VLQLYRJYJMHALD-CYBMUJFWSA-N 2 1 377.476 3.255 20 0 GGADMP C[NH+](C)CCOC1CC[NH+](Cc2nc3cc(Br)ccc3o2)CC1 ZINC000671681731 566439013 /nfs/dbraw/zinc/43/90/13/566439013.db2.gz YRWMCGVDNGEANQ-UHFFFAOYSA-N 2 1 382.302 3.133 20 0 GGADMP C[C@@H]1C[C@@H](C)[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)C[C@@H]1C[NH3+] ZINC000422637625 566460645 /nfs/dbraw/zinc/46/06/45/566460645.db2.gz PCNQSYUNNQDVLS-UPJWGTAASA-N 2 1 386.309 3.222 20 0 GGADMP COc1cc(Br)c(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1OC ZINC000422939522 566467125 /nfs/dbraw/zinc/46/71/25/566467125.db2.gz FZQCAHPCPBXIJW-NUEKZKHPSA-N 2 1 383.330 3.477 20 0 GGADMP [NH3+][C@H]1CCCCC[C@H]1[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000422989142 566469750 /nfs/dbraw/zinc/46/97/50/566469750.db2.gz KMESZRBPHFHEBF-DLBZAZTESA-N 2 1 382.346 3.035 20 0 GGADMP C[N@H+](CC(=O)Nc1ccc(SCC[NH+]2CCCC2)cc1)[C@H]1CCSC1 ZINC000650680266 566470144 /nfs/dbraw/zinc/47/01/44/566470144.db2.gz XJCIPHFCLVXLJC-KRWDZBQOSA-N 2 1 379.595 3.250 20 0 GGADMP C[N@@H+](CC(=O)Nc1ccc(SCC[NH+]2CCCC2)cc1)[C@H]1CCSC1 ZINC000650680266 566470148 /nfs/dbraw/zinc/47/01/48/566470148.db2.gz XJCIPHFCLVXLJC-KRWDZBQOSA-N 2 1 379.595 3.250 20 0 GGADMP COc1c(Br)cccc1C[N@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000650707673 566471118 /nfs/dbraw/zinc/47/11/18/566471118.db2.gz KQHRWUQUNRXYGO-LXZKKBNFSA-N 2 1 383.330 3.176 20 0 GGADMP C[C@H]([NH3+])[C@H]1COCC[C@@H]1[NH2+]Cc1cc(Br)ccc1Br ZINC000423051246 566471248 /nfs/dbraw/zinc/47/12/48/566471248.db2.gz MTNRRCLSDPGNOC-BHYNMZESSA-N 2 1 392.135 3.054 20 0 GGADMP Cc1cc(Br)cn2cc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)nc12 ZINC000423042262 566471557 /nfs/dbraw/zinc/47/15/57/566471557.db2.gz YVVGXTSDHPUZST-YESZJQIVSA-N 2 1 377.330 3.416 20 0 GGADMP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1cnn(-c3ccc(Br)cc3)c1)C2 ZINC000650708605 566472064 /nfs/dbraw/zinc/47/20/64/566472064.db2.gz GSDPKQVULZECCG-YJBOKZPZSA-N 2 1 375.314 3.196 20 0 GGADMP [NH3+]C[C@]12CCC[C@H]1C[N@@H+](Cc1cnn(-c3ccc(Br)cc3)c1)C2 ZINC000650708605 566472066 /nfs/dbraw/zinc/47/20/66/566472066.db2.gz GSDPKQVULZECCG-YJBOKZPZSA-N 2 1 375.314 3.196 20 0 GGADMP COc1c(Br)cccc1C[N@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000650707672 566472087 /nfs/dbraw/zinc/47/20/87/566472087.db2.gz KQHRWUQUNRXYGO-JLJPHGGASA-N 2 1 383.330 3.176 20 0 GGADMP COc1cc(Br)c(C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1OC ZINC000650718534 566474260 /nfs/dbraw/zinc/47/42/60/566474260.db2.gz QHOIVMPOHKKQLG-UHFFFAOYSA-N 2 1 383.261 3.354 20 0 GGADMP Clc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)ccc1I ZINC000423114160 566476985 /nfs/dbraw/zinc/47/69/85/566476985.db2.gz LQVBAZMVIWWMLS-FOSCPWQOSA-N 2 1 376.669 3.317 20 0 GGADMP C[N@H+](C[C@H](O)C[NH+]1CCC(C)(c2ccc(Br)cc2)CC1)C1CC1 ZINC000558467196 566477247 /nfs/dbraw/zinc/47/72/47/566477247.db2.gz UUJZOVKMHSHENF-SFHVURJKSA-N 2 1 381.358 3.258 20 0 GGADMP C[N@@H+](C[C@H](O)C[NH+]1CCC(C)(c2ccc(Br)cc2)CC1)C1CC1 ZINC000558467196 566477252 /nfs/dbraw/zinc/47/72/52/566477252.db2.gz UUJZOVKMHSHENF-SFHVURJKSA-N 2 1 381.358 3.258 20 0 GGADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H](CO)Cc2cc(Br)ccc2F)c2ccccc21 ZINC000423161434 566481036 /nfs/dbraw/zinc/48/10/36/566481036.db2.gz NVGMPOPIYLOZMF-GESALYCCSA-N 2 1 393.300 3.474 20 0 GGADMP Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)nnn1-c1cccc(Br)c1 ZINC000423364462 566485541 /nfs/dbraw/zinc/48/55/41/566485541.db2.gz ASOURXOOYWSFHO-TUKIKUTGSA-N 2 1 378.318 3.259 20 0 GGADMP Ic1ccc2c(c1)[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)CCCO2 ZINC000423365753 566486539 /nfs/dbraw/zinc/48/65/39/566486539.db2.gz PQJVXGJFNGXIBF-HIFRSBDPSA-N 2 1 386.277 3.237 20 0 GGADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCOc3ccc(I)cc32)CC[NH2+]1 ZINC000423381311 566486696 /nfs/dbraw/zinc/48/66/96/566486696.db2.gz OJJRERSDHBPVST-KYOSRNDESA-N 2 1 386.277 3.235 20 0 GGADMP Brc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423490603 566490831 /nfs/dbraw/zinc/49/08/31/566490831.db2.gz IGMYFKVWLXMFEN-CXAGYDPISA-N 2 1 378.314 3.276 20 0 GGADMP Brc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423490606 566491344 /nfs/dbraw/zinc/49/13/44/566491344.db2.gz IGMYFKVWLXMFEN-SUMWQHHRSA-N 2 1 378.314 3.276 20 0 GGADMP COc1ccc(C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c(Br)c1 ZINC000512011990 566505539 /nfs/dbraw/zinc/50/55/39/566505539.db2.gz XNXCJBVVCQGSDT-UHFFFAOYSA-N 2 1 394.313 3.083 20 0 GGADMP Cc1cc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)sc1Br ZINC000512050879 566509327 /nfs/dbraw/zinc/50/93/27/566509327.db2.gz FGTAELLBTWPOTD-STQMWFEESA-N 2 1 388.375 3.057 20 0 GGADMP C[C@H](Cc1ccc(F)cc1Br)[NH2+]CCCC[N@H+]1CCC[C@H]1CO ZINC000578395421 566517315 /nfs/dbraw/zinc/51/73/15/566517315.db2.gz AJFCPHHQKGHOOH-PBHICJAKSA-N 2 1 387.337 3.346 20 0 GGADMP C[C@H](Cc1ccc(F)cc1Br)[NH2+]CCCC[N@H+]1CCC[C@@H]1CO ZINC000578395422 566517821 /nfs/dbraw/zinc/51/78/21/566517821.db2.gz AJFCPHHQKGHOOH-RHSMWYFYSA-N 2 1 387.337 3.346 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c(Br)c1 ZINC000424285606 566524743 /nfs/dbraw/zinc/52/47/43/566524743.db2.gz GCAZXBOJAKYYMV-CQSZACIVSA-N 2 1 380.330 3.160 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c(Br)c1 ZINC000424285606 566524752 /nfs/dbraw/zinc/52/47/52/566524752.db2.gz GCAZXBOJAKYYMV-CQSZACIVSA-N 2 1 380.330 3.160 20 0 GGADMP C[C@H]1CC2(C[N@H+]1CCC(=O)Nc1ccc(Br)cc1F)CC[NH2+]CC2 ZINC000424289082 566524921 /nfs/dbraw/zinc/52/49/21/566524921.db2.gz LKFYUTKAUJWKOL-ZDUSSCGKSA-N 2 1 398.320 3.381 20 0 GGADMP C[C@H]1CC2(C[N@H+]1CCC(=O)Nc1ccc(Br)cc1)CC[NH2+]CC2 ZINC000424288028 566525173 /nfs/dbraw/zinc/52/51/73/566525173.db2.gz JSBMAGMPENMIMF-AWEZNQCLSA-N 2 1 380.330 3.242 20 0 GGADMP C[C@@H]1CC2(C[N@H+]1CCC(=O)Nc1ccccc1Br)CC[NH2+]CC2 ZINC000424283138 566525290 /nfs/dbraw/zinc/52/52/90/566525290.db2.gz AVIQPQDZNNHFKL-CQSZACIVSA-N 2 1 380.330 3.242 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1cc(Cl)cc(I)c1 ZINC000424286023 566525415 /nfs/dbraw/zinc/52/54/15/566525415.db2.gz FRZVCZHESACREI-HZMBPMFUSA-N 2 1 378.685 3.374 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CC2(C[C@H]1C)CC[NH2+]CC2)c1ccc(Br)cc1 ZINC000424301174 566526924 /nfs/dbraw/zinc/52/69/24/566526924.db2.gz XJKIJVBDXNFNSP-CABCVRRESA-N 2 1 394.357 3.090 20 0 GGADMP C[C@H]1CC2(C[N@H+]1CC(=O)N(C)Cc1cc(Cl)cc(Cl)c1)CC[NH2+]CC2 ZINC000424301555 566527388 /nfs/dbraw/zinc/52/73/88/566527388.db2.gz XQCSAKADAOAZBN-AWEZNQCLSA-N 2 1 384.351 3.416 20 0 GGADMP C[N@H+]1CCC[C@]2(CC[NH+](CCC(=O)Nc3ccc(Br)cc3)C2)C1 ZINC000559311306 566540281 /nfs/dbraw/zinc/54/02/81/566540281.db2.gz KMKOFOQJISXLMD-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CCC[C@]2(CC[N@H+](CCC(=O)Nc3ccc(Br)cc3)C2)C1 ZINC000559311306 566540288 /nfs/dbraw/zinc/54/02/88/566540288.db2.gz KMKOFOQJISXLMD-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCC(=O)Nc3ccc(Br)cc3)C2)C1 ZINC000559311306 566540295 /nfs/dbraw/zinc/54/02/95/566540295.db2.gz KMKOFOQJISXLMD-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCn2cc(Br)ccc2=O)CC1 ZINC000449379564 566553620 /nfs/dbraw/zinc/55/36/20/566553620.db2.gz TXFZBKHECUQYQW-MAUKXSAKSA-N 2 1 396.373 3.244 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCOc2ncc(Cl)cc2Cl)[C@H](C)C1 ZINC000539058041 566556720 /nfs/dbraw/zinc/55/67/20/566556720.db2.gz HXWQLWVYYDXBIT-PBHICJAKSA-N 2 1 390.355 3.494 20 0 GGADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856282 566562403 /nfs/dbraw/zinc/56/24/03/566562403.db2.gz NEGRZQFQUDPSSN-CVEARBPZSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856282 566562411 /nfs/dbraw/zinc/56/24/11/566562411.db2.gz NEGRZQFQUDPSSN-CVEARBPZSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856282 566562417 /nfs/dbraw/zinc/56/24/17/566562417.db2.gz NEGRZQFQUDPSSN-CVEARBPZSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000673856282 566562424 /nfs/dbraw/zinc/56/24/24/566562424.db2.gz NEGRZQFQUDPSSN-CVEARBPZSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CCC(CS(C)(=O)=O)CC2)[C@H]1c1cccs1 ZINC000559767396 566569260 /nfs/dbraw/zinc/56/92/60/566569260.db2.gz SJVQJZPOSISOJW-OLECLDRESA-N 2 1 384.611 3.324 20 0 GGADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CCC(CS(C)(=O)=O)CC2)[C@H]1c1cccs1 ZINC000559767396 566569265 /nfs/dbraw/zinc/56/92/65/566569265.db2.gz SJVQJZPOSISOJW-OLECLDRESA-N 2 1 384.611 3.324 20 0 GGADMP C[C@@H]1C[N@H+](C)C[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486233023 566571785 /nfs/dbraw/zinc/57/17/85/566571785.db2.gz UZFLNFMTCBEBGV-CJNGLKHVSA-N 2 1 384.351 3.272 20 0 GGADMP C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486233023 566571790 /nfs/dbraw/zinc/57/17/90/566571790.db2.gz UZFLNFMTCBEBGV-CJNGLKHVSA-N 2 1 384.351 3.272 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(Br)ccc2F)[C@H](C)C1 ZINC000449596720 566578401 /nfs/dbraw/zinc/57/84/01/566578401.db2.gz CFXMEQNLNMKVNM-LBTNJELSSA-N 2 1 387.337 3.059 20 0 GGADMP Cc1ccc(C[C@H](CO)C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1Br ZINC000449599468 566580353 /nfs/dbraw/zinc/58/03/53/566580353.db2.gz LASMTYSNJYIACB-RCCFBDPRSA-N 2 1 381.358 3.125 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](CO)Cc2ccc(C)c(Br)c2)[C@@H](C)C1 ZINC000449599171 566580410 /nfs/dbraw/zinc/58/04/10/566580410.db2.gz KDBPTNQEQPNNID-WDYCEAGBSA-N 2 1 383.374 3.228 20 0 GGADMP CC[N@H+](CCC[NH2+]Cc1ccc(S(N)(=O)=O)c(Cl)c1)C1CCCCC1 ZINC000651978753 566581023 /nfs/dbraw/zinc/58/10/23/566581023.db2.gz CQVHJFNWQUHYKD-UHFFFAOYSA-N 2 1 387.977 3.122 20 0 GGADMP CC[N@@H+](CCC[NH2+]Cc1ccc(S(N)(=O)=O)c(Cl)c1)C1CCCCC1 ZINC000651978753 566581028 /nfs/dbraw/zinc/58/10/28/566581028.db2.gz CQVHJFNWQUHYKD-UHFFFAOYSA-N 2 1 387.977 3.122 20 0 GGADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCCOc3ccc(I)cc32)CC1 ZINC000539507300 566585681 /nfs/dbraw/zinc/58/56/81/566585681.db2.gz LDIVRUGUKGDDSM-MRXNPFEDSA-N 2 1 398.288 3.356 20 0 GGADMP COc1cccc(Cl)c1C[NH2+]C[C@H](c1cccs1)N1CC[NH+](C)CC1 ZINC000605321812 566603007 /nfs/dbraw/zinc/60/30/07/566603007.db2.gz DRIBPIUHBZHSDH-QGZVFWFLSA-N 2 1 379.957 3.488 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3cc(Br)cc(F)c3F)C2)C1 ZINC000652350223 566603190 /nfs/dbraw/zinc/60/31/90/566603190.db2.gz MSBRBHUXOUWASD-DJSGYFEHSA-N 2 1 389.284 3.446 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](Cc3cc(Br)cc(F)c3F)C2)C1 ZINC000652350223 566603194 /nfs/dbraw/zinc/60/31/94/566603194.db2.gz MSBRBHUXOUWASD-DJSGYFEHSA-N 2 1 389.284 3.446 20 0 GGADMP COc1cccc(Cl)c1C[NH2+]C[C@@H](c1cccs1)N1CC[NH+](C)CC1 ZINC000605321811 566603499 /nfs/dbraw/zinc/60/34/99/566603499.db2.gz DRIBPIUHBZHSDH-KRWDZBQOSA-N 2 1 379.957 3.488 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](CCOc3ccccc3Br)C2)C1 ZINC000652349173 566603561 /nfs/dbraw/zinc/60/35/61/566603561.db2.gz DUILNJOYBQQDST-DAYGRLMNSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3cn4cc(Cl)cc(Cl)c4n3)C2)C1 ZINC000652348385 566603699 /nfs/dbraw/zinc/60/36/99/566603699.db2.gz BOBUJLOOVHQVHF-SUYBPPKGSA-N 2 1 383.323 3.359 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](Cc3cn4cc(Cl)cc(Cl)c4n3)C2)C1 ZINC000652348385 566603703 /nfs/dbraw/zinc/60/37/03/566603703.db2.gz BOBUJLOOVHQVHF-SUYBPPKGSA-N 2 1 383.323 3.359 20 0 GGADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](CCOc3ccc(Br)cc3)C2)C1 ZINC000652345982 566603893 /nfs/dbraw/zinc/60/38/93/566603893.db2.gz QKMNAKALSVENQR-QGPMSJSTSA-N 2 1 383.330 3.046 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](CC(=O)Nc3ccc(Cl)cc3Cl)C2)C1 ZINC000652346113 566603908 /nfs/dbraw/zinc/60/39/08/566603908.db2.gz UDQKSFJURKRJDK-QEORTHHSSA-N 2 1 386.323 3.150 20 0 GGADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](CC(=O)Nc3ccc(Cl)cc3Cl)C2)C1 ZINC000652346113 566603913 /nfs/dbraw/zinc/60/39/13/566603913.db2.gz UDQKSFJURKRJDK-QEORTHHSSA-N 2 1 386.323 3.150 20 0 GGADMP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](Cc3cnc(-c4ccsc4)s3)C2)CC1 ZINC000539820942 566604455 /nfs/dbraw/zinc/60/44/55/566604455.db2.gz RYFHEWHNRWEKDT-KRWDZBQOSA-N 2 1 376.595 3.472 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)[C@@H]1CC[NH3+] ZINC000652353994 566605883 /nfs/dbraw/zinc/60/58/83/566605883.db2.gz KARKIISMXPDGRG-MLGOLLRUSA-N 2 1 386.309 3.366 20 0 GGADMP Cc1ccc(C[N@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)c(Br)c1 ZINC000539862980 566608947 /nfs/dbraw/zinc/60/89/47/566608947.db2.gz QZKAQXXRFLUOBP-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP Cc1ccc(C[N@@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)c(Br)c1 ZINC000539862980 566608953 /nfs/dbraw/zinc/60/89/53/566608953.db2.gz QZKAQXXRFLUOBP-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP COc1cc2[nH+]ccc(N[C@H]3CC[N@H+]4CCC[C@H]4C3)c2cc1Br ZINC000425209609 566617179 /nfs/dbraw/zinc/61/71/79/566617179.db2.gz SDDIRRBVDHSJMC-STQMWFEESA-N 2 1 376.298 3.467 20 0 GGADMP COc1cc2[nH+]ccc(N[C@@H]3CC[N@H+]4CCC[C@H]4C3)c2cc1Br ZINC000425209607 566617261 /nfs/dbraw/zinc/61/72/61/566617261.db2.gz SDDIRRBVDHSJMC-OLZOCXBDSA-N 2 1 376.298 3.467 20 0 GGADMP Cc1ccc(C[NH2+]Cc2ccncc2OCC[NH+](C)C)c(Br)c1 ZINC000579756316 566637135 /nfs/dbraw/zinc/63/71/35/566637135.db2.gz JCLADDOIVYUIBS-UHFFFAOYSA-N 2 1 378.314 3.383 20 0 GGADMP Brc1cnn(CC[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000560580593 566640706 /nfs/dbraw/zinc/64/07/06/566640706.db2.gz KVUIMZZSTNZZAT-YTQUADARSA-N 2 1 389.341 3.146 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@H]1CCC[NH2+]CC1 ZINC000653119861 566651374 /nfs/dbraw/zinc/65/13/74/566651374.db2.gz ZHRLNKYKWUIDST-HNNXBMFYSA-N 2 1 384.351 3.464 20 0 GGADMP C[NH+]1CCN([C@@H](C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c2cccs2)CC1 ZINC000675723837 566661046 /nfs/dbraw/zinc/66/10/46/566661046.db2.gz BFZTUTCFECWWCP-OALUTQOASA-N 2 1 375.969 3.447 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+][C@H]1CCc2cccc(Br)c2C1 ZINC000580087758 566664763 /nfs/dbraw/zinc/66/47/63/566664763.db2.gz ABOUXRJYOMVQSP-DLBZAZTESA-N 2 1 381.358 3.133 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](CCOc2cccc(Br)c2)CC[C@@H]1C(F)(F)F ZINC000629562507 566665922 /nfs/dbraw/zinc/66/59/22/566665922.db2.gz NQTJZHQHEJFOKC-FZMZJTMJSA-N 2 1 381.236 3.287 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](CCOc2cccc(Br)c2)CC[C@@H]1C(F)(F)F ZINC000629562507 566665925 /nfs/dbraw/zinc/66/59/25/566665925.db2.gz NQTJZHQHEJFOKC-FZMZJTMJSA-N 2 1 381.236 3.287 20 0 GGADMP CSc1ccccc1NC(=O)CC[N@H+]1CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629567688 566666274 /nfs/dbraw/zinc/66/62/74/566666274.db2.gz PYXWAAPQTBSQIV-STQMWFEESA-N 2 1 375.460 3.196 20 0 GGADMP CSc1ccccc1NC(=O)CC[N@H+]1CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629567687 566666303 /nfs/dbraw/zinc/66/63/03/566666303.db2.gz PYXWAAPQTBSQIV-QWHCGFSZSA-N 2 1 375.460 3.196 20 0 GGADMP COc1c(Br)cc(C[NH2+]CCC[NH2+]C2CC2)cc1Br ZINC000580168734 566671506 /nfs/dbraw/zinc/67/15/06/566671506.db2.gz RVSAVYUQXIYTQZ-UHFFFAOYSA-N 2 1 392.135 3.452 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+]CCC(=O)Nc1ccc(Br)cc1 ZINC000514856111 566674789 /nfs/dbraw/zinc/67/47/89/566674789.db2.gz REFUCSUAUUZYHN-UHFFFAOYSA-N 2 1 379.302 3.353 20 0 GGADMP Cc1ccc(Br)cc1C(=O)Nc1c[nH+]ccc1N1CC[NH+](C)CC1 ZINC000607805846 566682158 /nfs/dbraw/zinc/68/21/58/566682158.db2.gz PZEPXDWNVHUMJA-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP O=C(NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)N[C@@H]1CCC[NH2+]C1 ZINC000515004563 566685178 /nfs/dbraw/zinc/68/51/78/566685178.db2.gz XHBJCNMZEYLKFE-QGZVFWFLSA-N 2 1 385.339 3.009 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cscc3Cl)c2)C1 ZINC000676415667 566690820 /nfs/dbraw/zinc/69/08/20/566690820.db2.gz GORDJBKGVXUYBM-MRXNPFEDSA-N 2 1 377.941 3.389 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cscc3Cl)c2)C1 ZINC000676415667 566690830 /nfs/dbraw/zinc/69/08/30/566690830.db2.gz GORDJBKGVXUYBM-MRXNPFEDSA-N 2 1 377.941 3.389 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)Nc1ccccc1Br ZINC000561278915 566690966 /nfs/dbraw/zinc/69/09/66/566690966.db2.gz SYDGIQKEQPCASA-IRXDYDNUSA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)Nc1ccccc1Br ZINC000561278915 566690973 /nfs/dbraw/zinc/69/09/73/566690973.db2.gz SYDGIQKEQPCASA-IRXDYDNUSA-N 2 1 380.330 3.384 20 0 GGADMP C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccnc2c(Br)cccc12 ZINC000561356686 566698090 /nfs/dbraw/zinc/69/80/90/566698090.db2.gz XZUBHNHVYCCVKX-ZIAGYGMSSA-N 2 1 376.298 3.297 20 0 GGADMP C[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1cncc(Br)c1 ZINC000580572496 566705592 /nfs/dbraw/zinc/70/55/92/566705592.db2.gz YHSCCXQTIXESLA-CYBMUJFWSA-N 2 1 379.302 3.030 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000580646598 566712157 /nfs/dbraw/zinc/71/21/57/566712157.db2.gz OBAMGVWUEGNACY-JYJNAYRXSA-N 2 1 394.357 3.406 20 0 GGADMP Cc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000580646598 566712158 /nfs/dbraw/zinc/71/21/58/566712158.db2.gz OBAMGVWUEGNACY-JYJNAYRXSA-N 2 1 394.357 3.406 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H](C[NH3+])C2(C1)CCOCC2 ZINC000580774762 566720977 /nfs/dbraw/zinc/72/09/77/566720977.db2.gz MALUBYVFERJFKS-STQMWFEESA-N 2 1 386.323 3.008 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H](C[NH3+])C2(C1)CCOCC2 ZINC000580774762 566720980 /nfs/dbraw/zinc/72/09/80/566720980.db2.gz MALUBYVFERJFKS-STQMWFEESA-N 2 1 386.323 3.008 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cc4c(cc3Br)OCCCO4)C[C@@H]21 ZINC000515649767 566725202 /nfs/dbraw/zinc/72/52/02/566725202.db2.gz PUSHSEROCNLSEC-DUVNUKRYSA-N 2 1 381.314 3.170 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3cc4c(cc3Br)OCCCO4)C[C@@H]21 ZINC000515649767 566725207 /nfs/dbraw/zinc/72/52/07/566725207.db2.gz PUSHSEROCNLSEC-DUVNUKRYSA-N 2 1 381.314 3.170 20 0 GGADMP COCC[N@@H+](C)CCC[NH2+]Cc1cc(Br)cc(Br)c1 ZINC000561739035 566734498 /nfs/dbraw/zinc/73/44/98/566734498.db2.gz VQMDAPVGDUOMCW-UHFFFAOYSA-N 2 1 394.151 3.270 20 0 GGADMP CC[C@@H]1[NH2+]CC[C@@H]1C(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000581130573 566752141 /nfs/dbraw/zinc/75/21/41/566752141.db2.gz RHNWQEVPQBBXRX-ROUUACIJSA-N 2 1 384.351 3.462 20 0 GGADMP CC(C)[NH+]1CCN(C2CC[NH+](Cc3ccccc3Br)CC2)CC1 ZINC000677739396 566761885 /nfs/dbraw/zinc/76/18/85/566761885.db2.gz YNJXVFIVQFEDFS-UHFFFAOYSA-N 2 1 380.374 3.440 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccnc(-c4ccc(Br)cc4)n3)C[C@H]21 ZINC000581251701 566762050 /nfs/dbraw/zinc/76/20/50/566762050.db2.gz GEADLVIKOWKJMT-BMGDILEWSA-N 2 1 387.325 3.465 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccnc(-c4ccc(Br)cc4)n3)C[C@H]21 ZINC000581251704 566762713 /nfs/dbraw/zinc/76/27/13/566762713.db2.gz GEADLVIKOWKJMT-ZTFGCOKTSA-N 2 1 387.325 3.465 20 0 GGADMP C[N@@H+](Cc1ccc(F)c(Br)c1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000677801144 566763303 /nfs/dbraw/zinc/76/33/03/566763303.db2.gz DRAYJPANCLQYII-INIZCTEOSA-N 2 1 384.337 3.189 20 0 GGADMP O=C(C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)Nc1cccc(Br)c1 ZINC000581364196 566769970 /nfs/dbraw/zinc/76/99/70/566769970.db2.gz IUPPPNRFBJHKEG-BRWVUGGUSA-N 2 1 380.330 3.288 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3ccncc3Br)CC2)oc1C ZINC000631070254 566776271 /nfs/dbraw/zinc/77/62/71/566776271.db2.gz RLOLTKBDNLKXBS-UHFFFAOYSA-N 2 1 393.329 3.451 20 0 GGADMP C[N@@H+](CCSc1ccnc2cc(Cl)ccc21)C1CCN(CCO)CC1 ZINC000489253221 566777119 /nfs/dbraw/zinc/77/71/19/566777119.db2.gz XQFLLDJJZFSLMJ-UHFFFAOYSA-N 2 1 379.957 3.369 20 0 GGADMP Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000469874317 566822995 /nfs/dbraw/zinc/82/29/95/566822995.db2.gz QCCLHHDHXVJHSC-KKXDTOCCSA-N 2 1 375.314 3.112 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000469877938 566824112 /nfs/dbraw/zinc/82/41/12/566824112.db2.gz IOLFPMIRZRHSAL-WBAXXEDZSA-N 2 1 397.357 3.424 20 0 GGADMP CCOCCOc1ccc(Br)cc1C[N@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000469877938 566824117 /nfs/dbraw/zinc/82/41/17/566824117.db2.gz IOLFPMIRZRHSAL-WBAXXEDZSA-N 2 1 397.357 3.424 20 0 GGADMP CCOc1c(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)cc1OC ZINC000469888310 566825303 /nfs/dbraw/zinc/82/53/03/566825303.db2.gz KIAIRVPZRPAADW-SQWLQELKSA-N 2 1 383.330 3.416 20 0 GGADMP CCOc1c(Br)cc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)cc1OC ZINC000469888310 566825307 /nfs/dbraw/zinc/82/53/07/566825307.db2.gz KIAIRVPZRPAADW-SQWLQELKSA-N 2 1 383.330 3.416 20 0 GGADMP [NH3+]CCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000469995334 566834685 /nfs/dbraw/zinc/83/46/85/566834685.db2.gz YYSPVVKBMXHLTB-CQSZACIVSA-N 2 1 377.941 3.355 20 0 GGADMP Fc1ccc(Br)cc1CC[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000655700938 566836611 /nfs/dbraw/zinc/83/66/11/566836611.db2.gz RDQNGVNJYDGTCN-QGZVFWFLSA-N 2 1 385.321 3.364 20 0 GGADMP COc1cc(Br)c(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c(OC)c1 ZINC000470005925 566837112 /nfs/dbraw/zinc/83/71/12/566837112.db2.gz KGISPPOJUJKVRN-QGZVFWFLSA-N 2 1 383.330 3.430 20 0 GGADMP COCC[N@H+](C)CCC[NH2+]Cc1cn(-c2cccc(Br)c2)nc1C ZINC000655711189 566838158 /nfs/dbraw/zinc/83/81/58/566838158.db2.gz GEFQOKIDUOCJBL-UHFFFAOYSA-N 2 1 395.345 3.001 20 0 GGADMP COCC[N@@H+](C)CCC[NH2+]Cc1cn(-c2cccc(Br)c2)nc1C ZINC000655711189 566838162 /nfs/dbraw/zinc/83/81/62/566838162.db2.gz GEFQOKIDUOCJBL-UHFFFAOYSA-N 2 1 395.345 3.001 20 0 GGADMP Cc1cc(Br)cn2c(C[NH+]3CCC([C@@H]4CCC[NH2+]4)CC3)cnc12 ZINC000470014091 566838589 /nfs/dbraw/zinc/83/85/89/566838589.db2.gz UVVIKRZKZWWJJV-KRWDZBQOSA-N 2 1 377.330 3.369 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)Oc1ccc(Br)cc1 ZINC000655718710 566838628 /nfs/dbraw/zinc/83/86/28/566838628.db2.gz QFKNVJZCKHZMPL-DNVCBOLYSA-N 2 1 397.357 3.449 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)Oc1ccc(Br)cc1 ZINC000655719532 566839016 /nfs/dbraw/zinc/83/90/16/566839016.db2.gz VDABOICLEJXXQI-YOEHRIQHSA-N 2 1 383.330 3.059 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)Oc1ccc(Br)cc1 ZINC000655718711 566839088 /nfs/dbraw/zinc/83/90/88/566839088.db2.gz QFKNVJZCKHZMPL-HNAYVOBHSA-N 2 1 397.357 3.449 20 0 GGADMP C[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)Oc1cccc(Br)c1 ZINC000655719554 566839186 /nfs/dbraw/zinc/83/91/86/566839186.db2.gz VXDUPJUQIQLUFD-RHSMWYFYSA-N 2 1 383.330 3.059 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+]Cc2oc3ccccc3c2Br)CC1 ZINC000655731377 566840588 /nfs/dbraw/zinc/84/05/88/566840588.db2.gz XAVCWNFJTWNKGY-UHFFFAOYSA-N 2 1 380.330 3.313 20 0 GGADMP Cc1nn(-c2ccccc2Br)cc1C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000655734056 566840633 /nfs/dbraw/zinc/84/06/33/566840633.db2.gz YFHXEFWKFNQQEZ-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP Cc1nn(-c2ccccc2Br)cc1C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000655734056 566840638 /nfs/dbraw/zinc/84/06/38/566840638.db2.gz YFHXEFWKFNQQEZ-OAHLLOKOSA-N 2 1 377.330 3.375 20 0 GGADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@H](O)COCc2cccs2)[C@H]1c1cccs1 ZINC000562994564 566842177 /nfs/dbraw/zinc/84/21/77/566842177.db2.gz CBQCAEKRTAYDAB-GJYPPUQNSA-N 2 1 380.579 3.360 20 0 GGADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@H](O)COCc2cccs2)[C@H]1c1cccs1 ZINC000562994564 566842186 /nfs/dbraw/zinc/84/21/86/566842186.db2.gz CBQCAEKRTAYDAB-GJYPPUQNSA-N 2 1 380.579 3.360 20 0 GGADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@H](O)COCc2cccs2)[C@H]1c1cccs1 ZINC000562994572 566842526 /nfs/dbraw/zinc/84/25/26/566842526.db2.gz CBQCAEKRTAYDAB-MDZRGWNJSA-N 2 1 380.579 3.360 20 0 GGADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@@H](O)COCc2cccs2)[C@H]1c1cccs1 ZINC000562994572 566842532 /nfs/dbraw/zinc/84/25/32/566842532.db2.gz CBQCAEKRTAYDAB-MDZRGWNJSA-N 2 1 380.579 3.360 20 0 GGADMP COc1cc(Br)ccc1CCC[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655754209 566845621 /nfs/dbraw/zinc/84/56/21/566845621.db2.gz MYJWDTZFWYNXNJ-GOSISDBHSA-N 2 1 397.357 3.233 20 0 GGADMP Brc1ccc2[nH]c(C[NH2+]C3CC[NH+]([C@H]4CCOC4)CC3)cc2c1 ZINC000655757035 566846126 /nfs/dbraw/zinc/84/61/26/566846126.db2.gz OCPOBXXDRBLPCA-KRWDZBQOSA-N 2 1 378.314 3.273 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccc(Br)cc2)C(C)C)CC1 ZINC000517856068 566850583 /nfs/dbraw/zinc/85/05/83/566850583.db2.gz BGGUDCVFBYORNP-UHFFFAOYSA-N 2 1 396.373 3.260 20 0 GGADMP O=C1[C@H]([NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)CCN1c1ccc(Cl)cc1Cl ZINC000563149540 566859675 /nfs/dbraw/zinc/85/96/75/566859675.db2.gz BMKHDYKIKXSEHN-RDTXWAMCSA-N 2 1 382.335 3.420 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCC(=O)Nc2c(Cl)cccc2Cl)CC12CCOCC2 ZINC000563154558 566860449 /nfs/dbraw/zinc/86/04/49/566860449.db2.gz PSGZTOHEUFCGME-CYBMUJFWSA-N 2 1 386.323 3.009 20 0 GGADMP O=C1[C@H]([N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)CCN1c1ccc(Cl)cc1Cl ZINC000563155021 566860590 /nfs/dbraw/zinc/86/05/90/566860590.db2.gz XYCKYNRIRKXCLJ-PMUMKWKESA-N 2 1 382.335 3.420 20 0 GGADMP Nc1c(Br)cc(Br)cc1C[NH2+]CCC[NH+]1CCCC1 ZINC000470322252 566863167 /nfs/dbraw/zinc/86/31/67/566863167.db2.gz HKNINABYKLRZIZ-UHFFFAOYSA-N 2 1 391.151 3.369 20 0 GGADMP C[C@H]1C[N@H+](CCOc2cc(Cl)cc(Cl)c2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000490632676 566872697 /nfs/dbraw/zinc/87/26/97/566872697.db2.gz SXSGUEIPFWJIMG-KXBFYZLASA-N 2 1 386.367 3.330 20 0 GGADMP C[C@H]1C[N@@H+](CCOc2cc(Cl)cc(Cl)c2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000490632676 566872701 /nfs/dbraw/zinc/87/27/01/566872701.db2.gz SXSGUEIPFWJIMG-KXBFYZLASA-N 2 1 386.367 3.330 20 0 GGADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cn4ccc(Br)cc4n3)C2)CC1 ZINC000563325272 566876450 /nfs/dbraw/zinc/87/64/50/566876450.db2.gz RAZCQMACEICPIC-OAHLLOKOSA-N 2 1 377.330 3.261 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cncc(Br)c1 ZINC000518566018 566892284 /nfs/dbraw/zinc/89/22/84/566892284.db2.gz WLHJOUAYGYVIDD-LIRRHRJNSA-N 2 1 390.325 3.262 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+](Cc2cccc(Br)c2)C(C)C)CC1 ZINC000518597146 566893904 /nfs/dbraw/zinc/89/39/04/566893904.db2.gz IVRRCUVYMNRMKZ-UHFFFAOYSA-N 2 1 396.373 3.260 20 0 GGADMP Cc1cc(Br)ccc1NC(=O)CC[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000680479010 566910513 /nfs/dbraw/zinc/91/05/13/566910513.db2.gz RBWGMAUVHYGINY-HOTGVXAUSA-N 2 1 380.330 3.303 20 0 GGADMP COCC[N@H+](C)CC[C@H](Nc1cc[nH+]cc1Br)c1ccccc1 ZINC000492178260 566927022 /nfs/dbraw/zinc/92/70/22/566927022.db2.gz KZXGJQPTQPESAV-KRWDZBQOSA-N 2 1 378.314 3.388 20 0 GGADMP COCC[N@@H+](C)CC[C@H](Nc1cc[nH+]cc1Br)c1ccccc1 ZINC000492178260 566927025 /nfs/dbraw/zinc/92/70/25/566927025.db2.gz KZXGJQPTQPESAV-KRWDZBQOSA-N 2 1 378.314 3.388 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+][C@@H]2CCCc3c(Br)cccc32)C1 ZINC000544010925 566928058 /nfs/dbraw/zinc/92/80/58/566928058.db2.gz IPPKNNGTCRVDDA-KBXCAEBGSA-N 2 1 394.357 3.004 20 0 GGADMP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCc3sc(Br)cc32)CC1 ZINC000583217367 566930902 /nfs/dbraw/zinc/93/09/02/566930902.db2.gz XWJZJHLHEUDLFK-QLFBSQMISA-N 2 1 385.371 3.465 20 0 GGADMP O[C@@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)COCc1cccs1 ZINC000564079007 566943759 /nfs/dbraw/zinc/94/37/59/566943759.db2.gz YWIMLJXXEVWRLT-IRXDYDNUSA-N 2 1 380.579 3.189 20 0 GGADMP O[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)COCc1cccs1 ZINC000564079007 566943764 /nfs/dbraw/zinc/94/37/64/566943764.db2.gz YWIMLJXXEVWRLT-IRXDYDNUSA-N 2 1 380.579 3.189 20 0 GGADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cccc(I)c3)C2)CC1 ZINC000564250385 566957790 /nfs/dbraw/zinc/95/77/90/566957790.db2.gz DOSJHGJIFSOENK-MRXNPFEDSA-N 2 1 384.305 3.455 20 0 GGADMP Cn1ccnc1[C@H]1CC[N@H+](Cc2cn(-c3cccc(Cl)c3Cl)nn2)C1 ZINC000564318703 566963545 /nfs/dbraw/zinc/96/35/45/566963545.db2.gz FLTFGDKIGPMLEZ-LBPRGKRZSA-N 2 1 377.279 3.297 20 0 GGADMP Cc1cc(Br)cc2c1[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)CC2 ZINC000493975038 566965691 /nfs/dbraw/zinc/96/56/91/566965691.db2.gz DWZMGPUNMPFAHG-GOSISDBHSA-N 2 1 380.374 3.362 20 0 GGADMP Cc1cc(NC(=O)C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)ccc1Br ZINC000583934971 566996034 /nfs/dbraw/zinc/99/60/34/566996034.db2.gz GCEJDMBCEOXNDN-OAHLLOKOSA-N 2 1 380.330 3.018 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2nnc(C3CC[NH2+]CC3)[nH]2)c2cccc(Br)c21 ZINC000564841023 567012896 /nfs/dbraw/zinc/01/28/96/567012896.db2.gz LSVNCCMDPMJKDH-IAQYHMDHSA-N 2 1 390.329 3.372 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2nnc(C3CC[NH2+]CC3)[nH]2)c2cccc(Br)c21 ZINC000564841022 567013127 /nfs/dbraw/zinc/01/31/27/567013127.db2.gz LSVNCCMDPMJKDH-ABAIWWIYSA-N 2 1 390.329 3.372 20 0 GGADMP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1nnc(C3CC[NH2+]CC3)[nH]1)CC2 ZINC000564840481 567013376 /nfs/dbraw/zinc/01/33/76/567013376.db2.gz IGWDDJKCZKKLKE-HNNXBMFYSA-N 2 1 390.329 3.120 20 0 GGADMP C[NH+]1CCN(c2cc[nH+]cc2NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1 ZINC000584147393 567015763 /nfs/dbraw/zinc/01/57/63/567015763.db2.gz YHABRVGBMITXRL-CHWSQXEVSA-N 2 1 376.913 3.291 20 0 GGADMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000430579271 567022374 /nfs/dbraw/zinc/02/23/74/567022374.db2.gz CAQGUHRVEMSCEF-KGLIPLIRSA-N 2 1 388.293 3.119 20 0 GGADMP O=C(NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1C[C@@]12CC[NH2+]C2 ZINC000564939622 567022680 /nfs/dbraw/zinc/02/26/80/567022680.db2.gz FKWFAKQWZAWRQF-PKOBYXMFSA-N 2 1 382.335 3.074 20 0 GGADMP O=C(NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1C[C@]12CC[NH2+]C2 ZINC000564939614 567023177 /nfs/dbraw/zinc/02/31/77/567023177.db2.gz FKWFAKQWZAWRQF-HKUYNNGSSA-N 2 1 382.335 3.074 20 0 GGADMP CC(C)[C@@H]([NH3+])CC[N@H+](C)[C@@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000430583541 567023340 /nfs/dbraw/zinc/02/33/40/567023340.db2.gz MWKCAYCFBOYRSP-YOEHRIQHSA-N 2 1 384.362 3.101 20 0 GGADMP CC(C)[C@@H]([NH3+])CC[N@@H+](C)[C@@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000430583541 567023348 /nfs/dbraw/zinc/02/33/48/567023348.db2.gz MWKCAYCFBOYRSP-YOEHRIQHSA-N 2 1 384.362 3.101 20 0 GGADMP C[C@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@]1(O)CC[N@H+](C)C1 ZINC000545161391 567024088 /nfs/dbraw/zinc/02/40/88/567024088.db2.gz UHGOQFZFVQEEIC-AUUYWEPGSA-N 2 1 393.325 3.026 20 0 GGADMP Cc1cc(NC(=O)C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)ccc1Br ZINC000564989600 567028200 /nfs/dbraw/zinc/02/82/00/567028200.db2.gz TXSUNQSHROUQDY-GJZGRUSLSA-N 2 1 380.330 3.018 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](C[NH2+]CCC(=O)Nc2cccc(Br)c2)C1 ZINC000584286958 567029005 /nfs/dbraw/zinc/02/90/05/567029005.db2.gz OWFZJBBIPXSTLI-OAHLLOKOSA-N 2 1 382.346 3.345 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](C[NH2+]CCC(=O)Nc2cccc(Br)c2)C1 ZINC000584286957 567029348 /nfs/dbraw/zinc/02/93/48/567029348.db2.gz OWFZJBBIPXSTLI-HNNXBMFYSA-N 2 1 382.346 3.345 20 0 GGADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492724 567029802 /nfs/dbraw/zinc/02/98/02/567029802.db2.gz CHZHYIDAMIRZGC-WBVHZDCISA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492724 567029810 /nfs/dbraw/zinc/02/98/10/567029810.db2.gz CHZHYIDAMIRZGC-WBVHZDCISA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492724 567029814 /nfs/dbraw/zinc/02/98/14/567029814.db2.gz CHZHYIDAMIRZGC-WBVHZDCISA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492724 567029819 /nfs/dbraw/zinc/02/98/19/567029819.db2.gz CHZHYIDAMIRZGC-WBVHZDCISA-N 2 1 387.351 3.397 20 0 GGADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492722 567030225 /nfs/dbraw/zinc/03/02/25/567030225.db2.gz CHZHYIDAMIRZGC-RDJZCZTQSA-N 2 1 387.351 3.397 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492722 567030226 /nfs/dbraw/zinc/03/02/26/567030226.db2.gz CHZHYIDAMIRZGC-RDJZCZTQSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492722 567030231 /nfs/dbraw/zinc/03/02/31/567030231.db2.gz CHZHYIDAMIRZGC-RDJZCZTQSA-N 2 1 387.351 3.397 20 0 GGADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000472492722 567030233 /nfs/dbraw/zinc/03/02/33/567030233.db2.gz CHZHYIDAMIRZGC-RDJZCZTQSA-N 2 1 387.351 3.397 20 0 GGADMP Cc1ccc(C[N@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Br ZINC000682085667 567031155 /nfs/dbraw/zinc/03/11/55/567031155.db2.gz KOCMEWWAGNGYSW-GOSISDBHSA-N 2 1 380.374 3.358 20 0 GGADMP Brc1ccc(-c2noc(C[NH+]3CCC4(CC[NH2+]C4)CC3)n2)s1 ZINC000431014602 567047287 /nfs/dbraw/zinc/04/72/87/567047287.db2.gz OELVGYHTQIMYGI-UHFFFAOYSA-N 2 1 383.315 3.136 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cncc(Br)c2C)[C@H](C)C1 ZINC000657362345 567052394 /nfs/dbraw/zinc/05/23/94/567052394.db2.gz AJGGCYZRYGGOEO-RDTXWAMCSA-N 2 1 384.362 3.379 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cncc(Br)c2C)[C@H](C)C1 ZINC000657362345 567052399 /nfs/dbraw/zinc/05/23/99/567052399.db2.gz AJGGCYZRYGGOEO-RDTXWAMCSA-N 2 1 384.362 3.379 20 0 GGADMP COC(=O)c1ccc(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c(Br)c1 ZINC000584557296 567054206 /nfs/dbraw/zinc/05/42/06/567054206.db2.gz RRPRSURLZVQTMY-MRXNPFEDSA-N 2 1 395.341 3.399 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2ccc(OC)cc2Br)C1 ZINC000584687140 567061326 /nfs/dbraw/zinc/06/13/26/567061326.db2.gz JYSNXPOJIXGZBO-KRWDZBQOSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2ccc(OC)cc2Br)C1 ZINC000584687140 567061332 /nfs/dbraw/zinc/06/13/32/567061332.db2.gz JYSNXPOJIXGZBO-KRWDZBQOSA-N 2 1 385.346 3.390 20 0 GGADMP Cc1ccc(NC(=O)C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000584721724 567064863 /nfs/dbraw/zinc/06/48/63/567064863.db2.gz WRIBSGILFALEPB-CABCVRRESA-N 2 1 380.330 3.018 20 0 GGADMP Cc1ccc(NC(=O)C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c(Br)c1 ZINC000584721724 567064870 /nfs/dbraw/zinc/06/48/70/567064870.db2.gz WRIBSGILFALEPB-CABCVRRESA-N 2 1 380.330 3.018 20 0 GGADMP C[N@@H+]1CC[C@@H]([NH2+]CCn2cc(Br)ccc2=O)C[C@H]1c1ccccc1 ZINC000453261724 567069625 /nfs/dbraw/zinc/06/96/25/567069625.db2.gz YWVCATBTASIRJC-MSOLQXFVSA-N 2 1 390.325 3.036 20 0 GGADMP C[N@H+]1CC[C@@H]([NH2+]CCn2cc(Br)ccc2=O)C[C@H]1c1ccccc1 ZINC000453261724 567069630 /nfs/dbraw/zinc/06/96/30/567069630.db2.gz YWVCATBTASIRJC-MSOLQXFVSA-N 2 1 390.325 3.036 20 0 GGADMP Cc1c(Br)cccc1C[C@H](CO)C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000453345326 567078520 /nfs/dbraw/zinc/07/85/20/567078520.db2.gz FFJWOQRCWBNISJ-IWKLRQMXSA-N 2 1 383.374 3.227 20 0 GGADMP COc1ccc(C[NH2+]C[C@@H](c2cccs2)N2CC[NH+](C)CC2)c(Cl)c1 ZINC000521806339 567080578 /nfs/dbraw/zinc/08/05/78/567080578.db2.gz XEHIYGMXIUHSNT-SFHVURJKSA-N 2 1 379.957 3.488 20 0 GGADMP C[N@H+]1CC[C@](O)(CN[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864897 567080996 /nfs/dbraw/zinc/08/09/96/567080996.db2.gz ARDZDYAWOKFKPH-BEFAXECRSA-N 2 1 377.941 3.497 20 0 GGADMP C[N@@H+]1CC[C@](O)(C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864897 567081002 /nfs/dbraw/zinc/08/10/02/567081002.db2.gz ARDZDYAWOKFKPH-BEFAXECRSA-N 2 1 377.941 3.497 20 0 GGADMP C[N@H+]1CC[C@](O)(C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864897 567081009 /nfs/dbraw/zinc/08/10/09/567081009.db2.gz ARDZDYAWOKFKPH-BEFAXECRSA-N 2 1 377.941 3.497 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H](CO)Cc1cc(Br)ccc1F ZINC000453370229 567081233 /nfs/dbraw/zinc/08/12/33/567081233.db2.gz NEIWSEXNFMERCB-MMQJMDILSA-N 2 1 387.337 3.058 20 0 GGADMP C[N@H+]1CC[C@@](O)(CN[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864907 567082228 /nfs/dbraw/zinc/08/22/28/567082228.db2.gz ARDZDYAWOKFKPH-HNAYVOBHSA-N 2 1 377.941 3.497 20 0 GGADMP C[N@@H+]1CC[C@@](O)(C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864907 567082238 /nfs/dbraw/zinc/08/22/38/567082238.db2.gz ARDZDYAWOKFKPH-HNAYVOBHSA-N 2 1 377.941 3.497 20 0 GGADMP C[N@H+]1CC[C@@](O)(C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000545864907 567082246 /nfs/dbraw/zinc/08/22/46/567082246.db2.gz ARDZDYAWOKFKPH-HNAYVOBHSA-N 2 1 377.941 3.497 20 0 GGADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000565627035 567084190 /nfs/dbraw/zinc/08/41/90/567084190.db2.gz SRAYMQVXAPRMEV-HUUCEWRRSA-N 2 1 382.346 3.486 20 0 GGADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000565627036 567084710 /nfs/dbraw/zinc/08/47/10/567084710.db2.gz SRAYMQVXAPRMEV-LSDHHAIUSA-N 2 1 382.346 3.486 20 0 GGADMP CC[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000453395339 567085011 /nfs/dbraw/zinc/08/50/11/567085011.db2.gz HUABLIYEIONHCG-KRWDZBQOSA-N 2 1 387.977 3.163 20 0 GGADMP CCCOc1ccc(Br)cc1C[N@@H+](C)CCCN1CC[NH+](C)CC1 ZINC000545904290 567087284 /nfs/dbraw/zinc/08/72/84/567087284.db2.gz GMGAWZSZBSKAHZ-UHFFFAOYSA-N 2 1 398.389 3.307 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000453404737 567087554 /nfs/dbraw/zinc/08/75/54/567087554.db2.gz PPWYOOCVYDVBLK-LLVKDONJSA-N 2 1 394.368 3.166 20 0 GGADMP CC[C@@H](Cc1ccc(Br)cc1)[NH2+]CCN1CC[N@@H+](C)C(C)(C)C1 ZINC000658003837 567114285 /nfs/dbraw/zinc/11/42/85/567114285.db2.gz USKMMPOFYXTUNR-SFHVURJKSA-N 2 1 382.390 3.386 20 0 GGADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000474011911 567123682 /nfs/dbraw/zinc/12/36/82/567123682.db2.gz RDICIVOASWVLKO-INIZCTEOSA-N 2 1 396.373 3.107 20 0 GGADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000474011911 567123686 /nfs/dbraw/zinc/12/36/86/567123686.db2.gz RDICIVOASWVLKO-INIZCTEOSA-N 2 1 396.373 3.107 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1)c1ccc(Cl)c(Cl)c1 ZINC000566245414 567142213 /nfs/dbraw/zinc/14/22/13/567142213.db2.gz QSOWUFCSBDIARL-CWRNSKLLSA-N 2 1 384.351 3.492 20 0 GGADMP C[C@H](NC(=O)C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1)c1ccc(Cl)c(Cl)c1 ZINC000566245413 567142542 /nfs/dbraw/zinc/14/25/42/567142542.db2.gz QSOWUFCSBDIARL-BPUTZDHNSA-N 2 1 384.351 3.492 20 0 GGADMP C[C@H]1C[N@H+](CCC[NH2+][C@@H]2CCc3cc(Br)ccc3C2)CCCO1 ZINC000432424046 567159006 /nfs/dbraw/zinc/15/90/06/567159006.db2.gz MLEASWJJYLEHBD-HNAYVOBHSA-N 2 1 381.358 3.397 20 0 GGADMP C[C@H]1C[N@@H+](CCC[NH2+][C@@H]2CCc3cc(Br)ccc3C2)CCCO1 ZINC000432424046 567159014 /nfs/dbraw/zinc/15/90/14/567159014.db2.gz MLEASWJJYLEHBD-HNAYVOBHSA-N 2 1 381.358 3.397 20 0 GGADMP C[C@@H]1C[N@H+](CCC[NH2+][C@H]2CCc3cc(Br)ccc3C2)CCCO1 ZINC000432424044 567159057 /nfs/dbraw/zinc/15/90/57/567159057.db2.gz MLEASWJJYLEHBD-BEFAXECRSA-N 2 1 381.358 3.397 20 0 GGADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H]2CCc3cc(Br)ccc3C2)CCCO1 ZINC000432424044 567159064 /nfs/dbraw/zinc/15/90/64/567159064.db2.gz MLEASWJJYLEHBD-BEFAXECRSA-N 2 1 381.358 3.397 20 0 GGADMP C[C@H]1C[N@H+](CCC[NH2+][C@H]2CCc3cc(Br)ccc3C2)CCCO1 ZINC000432424047 567159491 /nfs/dbraw/zinc/15/94/91/567159491.db2.gz MLEASWJJYLEHBD-KXBFYZLASA-N 2 1 381.358 3.397 20 0 GGADMP C[C@H]1C[N@@H+](CCC[NH2+][C@H]2CCc3cc(Br)ccc3C2)CCCO1 ZINC000432424047 567159497 /nfs/dbraw/zinc/15/94/97/567159497.db2.gz MLEASWJJYLEHBD-KXBFYZLASA-N 2 1 381.358 3.397 20 0 GGADMP C[C@H](Cc1ccc(F)cc1Br)[NH2+]CCN1CC[N@@H+](C)C(C)(C)C1 ZINC000566700639 567181401 /nfs/dbraw/zinc/18/14/01/567181401.db2.gz AISGTQBFKKMNBQ-CQSZACIVSA-N 2 1 386.353 3.135 20 0 GGADMP C[NH2+][C@@H](C(=O)Nc1cnc2c(c1)C[C@H]([NH3+])CC2)c1cccc(Cl)c1Cl ZINC000659303807 567202025 /nfs/dbraw/zinc/20/20/25/567202025.db2.gz VXKOQGLEQPFBCH-PIGZYNQJSA-N 2 1 379.291 3.104 20 0 GGADMP C[NH2+][C@H](C(=O)Nc1cnc2c(c1)C[C@@H]([NH3+])CC2)c1cccc(Cl)c1Cl ZINC000659303805 567202191 /nfs/dbraw/zinc/20/21/91/567202191.db2.gz VXKOQGLEQPFBCH-GTNSWQLSSA-N 2 1 379.291 3.104 20 0 GGADMP C[C@H](CCc1ccc(I)cc1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000474881129 567206893 /nfs/dbraw/zinc/20/68/93/567206893.db2.gz PYYUHNAUQIKUDK-CQSZACIVSA-N 2 1 384.305 3.464 20 0 GGADMP C[NH+](C)CC1CC[NH+](Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000590125829 567211129 /nfs/dbraw/zinc/21/11/29/567211129.db2.gz PCYQBGMOQZQQMA-UHFFFAOYSA-N 2 1 379.302 3.273 20 0 GGADMP COc1ccc(C[NH2+]C[C@H](c2cccs2)N2CC[NH+](C)CC2)cc1Cl ZINC000524728149 567212242 /nfs/dbraw/zinc/21/22/42/567212242.db2.gz REAKKCIZMIWWNT-QGZVFWFLSA-N 2 1 379.957 3.488 20 0 GGADMP O[C@@H](C[NH2+][C@@H]1CCCc2c3cc(Br)ccc3[nH]c21)C[NH+]1CCCC1 ZINC000567307642 567234586 /nfs/dbraw/zinc/23/45/86/567234586.db2.gz OAMONHRGHVLORG-KBXCAEBGSA-N 2 1 392.341 3.354 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+]Cc2nc3cc(Br)ccc3o2)CC1 ZINC000638360076 567245368 /nfs/dbraw/zinc/24/53/68/567245368.db2.gz NUKVPZCEWOCNCH-UHFFFAOYSA-N 2 1 395.345 3.098 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Cc1c(Cl)cccc1Cl ZINC000499518505 567254495 /nfs/dbraw/zinc/25/44/95/567254495.db2.gz HMXCFHZCAQZUDQ-OAHLLOKOSA-N 2 1 386.367 3.410 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cnn3cc(Br)cnc23)c1 ZINC000638562345 567258922 /nfs/dbraw/zinc/25/89/22/567258922.db2.gz BWFPJNVZHQWTLL-UHFFFAOYSA-N 2 1 388.313 3.233 20 0 GGADMP C[NH2+][C@H](C(=O)N1CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C1)c1cccc(Cl)c1Cl ZINC000638564733 567259044 /nfs/dbraw/zinc/25/90/44/567259044.db2.gz WBHPMOVUKVYCEV-PXWWUCIGSA-N 2 1 398.256 3.240 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000567681648 567266644 /nfs/dbraw/zinc/26/66/44/567266644.db2.gz XWIXNWSGYYWQSJ-HOCLYGCPSA-N 2 1 375.340 3.443 20 0 GGADMP CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1c(Cl)cccc1OC(F)F ZINC000685454804 567275667 /nfs/dbraw/zinc/27/56/67/567275667.db2.gz VGJUMKQTJOUWSN-UHFFFAOYSA-N 2 1 375.891 3.399 20 0 GGADMP Nc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000638971832 567280907 /nfs/dbraw/zinc/28/09/07/567280907.db2.gz BDDQKXGYBOUAEB-QGZVFWFLSA-N 2 1 380.319 3.432 20 0 GGADMP C[C@]1(C(=O)NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)CCC[NH2+]C1 ZINC000567911543 567290391 /nfs/dbraw/zinc/29/03/91/567290391.db2.gz ZBAXJYXLNQBSDP-IBGZPJMESA-N 2 1 384.351 3.464 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cnn2cc(Br)cnc12 ZINC000639177589 567292162 /nfs/dbraw/zinc/29/21/62/567292162.db2.gz VWRDOAQGNYBXSH-UHFFFAOYSA-N 2 1 391.317 3.163 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cnn2cc(Br)cnc12 ZINC000639177589 567292166 /nfs/dbraw/zinc/29/21/66/567292166.db2.gz VWRDOAQGNYBXSH-UHFFFAOYSA-N 2 1 391.317 3.163 20 0 GGADMP CC(C)[N@H+](C)C[C@H](O)C[NH+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000660403349 567293177 /nfs/dbraw/zinc/29/31/77/567293177.db2.gz XLESLOKNRRQTBV-IBGZPJMESA-N 2 1 399.373 3.131 20 0 GGADMP CC(C)[N@@H+](C)C[C@H](O)C[NH+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000660403349 567293183 /nfs/dbraw/zinc/29/31/83/567293183.db2.gz XLESLOKNRRQTBV-IBGZPJMESA-N 2 1 399.373 3.131 20 0 GGADMP CC(C)[NH+](C)C[C@H](O)C[N@H+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000660403349 567293192 /nfs/dbraw/zinc/29/31/92/567293192.db2.gz XLESLOKNRRQTBV-IBGZPJMESA-N 2 1 399.373 3.131 20 0 GGADMP CC(C)[NH+](C)C[C@H](O)C[N@@H+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000660403349 567293199 /nfs/dbraw/zinc/29/31/99/567293199.db2.gz XLESLOKNRRQTBV-IBGZPJMESA-N 2 1 399.373 3.131 20 0 GGADMP CC[C@@H]([NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1)c1ccc(Br)cc1 ZINC000568102296 567304438 /nfs/dbraw/zinc/30/44/38/567304438.db2.gz HAUTVYPUQWJEAG-OAHLLOKOSA-N 2 1 378.318 3.275 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)Nc2cc(N(C)C)c(Br)cn2)C1 ZINC000455873601 567316226 /nfs/dbraw/zinc/31/62/26/567316226.db2.gz XZVIFOUHUJXFTH-ZDUSSCGKSA-N 2 1 398.349 3.010 20 0 GGADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCC(=O)Nc1ccccc1Br)C2 ZINC000660659906 567317241 /nfs/dbraw/zinc/31/72/41/567317241.db2.gz SGBRJOOMRDDDTF-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCC(=O)Nc1ccccc1Br)C2 ZINC000660659906 567317246 /nfs/dbraw/zinc/31/72/46/567317246.db2.gz SGBRJOOMRDDDTF-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCC(=O)Nc1ccccc1Br)C2 ZINC000660659906 567317252 /nfs/dbraw/zinc/31/72/52/567317252.db2.gz SGBRJOOMRDDDTF-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCC(=O)Nc1cccc(Br)c1)C2 ZINC000660658567 567317475 /nfs/dbraw/zinc/31/74/75/567317475.db2.gz FBGXNUSKPIIDLA-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCC(=O)Nc1cccc(Br)c1)C2 ZINC000660658567 567317480 /nfs/dbraw/zinc/31/74/80/567317480.db2.gz FBGXNUSKPIIDLA-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCC(=O)Nc1cccc(Br)c1)C2 ZINC000660658567 567317486 /nfs/dbraw/zinc/31/74/86/567317486.db2.gz FBGXNUSKPIIDLA-GOSISDBHSA-N 2 1 380.330 3.195 20 0 GGADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](CCC(=O)Nc1cccc(Br)c1)C2 ZINC000660658571 567318199 /nfs/dbraw/zinc/31/81/99/567318199.db2.gz FBGXNUSKPIIDLA-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](CCC(=O)Nc1cccc(Br)c1)C2 ZINC000660658571 567318202 /nfs/dbraw/zinc/31/82/02/567318202.db2.gz FBGXNUSKPIIDLA-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCC(=O)Nc1cccc(Br)c1)C2 ZINC000660658571 567318207 /nfs/dbraw/zinc/31/82/07/567318207.db2.gz FBGXNUSKPIIDLA-SFHVURJKSA-N 2 1 380.330 3.195 20 0 GGADMP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(Br)cc1N1CCOCC1 ZINC000568614356 567343639 /nfs/dbraw/zinc/34/36/39/567343639.db2.gz OKGJMIKQGBKOLF-UHFFFAOYSA-N 2 1 398.389 3.449 20 0 GGADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(Br)cc1N1CCOCC1 ZINC000568614356 567343644 /nfs/dbraw/zinc/34/36/44/567343644.db2.gz OKGJMIKQGBKOLF-UHFFFAOYSA-N 2 1 398.389 3.449 20 0 GGADMP Clc1ccc(-n2cc(C[N@H+]3CCC[C@H]([C@@H]4CC[NH2+]C4)C3)nn2)cc1Cl ZINC000568628682 567345139 /nfs/dbraw/zinc/34/51/39/567345139.db2.gz VFKLXGDSIFVCPG-KGLIPLIRSA-N 2 1 380.323 3.396 20 0 GGADMP C[NH+](C)CCOc1ccc(C[NH2+]Cc2ncc(Br)cc2F)cc1 ZINC000527640393 567354600 /nfs/dbraw/zinc/35/46/00/567354600.db2.gz KBDRFHIOFZYRJL-UHFFFAOYSA-N 2 1 382.277 3.213 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C[C@@H]21 ZINC000435377387 567358074 /nfs/dbraw/zinc/35/80/74/567358074.db2.gz BAKQFSDJHVFRSQ-CWRNSKLLSA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C[C@@H]21 ZINC000435377387 567358079 /nfs/dbraw/zinc/35/80/79/567358079.db2.gz BAKQFSDJHVFRSQ-CWRNSKLLSA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3nc(-c4ccc(Br)cc4)c[nH]3)C[C@@H]21 ZINC000435381098 567359780 /nfs/dbraw/zinc/35/97/80/567359780.db2.gz VHRRMQJPKKULEB-VNQPRFMTSA-N 2 1 375.314 3.398 20 0 GGADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4ccc(Br)cc4)c[nH]3)C[C@@H]21 ZINC000435381098 567359783 /nfs/dbraw/zinc/35/97/83/567359783.db2.gz VHRRMQJPKKULEB-VNQPRFMTSA-N 2 1 375.314 3.398 20 0 GGADMP C[N@H+](C[C@H](O)C[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1CC1 ZINC000569111910 567380826 /nfs/dbraw/zinc/38/08/26/567380826.db2.gz DOJMIKDRDSBTIG-LJQANCHMSA-N 2 1 386.367 3.003 20 0 GGADMP C[N@@H+](C[C@H](O)C[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1CC1 ZINC000569111910 567380830 /nfs/dbraw/zinc/38/08/30/567380830.db2.gz DOJMIKDRDSBTIG-LJQANCHMSA-N 2 1 386.367 3.003 20 0 GGADMP C[C@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1cc(F)c(Br)cc1F ZINC000527898310 567383460 /nfs/dbraw/zinc/38/34/60/567383460.db2.gz XIYAWTMRBKULDM-LBPRGKRZSA-N 2 1 390.316 3.404 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2c(F)ccc(Br)c2F)CC1 ZINC000501402477 567385900 /nfs/dbraw/zinc/38/59/00/567385900.db2.gz ZVJLRZGJTFQQKD-UHFFFAOYSA-N 2 1 390.316 3.091 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)[C@@H](CO)c2cccc(Cl)c2Cl)CC1 ZINC000661644016 567386151 /nfs/dbraw/zinc/38/61/51/567386151.db2.gz RBNFQWCCKSZFLZ-SFHVURJKSA-N 2 1 388.383 3.375 20 0 GGADMP COc1cc(Br)ccc1C[NH2+]Cc1ccncc1OCC[NH+](C)C ZINC000569405661 567402633 /nfs/dbraw/zinc/40/26/33/567402633.db2.gz ODWOTLNFNILLKJ-UHFFFAOYSA-N 2 1 394.313 3.083 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCc3cccc(Br)c3C2)CC1 ZINC000549733994 567407623 /nfs/dbraw/zinc/40/76/23/567407623.db2.gz RFYSDUVXGGASIU-GOSISDBHSA-N 2 1 394.401 3.170 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+](C)Cc2ccc(F)cc2Br)CC1 ZINC000501849778 567408752 /nfs/dbraw/zinc/40/87/52/567408752.db2.gz OIPZGKXDDKGKML-UHFFFAOYSA-N 2 1 386.353 3.436 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+](C)Cc2ccc(F)cc2Br)CC1 ZINC000501849778 567408758 /nfs/dbraw/zinc/40/87/58/567408758.db2.gz OIPZGKXDDKGKML-UHFFFAOYSA-N 2 1 386.353 3.436 20 0 GGADMP C[C@@H]1C[N@H+](CCC[NH2+][C@H]2CCc3cccc(Br)c3C2)CCCO1 ZINC000549816781 567412405 /nfs/dbraw/zinc/41/24/05/567412405.db2.gz ZMMKMHDJGDRQKU-WBVHZDCISA-N 2 1 381.358 3.397 20 0 GGADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H]2CCc3cccc(Br)c3C2)CCCO1 ZINC000549816781 567412413 /nfs/dbraw/zinc/41/24/13/567412413.db2.gz ZMMKMHDJGDRQKU-WBVHZDCISA-N 2 1 381.358 3.397 20 0 GGADMP O=C(NC[C@@H]1CCC[N@H+](CCSc2cccc(Cl)c2)C1)[C@H]1CCC[NH2+]1 ZINC000662263750 567422169 /nfs/dbraw/zinc/42/21/69/567422169.db2.gz DSNZEOXRMNVBMH-MAUKXSAKSA-N 2 1 381.973 3.012 20 0 GGADMP [NH3+]C[C@H]1C[N@H+](Cc2oc3ccccc3c2Br)CC12CCOCC2 ZINC000662273822 567424324 /nfs/dbraw/zinc/42/43/24/567424324.db2.gz PVRMZHSSZVHFIK-ZDUSSCGKSA-N 2 1 379.298 3.383 20 0 GGADMP [NH3+]C[C@H]1C[N@@H+](Cc2oc3ccccc3c2Br)CC12CCOCC2 ZINC000662273822 567424330 /nfs/dbraw/zinc/42/43/30/567424330.db2.gz PVRMZHSSZVHFIK-ZDUSSCGKSA-N 2 1 379.298 3.383 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@H]2c2ccc(Br)cn2)CC1 ZINC000550078190 567426046 /nfs/dbraw/zinc/42/60/46/567426046.db2.gz VZINFOFRTWSVHU-IBGZPJMESA-N 2 1 395.389 3.397 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@H]2c2ccc(Br)cn2)CC1 ZINC000550078190 567426050 /nfs/dbraw/zinc/42/60/50/567426050.db2.gz VZINFOFRTWSVHU-IBGZPJMESA-N 2 1 395.389 3.397 20 0 GGADMP C[C@@H]1CCC[N@@H+](CC(=O)N(C)Cc2ccccc2Br)[C@@H]1CCC[NH3+] ZINC000662315513 567427131 /nfs/dbraw/zinc/42/71/31/567427131.db2.gz SAWKBGZKSWKGBS-CRAIPNDOSA-N 2 1 396.373 3.247 20 0 GGADMP C[N@H+](CCCNC(=O)[C@H]([NH3+])c1ccccc1Br)Cc1ccccc1 ZINC000662356744 567428560 /nfs/dbraw/zinc/42/85/60/567428560.db2.gz VTFMOYJRXJKYBW-GOSISDBHSA-N 2 1 390.325 3.087 20 0 GGADMP C[N@@H+](CCCNC(=O)[C@H]([NH3+])c1ccccc1Br)Cc1ccccc1 ZINC000662356744 567428565 /nfs/dbraw/zinc/42/85/65/567428565.db2.gz VTFMOYJRXJKYBW-GOSISDBHSA-N 2 1 390.325 3.087 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)[C@H]([NH3+])c1ccccc1Br)c1cccc(F)c1 ZINC000662348668 567428840 /nfs/dbraw/zinc/42/88/40/567428840.db2.gz XKLZRFODGAQWGN-DLBZAZTESA-N 2 1 394.288 3.007 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)[C@@H]([NH3+])c1ccccc1Br)c1cccc(F)c1 ZINC000662348670 567428865 /nfs/dbraw/zinc/42/88/65/567428865.db2.gz XKLZRFODGAQWGN-IRXDYDNUSA-N 2 1 394.288 3.007 20 0 GGADMP C[C@H]1CCC[N@H+](CCCCNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662387144 567431612 /nfs/dbraw/zinc/43/16/12/567431612.db2.gz BUVXMDXIZHNGQO-YOEHRIQHSA-N 2 1 382.346 3.077 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)[C@@H]([NH3+])c2ccccc2Br)C1 ZINC000662387144 567431617 /nfs/dbraw/zinc/43/16/17/567431617.db2.gz BUVXMDXIZHNGQO-YOEHRIQHSA-N 2 1 382.346 3.077 20 0 GGADMP CC(C)[N@H+](C)CC1CCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)CC1 ZINC000662400819 567432532 /nfs/dbraw/zinc/43/25/32/567432532.db2.gz FJVIGOKELMYPCM-KRWDZBQOSA-N 2 1 382.346 3.028 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)CC1 ZINC000662400819 567432538 /nfs/dbraw/zinc/43/25/38/567432538.db2.gz FJVIGOKELMYPCM-KRWDZBQOSA-N 2 1 382.346 3.028 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cc2c(s1)CC[NH2+]C2 ZINC000662426476 567435088 /nfs/dbraw/zinc/43/50/88/567435088.db2.gz RWWURNBWWFQQRC-AWEZNQCLSA-N 2 1 375.563 3.097 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)[C@@H]([NH3+])c2ccccc2Br)[NH+](C)C)cc1 ZINC000662417914 567435161 /nfs/dbraw/zinc/43/51/61/567435161.db2.gz OJDAECKKYQLPRA-MSOLQXFVSA-N 2 1 390.325 3.176 20 0 GGADMP CCCC[N@H+](C)CC1CCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)CC1 ZINC000662464815 567439593 /nfs/dbraw/zinc/43/95/93/567439593.db2.gz SJGBRAKZWXKXIR-SFHVURJKSA-N 2 1 396.373 3.419 20 0 GGADMP CCCC[N@@H+](C)CC1CCN(C(=O)[C@@H]([NH3+])c2ccccc2Br)CC1 ZINC000662464815 567439598 /nfs/dbraw/zinc/43/95/98/567439598.db2.gz SJGBRAKZWXKXIR-SFHVURJKSA-N 2 1 396.373 3.419 20 0 GGADMP CC(C)CC[NH+]1CCC(CNC(=O)[C@@H]([NH3+])c2ccccc2Br)CC1 ZINC000662492667 567441317 /nfs/dbraw/zinc/44/13/17/567441317.db2.gz OGTDIZVFTAMTKN-SFHVURJKSA-N 2 1 396.373 3.323 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(C(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662526467 567446654 /nfs/dbraw/zinc/44/66/54/567446654.db2.gz FCVPPLFUOPONQU-BASYENTBSA-N 2 1 394.357 3.313 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)[C@H]([NH3+])c2ccccc2Br)C1 ZINC000662526467 567446658 /nfs/dbraw/zinc/44/66/58/567446658.db2.gz FCVPPLFUOPONQU-BASYENTBSA-N 2 1 394.357 3.313 20 0 GGADMP Cn1c[nH+]cc1CC[NH2+]Cc1cc(Br)sc1Br ZINC000641775091 567455616 /nfs/dbraw/zinc/45/56/16/567455616.db2.gz KOIGWZWEGCCFKB-UHFFFAOYSA-N 2 1 379.121 3.339 20 0 GGADMP C[C@]([NH3+])(C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccc(Br)cc1 ZINC000662667679 567455710 /nfs/dbraw/zinc/45/57/10/567455710.db2.gz CIVLOFKBFMQORY-VQIMIIECSA-N 2 1 394.357 3.146 20 0 GGADMP C[NH+](C)CCc1ccc(NC(=O)[C@H]([NH3+])c2ccccc2Br)cc1 ZINC000662703376 567458209 /nfs/dbraw/zinc/45/82/09/567458209.db2.gz HEPNXWBVORDXTB-QGZVFWFLSA-N 2 1 376.298 3.192 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@H]([NH3+])c1ccccc1Br ZINC000662747330 567461121 /nfs/dbraw/zinc/46/11/21/567461121.db2.gz SNTPGERXAXXATN-QGZVFWFLSA-N 2 1 376.298 3.458 20 0 GGADMP C[N@@H+]1CC[C@@H]([NH2+]CCCn2cc(Br)cn2)C[C@@H]1c1ccccc1 ZINC000550818271 567463041 /nfs/dbraw/zinc/46/30/41/567463041.db2.gz JLZVBSGLULJBIF-QZTJIDSGSA-N 2 1 377.330 3.461 20 0 GGADMP C[N@H+]1CC[C@@H]([NH2+]CCCn2cc(Br)cn2)C[C@@H]1c1ccccc1 ZINC000550818271 567463047 /nfs/dbraw/zinc/46/30/47/567463047.db2.gz JLZVBSGLULJBIF-QZTJIDSGSA-N 2 1 377.330 3.461 20 0 GGADMP Cc1[nH+]ccn1CC(=O)N(CCC[NH+](C)C)Cc1ccc(Cl)c(Cl)c1 ZINC000457481294 567468755 /nfs/dbraw/zinc/46/87/55/567468755.db2.gz QDYFIAVLGPQDTG-UHFFFAOYSA-N 2 1 383.323 3.479 20 0 GGADMP C[NH2+][C@H](C(=O)NC[C@H]1CCC[N@H+](CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000663002142 567473545 /nfs/dbraw/zinc/47/35/45/567473545.db2.gz CCNQFOCWZJYOPL-KDOFPFPSSA-N 2 1 384.351 3.492 20 0 GGADMP C[NH2+][C@H](C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1cccc(Cl)c1Cl ZINC000663002142 567473548 /nfs/dbraw/zinc/47/35/48/567473548.db2.gz CCNQFOCWZJYOPL-KDOFPFPSSA-N 2 1 384.351 3.492 20 0 GGADMP C[NH+]1CCC(O)(C[NH2+][C@@H](c2ccc(Br)o2)c2ccc(F)cc2)CC1 ZINC000551051294 567475794 /nfs/dbraw/zinc/47/57/94/567475794.db2.gz LVEHWVROYAWRLM-QGZVFWFLSA-N 2 1 397.288 3.317 20 0 GGADMP C[N@H+](C[C@@H](O)C[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1)C1CC1 ZINC000570325536 567476312 /nfs/dbraw/zinc/47/63/12/567476312.db2.gz YMQKKVFYHTYRGB-AWEZNQCLSA-N 2 1 376.850 3.435 20 0 GGADMP C[N@@H+](C[C@@H](O)C[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1)C1CC1 ZINC000570325536 567476313 /nfs/dbraw/zinc/47/63/13/567476313.db2.gz YMQKKVFYHTYRGB-AWEZNQCLSA-N 2 1 376.850 3.435 20 0 GGADMP O=C(CC[N@@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)Nc1cccc(Br)c1 ZINC000643061759 567491897 /nfs/dbraw/zinc/49/18/97/567491897.db2.gz SPWAFXQMVGIWRR-SJORKVTESA-N 2 1 380.330 3.384 20 0 GGADMP O=C(CC[N@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)Nc1cccc(Br)c1 ZINC000643061759 567491904 /nfs/dbraw/zinc/49/19/04/567491904.db2.gz SPWAFXQMVGIWRR-SJORKVTESA-N 2 1 380.330 3.384 20 0 GGADMP C[C@H]1C[NH+](CCCNc2cc[nH+]c3ccc(Br)cc23)C[C@H](C)O1 ZINC000503568776 567494829 /nfs/dbraw/zinc/49/48/29/567494829.db2.gz JFYROZASNRXYOE-KBPBESRZSA-N 2 1 378.314 3.330 20 0 GGADMP C[N@H+]1CCCN(CCC[NH2+][C@@H]2CCCc3cc(Br)ccc32)CC1 ZINC000479062323 567498888 /nfs/dbraw/zinc/49/88/88/567498888.db2.gz OUNHYFLXGXDMCW-LJQANCHMSA-N 2 1 380.374 3.444 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+][C@H]2CCCc3cc(Br)ccc32)C1 ZINC000479061473 567499537 /nfs/dbraw/zinc/49/95/37/567499537.db2.gz NTLUCUHDBMJBTB-YJBOKZPZSA-N 2 1 394.357 3.004 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccc(I)c(Cl)c1 ZINC000503900193 567510811 /nfs/dbraw/zinc/51/08/11/567510811.db2.gz DENQIBSUNAAYDM-YGRLFVJLSA-N 2 1 378.685 3.374 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccc(I)c(Cl)c1 ZINC000503900192 567511222 /nfs/dbraw/zinc/51/12/22/567511222.db2.gz DENQIBSUNAAYDM-QMTHXVAHSA-N 2 1 378.685 3.374 20 0 GGADMP Ic1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CC2 ZINC000595003435 567533832 /nfs/dbraw/zinc/53/38/32/567533832.db2.gz GPXDFZYGDRQITN-KRWDZBQOSA-N 2 1 382.289 3.495 20 0 GGADMP Ic1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CC2 ZINC000595008522 567533958 /nfs/dbraw/zinc/53/39/58/567533958.db2.gz UTWRFRZZEJBLGD-YVEFUNNKSA-N 2 1 382.289 3.352 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCc2ccc(I)cc21 ZINC000595018042 567535680 /nfs/dbraw/zinc/53/56/80/567535680.db2.gz OQZRGILRRMECOP-INIZCTEOSA-N 2 1 381.261 3.463 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](C[NH2+]C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000644588776 567561868 /nfs/dbraw/zinc/56/18/68/567561868.db2.gz UBQNWKYCSQRVAV-CABCVRRESA-N 2 1 375.340 3.301 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1ccc(Br)cc1C ZINC000505791554 567596792 /nfs/dbraw/zinc/59/67/92/567596792.db2.gz YFSDJYIBNNHUBM-KRWDZBQOSA-N 2 1 396.373 3.246 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Cc1cc(Cl)ccc1Cl ZINC000505789903 567597216 /nfs/dbraw/zinc/59/72/16/567597216.db2.gz NOKDDQXBTLHXSN-KRWDZBQOSA-N 2 1 386.367 3.410 20 0 GGADMP C[C@@H](CCc1ccc(I)cc1)[NH2+]CCc1c[nH+]cn1C ZINC000530465612 567604653 /nfs/dbraw/zinc/60/46/53/567604653.db2.gz PJIWZIMAGBGIAV-ZDUSSCGKSA-N 2 1 383.277 3.178 20 0 GGADMP C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@@H]2OCC[C@H]2[NH3+])CC1 ZINC000572037762 567608909 /nfs/dbraw/zinc/60/89/09/567608909.db2.gz HBIPHBPETZPRQT-LQAWEQHXSA-N 2 1 386.323 3.149 20 0 GGADMP CC[N@@H+](CCNC(=O)[C@H](c1ccc(Cl)cc1)N(C)C)CCC(F)(F)F ZINC000572058300 567609634 /nfs/dbraw/zinc/60/96/34/567609634.db2.gz UFGCZOFCPDCZHT-HNNXBMFYSA-N 2 1 379.854 3.333 20 0 GGADMP CCN(CCNC(=O)[C@H](c1ccc(Cl)cc1)N(C)C)CCC(F)(F)F ZINC000572058300 567609642 /nfs/dbraw/zinc/60/96/42/567609642.db2.gz UFGCZOFCPDCZHT-HNNXBMFYSA-N 2 1 379.854 3.333 20 0 GGADMP Cc1ccc(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)cc1Br ZINC000530610203 567613186 /nfs/dbraw/zinc/61/31/86/567613186.db2.gz INTYCHPSNYRTRX-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc3c(cc2Br)OCO3)C1 ZINC000530627140 567614166 /nfs/dbraw/zinc/61/41/66/567614166.db2.gz JDAWONJIAKGCFJ-HNNXBMFYSA-N 2 1 399.329 3.111 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCO3)C1 ZINC000530627140 567614173 /nfs/dbraw/zinc/61/41/73/567614173.db2.gz JDAWONJIAKGCFJ-HNNXBMFYSA-N 2 1 399.329 3.111 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc3c(cc2Br)OCO3)C1 ZINC000530627142 567615208 /nfs/dbraw/zinc/61/52/08/567615208.db2.gz JDAWONJIAKGCFJ-OAHLLOKOSA-N 2 1 399.329 3.111 20 0 GGADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCO3)C1 ZINC000530627142 567615213 /nfs/dbraw/zinc/61/52/13/567615213.db2.gz JDAWONJIAKGCFJ-OAHLLOKOSA-N 2 1 399.329 3.111 20 0 GGADMP CC(C)C[C@@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1cccc(Br)c1 ZINC000665293363 567616974 /nfs/dbraw/zinc/61/69/74/567616974.db2.gz ZKYVLAZQYBIZGU-OAHLLOKOSA-N 2 1 379.302 3.280 20 0 GGADMP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cccc(O)c2Br)cc1 ZINC000459390666 567620592 /nfs/dbraw/zinc/62/05/92/567620592.db2.gz NJQXLSAWXQIIHR-UHFFFAOYSA-N 2 1 379.298 3.385 20 0 GGADMP CCO[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3csc(CC)n3)CC2)[C@H]1SC ZINC000459403965 567622102 /nfs/dbraw/zinc/62/21/02/567622102.db2.gz BYPGWXKMLCNNBK-YQVWRLOYSA-N 2 1 383.627 3.416 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(Br)ccc2OC)C1 ZINC000530866573 567628470 /nfs/dbraw/zinc/62/84/70/567628470.db2.gz HLNSEHLDWFSGQF-KRWDZBQOSA-N 2 1 385.346 3.390 20 0 GGADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cc(Br)ccc2OC)C1 ZINC000530866573 567628478 /nfs/dbraw/zinc/62/84/78/567628478.db2.gz HLNSEHLDWFSGQF-KRWDZBQOSA-N 2 1 385.346 3.390 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)[C@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000645515962 567636422 /nfs/dbraw/zinc/63/64/22/567636422.db2.gz GCRHQBUYYJJYDH-HNAYVOBHSA-N 2 1 396.373 3.251 20 0 GGADMP Cc1c(Br)cccc1C[C@@H](CO)C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000459568836 567637511 /nfs/dbraw/zinc/63/75/11/567637511.db2.gz KDNYRRPSIOSIAY-OAHLLOKOSA-N 2 1 381.358 3.125 20 0 GGADMP C[NH+](C)CC1CC[NH+](Cc2cc(Br)c3c(c2)OCCCO3)CC1 ZINC000506862417 567647583 /nfs/dbraw/zinc/64/75/83/567647583.db2.gz QNJOWCFRDSFGFM-UHFFFAOYSA-N 2 1 383.330 3.384 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](CO)Cc2cc(F)cc(Br)c2)[C@@H](C)C1 ZINC000459693293 567652155 /nfs/dbraw/zinc/65/21/55/567652155.db2.gz HVASUNKVDTVEFP-YEWWUXTCSA-N 2 1 387.337 3.059 20 0 GGADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000459730182 567656438 /nfs/dbraw/zinc/65/64/38/567656438.db2.gz JXUQTHIIRSCQOA-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2CCOc1ccc(Br)cc1 ZINC000441250271 567657324 /nfs/dbraw/zinc/65/73/24/567657324.db2.gz YQLDKVPWUUFGMY-KBAYOESNSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2CCOc1ccc(Br)cc1 ZINC000441250271 567657332 /nfs/dbraw/zinc/65/73/32/567657332.db2.gz YQLDKVPWUUFGMY-KBAYOESNSA-N 2 1 383.330 3.011 20 0 GGADMP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cnc4ccc(Br)cn34)C2)CC1 ZINC000572683410 567657867 /nfs/dbraw/zinc/65/78/67/567657867.db2.gz UXQNXPKVRRDFJU-HNNXBMFYSA-N 2 1 377.330 3.261 20 0 GGADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cnc4ccc(Br)cn34)C2)CC1 ZINC000572683410 567657870 /nfs/dbraw/zinc/65/78/70/567657870.db2.gz UXQNXPKVRRDFJU-HNNXBMFYSA-N 2 1 377.330 3.261 20 0 GGADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ncc(Br)cc2Br)C1 ZINC000459790987 567660399 /nfs/dbraw/zinc/66/03/99/567660399.db2.gz RILSTBBXQZPBSW-NSHDSACASA-N 2 1 391.151 3.428 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]Cc2cc(Br)c(Cl)s2)CC1(C)C ZINC000441334979 567661320 /nfs/dbraw/zinc/66/13/20/567661320.db2.gz PCTLVNUFNAHQEB-UHFFFAOYSA-N 2 1 380.783 3.280 20 0 GGADMP CCCOc1ccc(Br)cc1C[NH2+]CCN1CC[N@@H+](C)C(C)(C)C1 ZINC000441371050 567662723 /nfs/dbraw/zinc/66/27/23/567662723.db2.gz ZMPWEZRMRHESEE-UHFFFAOYSA-N 2 1 398.389 3.354 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cc4cc(Br)ccc4o3)C2)CC1 ZINC000597002785 567669772 /nfs/dbraw/zinc/66/97/72/567669772.db2.gz IJBUUMIEIGZECU-QGZVFWFLSA-N 2 1 392.341 3.407 20 0 GGADMP CC(C)[C@H](C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[C@@H](C)[NH3+] ZINC000572999309 567680939 /nfs/dbraw/zinc/68/09/39/567680939.db2.gz QSKUUOIQYAQFRH-KDOFPFPSSA-N 2 1 396.373 3.149 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[C@@H](C)[NH3+] ZINC000572999311 567681354 /nfs/dbraw/zinc/68/13/54/567681354.db2.gz QSKUUOIQYAQFRH-RDTXWAMCSA-N 2 1 396.373 3.149 20 0 GGADMP C[NH+]1CCC2(CC1)C[N@@H+](CCC(=O)Nc1c(Cl)cccc1Cl)CCO2 ZINC000646104758 567695255 /nfs/dbraw/zinc/69/52/55/567695255.db2.gz MWLAOEQSQSDONR-UHFFFAOYSA-N 2 1 386.323 3.119 20 0 GGADMP COc1c(Br)cc(C[N@H+](C)C2CC[NH2+]CC2)cc1Br ZINC000573206841 567696513 /nfs/dbraw/zinc/69/65/13/567696513.db2.gz PIXDORVGLUFPAV-UHFFFAOYSA-N 2 1 392.135 3.404 20 0 GGADMP COc1c(Br)cc(C[N@@H+](C)C2CC[NH2+]CC2)cc1Br ZINC000573206841 567696515 /nfs/dbraw/zinc/69/65/15/567696515.db2.gz PIXDORVGLUFPAV-UHFFFAOYSA-N 2 1 392.135 3.404 20 0 GGADMP Brc1ccc(-c2noc(C[N@H+]3CCC[C@H]([C@H]4CC[NH2+]C4)C3)n2)s1 ZINC000573207342 567696816 /nfs/dbraw/zinc/69/68/16/567696816.db2.gz NQVJDVHDXVPOGD-RYUDHWBXSA-N 2 1 397.342 3.382 20 0 GGADMP C[N@H+]1CCN(CC[NH2+]C2CC(c3cccc(Br)c3)C2)CC1(C)C ZINC000442869352 567714967 /nfs/dbraw/zinc/71/49/67/567714967.db2.gz PMQXDEYPUIEQOF-UHFFFAOYSA-N 2 1 380.374 3.311 20 0 GGADMP Brc1ccc(-n2cc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)cn2)cc1 ZINC000666998489 567716774 /nfs/dbraw/zinc/71/67/74/567716774.db2.gz WOWADKCKUFVWNK-MRXNPFEDSA-N 2 1 375.314 3.399 20 0 GGADMP C[C@@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc(Br)cc1 ZINC000532508900 567719626 /nfs/dbraw/zinc/71/96/26/567719626.db2.gz SXMACHUQPAUHBW-CQSZACIVSA-N 2 1 382.346 3.042 20 0 GGADMP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000623657392 567728959 /nfs/dbraw/zinc/72/89/59/567728959.db2.gz PSWHAMZKVNMEGG-INIZCTEOSA-N 2 1 396.373 3.107 20 0 GGADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000623657392 567728966 /nfs/dbraw/zinc/72/89/66/567728966.db2.gz PSWHAMZKVNMEGG-INIZCTEOSA-N 2 1 396.373 3.107 20 0 GGADMP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000623656047 567729876 /nfs/dbraw/zinc/72/98/76/567729876.db2.gz LUIIFBHXVPSDLG-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000623656047 567729884 /nfs/dbraw/zinc/72/98/84/567729884.db2.gz LUIIFBHXVPSDLG-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000623656048 567729896 /nfs/dbraw/zinc/72/98/96/567729896.db2.gz LUIIFBHXVPSDLG-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000623656048 567729901 /nfs/dbraw/zinc/72/99/01/567729901.db2.gz LUIIFBHXVPSDLG-CQSZACIVSA-N 2 1 383.330 3.432 20 0 GGADMP C[C@@H]([NH3+])C[C@@H](C)NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000573719064 567731615 /nfs/dbraw/zinc/73/16/15/567731615.db2.gz QRTKLXDAZMBDMR-CHWSQXEVSA-N 2 1 387.355 3.383 20 0 GGADMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000624121223 567760464 /nfs/dbraw/zinc/76/04/64/567760464.db2.gz QFPJQJPQYNMWFY-CABCVRRESA-N 2 1 382.346 3.488 20 0 GGADMP Cc1cccc(C(=O)Nc2c[nH+]ccc2N2CC[NH+](C)CC2)c1Br ZINC000533784211 567787464 /nfs/dbraw/zinc/78/74/64/567787464.db2.gz HLZANNYEBSYVRO-UHFFFAOYSA-N 2 1 389.297 3.157 20 0 GGADMP COc1cc(Br)c(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cc1O ZINC000647542958 567790893 /nfs/dbraw/zinc/79/08/93/567790893.db2.gz FGGMNZIRFXSIBV-KGLIPLIRSA-N 2 1 383.330 3.375 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@@H]1C[C@]12CC[NH2+]C2 ZINC000444187040 567796227 /nfs/dbraw/zinc/79/62/27/567796227.db2.gz SFSMDOLTQWYENZ-KXBFYZLASA-N 2 1 382.335 3.074 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1cc2cc(Br)ccc2o1 ZINC000668163021 567799132 /nfs/dbraw/zinc/79/91/32/567799132.db2.gz PIHOXBIAFWVAMQ-UHFFFAOYSA-N 2 1 380.330 3.265 20 0 GGADMP Brc1cccc(-c2noc(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)n2)c1 ZINC000574916920 567805190 /nfs/dbraw/zinc/80/51/90/567805190.db2.gz LIICGPAPKZEFEK-OAHLLOKOSA-N 2 1 391.313 3.321 20 0 GGADMP CC[C@@H]1C[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC[C@H]1[NH3+] ZINC000647934986 567807549 /nfs/dbraw/zinc/80/75/49/567807549.db2.gz WJDNACZYFFYIQG-CXAGYDPISA-N 2 1 375.314 3.465 20 0 GGADMP CC[C@@H]1C[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC[C@H]1[NH3+] ZINC000647934986 567807553 /nfs/dbraw/zinc/80/75/53/567807553.db2.gz WJDNACZYFFYIQG-CXAGYDPISA-N 2 1 375.314 3.465 20 0 GGADMP O=C(C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1 ZINC000647975223 567808652 /nfs/dbraw/zinc/80/86/52/567808652.db2.gz RFHBYCGQIMLKBX-CABCVRRESA-N 2 1 380.330 3.099 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)Nc1cccc(Br)c1 ZINC000647977907 567808770 /nfs/dbraw/zinc/80/87/70/567808770.db2.gz JQJHGJIBDWUNGU-JKSUJKDBSA-N 2 1 394.357 3.489 20 0 GGADMP O=C(C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000647975006 567809111 /nfs/dbraw/zinc/80/91/11/567809111.db2.gz GHTNPOULCSJZTF-UONOGXRCSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)Nc1ccc(Br)cc1F ZINC000647975006 567809115 /nfs/dbraw/zinc/80/91/15/567809115.db2.gz GHTNPOULCSJZTF-UONOGXRCSA-N 2 1 398.320 3.238 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)Nc1cccc(Br)c1 ZINC000647977905 567809233 /nfs/dbraw/zinc/80/92/33/567809233.db2.gz JQJHGJIBDWUNGU-HOTGVXAUSA-N 2 1 394.357 3.489 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000025410256 570413139 /nfs/dbraw/zinc/41/31/39/570413139.db2.gz LTZUXXMZHZULJO-LJQANCHMSA-N 2 1 377.532 3.214 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000025410256 570413140 /nfs/dbraw/zinc/41/31/40/570413140.db2.gz LTZUXXMZHZULJO-LJQANCHMSA-N 2 1 377.532 3.214 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCc3ccc(C[NH+](C)C)cc3)cc2)C[C@@H](C)O1 ZINC000028895134 570465860 /nfs/dbraw/zinc/46/58/60/570465860.db2.gz QCEXTRQODAUFLD-RTBURBONSA-N 2 1 395.547 3.287 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccc(-c3nn[nH]n3)c2)CC1 ZINC000736829055 598509512 /nfs/dbraw/zinc/50/95/12/598509512.db2.gz VURCHODSTYDUFY-UHFFFAOYSA-N 2 1 376.508 3.211 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccccc2-c2nn[nH]n2)CC1 ZINC000736828981 598509976 /nfs/dbraw/zinc/50/99/76/598509976.db2.gz UCADZAQVPRKLRM-UHFFFAOYSA-N 2 1 376.508 3.211 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc(OCc3cccc(-c4nn[nH]n4)c3)c2)CC[N@H+]1C ZINC000820667474 599449236 /nfs/dbraw/zinc/44/92/36/599449236.db2.gz MOTIRCFGLIHBOH-OXQOHEQNSA-N 2 1 392.507 3.018 20 0 GGADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@H](C(=O)[O-])c1ccccc1F ZINC000830923648 601156727 /nfs/dbraw/zinc/15/67/27/601156727.db2.gz OQFBQLBHZWPNJF-NRFANRHFSA-N 2 1 391.531 3.080 20 0 GGADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@H](C(=O)[O-])c1ccccc1F ZINC000830923648 601156729 /nfs/dbraw/zinc/15/67/29/601156729.db2.gz OQFBQLBHZWPNJF-NRFANRHFSA-N 2 1 391.531 3.080 20 0 GGADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)Cc1ccc(C(=O)[O-])s1 ZINC000830924051 601963657 /nfs/dbraw/zinc/96/36/57/601963657.db2.gz ZVFIQERUOMWSMB-UHFFFAOYSA-N 2 1 379.570 3.074 20 0 GGADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)Cc1ccc(C(=O)[O-])s1 ZINC000830924051 601963661 /nfs/dbraw/zinc/96/36/61/601963661.db2.gz ZVFIQERUOMWSMB-UHFFFAOYSA-N 2 1 379.570 3.074 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C2CC[NH+](CCCC(=O)[O-])CC2)C1 ZINC000833614397 605218873 /nfs/dbraw/zinc/21/88/73/605218873.db2.gz LZAODAYSCDQJME-IBGZPJMESA-N 2 1 387.568 3.337 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C2CC[NH+](CCCC(=O)[O-])CC2)cc1 ZINC000833615328 605219472 /nfs/dbraw/zinc/21/94/72/605219472.db2.gz MQYIVGBGBZMLJN-IBGZPJMESA-N 2 1 387.568 3.480 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C3CC[NH+](CCCC(=O)[O-])CC3)cc2)C1 ZINC000833612628 605219582 /nfs/dbraw/zinc/21/95/82/605219582.db2.gz AXKUEXHCWBAVGI-IBGZPJMESA-N 2 1 387.568 3.337 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3cc(-c4nn[nH]n4)cs3)cc2)C1 ZINC000820709190 606211312 /nfs/dbraw/zinc/21/13/12/606211312.db2.gz FUHLJHNRDQIFBR-OAHLLOKOSA-N 2 1 382.537 3.450 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cccc(-c2nn[nH]n2)c1 ZINC000820759385 606742004 /nfs/dbraw/zinc/74/20/04/606742004.db2.gz KRICZVVOBGYGNL-LFUKPOHLSA-N 2 1 376.508 3.113 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccccc4-c4nn[nH]n4)cc3)CC[C@@H]21 ZINC000821625013 607104330 /nfs/dbraw/zinc/10/43/30/607104330.db2.gz CNUPJYVUVFDMRR-KNQAVFIVSA-N 2 1 388.519 3.450 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(-c4ccccc4-c4nn[nH]n4)cc3)CC[C@@H]21 ZINC000821625013 607104332 /nfs/dbraw/zinc/10/43/32/607104332.db2.gz CNUPJYVUVFDMRR-KNQAVFIVSA-N 2 1 388.519 3.450 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4-c4nn[nH]n4)cc3)CC[C@@H]21 ZINC000821625013 607104334 /nfs/dbraw/zinc/10/43/34/607104334.db2.gz CNUPJYVUVFDMRR-KNQAVFIVSA-N 2 1 388.519 3.450 20 0 GGADMP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(-c3nn[nH]n3)cc2)C[N@H+]1Cc1ccccc1 ZINC000824882898 607812424 /nfs/dbraw/zinc/81/24/24/607812424.db2.gz DFQBDKJKLAEPIT-XLIONFOSSA-N 2 1 376.508 3.257 20 0 GGADMP c1sc(C[NH2+][C@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc1-c1nn[nH]n1 ZINC000826521797 608135118 /nfs/dbraw/zinc/13/51/18/608135118.db2.gz YXUUOYIQCNXGII-VDGAXYAQSA-N 2 1 394.548 3.319 20 0 GGADMP c1sc(C[NH2+][C@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc1-c1nn[nH]n1 ZINC000826521794 608135391 /nfs/dbraw/zinc/13/53/91/608135391.db2.gz YXUUOYIQCNXGII-DBVUQKKJSA-N 2 1 394.548 3.319 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(F)cc1-c1nn[nH]n1 ZINC000825918747 608207569 /nfs/dbraw/zinc/20/75/69/608207569.db2.gz LKWBJPKGOFFKKJ-UHFFFAOYSA-N 2 1 395.486 3.139 20 0 GGADMP CC[N@@H+](CCC1CC[NH+](CCOc2ccc(-c3nn[nH]n3)cc2)CC1)CC1CC1 ZINC000825419199 608211877 /nfs/dbraw/zinc/21/18/77/608211877.db2.gz KOJOWDYKCLLKAU-UHFFFAOYSA-N 2 1 398.555 3.080 20 0 GGADMP c1ccc(-c2ccc(C[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)c(-c2nn[nH]n2)c1 ZINC000826519289 608527243 /nfs/dbraw/zinc/52/72/43/608527243.db2.gz RYEFGYBXPDLKCP-UHFFFAOYSA-N 2 1 388.519 3.498 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCOc2cccc(-c3nn[nH]n3)c2)cc1 ZINC000826330908 608580391 /nfs/dbraw/zinc/58/03/91/608580391.db2.gz NJCFDHIDXRHSLN-HNNXBMFYSA-N 2 1 389.463 3.090 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc(-c3nn[nH]n3)cs2)CC1 ZINC000825980516 608675530 /nfs/dbraw/zinc/67/55/30/608675530.db2.gz BZEPRCLECPAMLU-UHFFFAOYSA-N 2 1 382.537 3.272 20 0 GGADMP Cc1ccccc1C[NH+]1CCN(C(=O)NC[C@H](c2cccs2)[NH+](C)C)CC1 ZINC000053528527 1406427357 /nfs/dbraw/zinc/42/73/57/1406427357.db2.gz BCRPJFWDIDQWRY-LJQANCHMSA-N 2 1 386.565 3.187 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000053753186 1406503497 /nfs/dbraw/zinc/50/34/97/1406503497.db2.gz DJTYYOCMFZVOIW-LJQANCHMSA-N 2 1 386.584 3.461 20 0 GGADMP C[N@@H+](CCNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000053751237 1406503591 /nfs/dbraw/zinc/50/35/91/1406503591.db2.gz BVOKOUCYFABHDB-UHFFFAOYSA-N 2 1 380.536 3.082 20 0 GGADMP CC[NH+]1CCC(NC(=O)N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000053975610 1406575773 /nfs/dbraw/zinc/57/57/73/1406575773.db2.gz OFAADWYHAOZHRT-UHFFFAOYSA-N 2 1 378.948 3.042 20 0 GGADMP CC[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000053975610 1406575785 /nfs/dbraw/zinc/57/57/85/1406575785.db2.gz OFAADWYHAOZHRT-UHFFFAOYSA-N 2 1 378.948 3.042 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)C1 ZINC000054511673 1406757425 /nfs/dbraw/zinc/75/74/25/1406757425.db2.gz MWYCOEUZXJHUOX-SIKLNZKXSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000054511673 1406757434 /nfs/dbraw/zinc/75/74/34/1406757434.db2.gz MWYCOEUZXJHUOX-SIKLNZKXSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000054511673 1406757443 /nfs/dbraw/zinc/75/74/43/1406757443.db2.gz MWYCOEUZXJHUOX-SIKLNZKXSA-N 2 1 386.584 3.450 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NCC1([NH+](C)C)CCCCCC1 ZINC000054607627 1406782650 /nfs/dbraw/zinc/78/26/50/1406782650.db2.gz AJYNOSKPKYNPCO-UHFFFAOYSA-N 2 1 384.528 3.030 20 0 GGADMP CC[NH+](CC)CCN(CC(C)C)C(=O)NCc1cccnc1-n1cc[nH+]c1C ZINC000054610156 1406783773 /nfs/dbraw/zinc/78/37/73/1406783773.db2.gz NXDDXBUACWGJBK-UHFFFAOYSA-N 2 1 386.544 3.085 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@@H](C(C)C)[NH+]1CCC(C)CC1 ZINC000054609758 1406783861 /nfs/dbraw/zinc/78/38/61/1406783861.db2.gz MPIBXTAVOCGNFM-FQEVSTJZSA-N 2 1 398.555 3.131 20 0 GGADMP O=C(NCC[N@@H+]1CCc2sccc2C1)N1CCC[NH+](Cc2ccccc2)CC1 ZINC000054685829 1406806653 /nfs/dbraw/zinc/80/66/53/1406806653.db2.gz ZSEHXBQQVHBPQR-UHFFFAOYSA-N 2 1 398.576 3.024 20 0 GGADMP O=C(NCC[N@H+]1CCc2sccc2C1)N1CCC[NH+](Cc2ccccc2)CC1 ZINC000054685829 1406806657 /nfs/dbraw/zinc/80/66/57/1406806657.db2.gz ZSEHXBQQVHBPQR-UHFFFAOYSA-N 2 1 398.576 3.024 20 0 GGADMP O=C(NCC[NH+]1CCc2sccc2C1)N1CCC[N@H+](Cc2ccccc2)CC1 ZINC000054685829 1406806660 /nfs/dbraw/zinc/80/66/60/1406806660.db2.gz ZSEHXBQQVHBPQR-UHFFFAOYSA-N 2 1 398.576 3.024 20 0 GGADMP O=C(NCC[NH+]1CCc2sccc2C1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000054685829 1406806664 /nfs/dbraw/zinc/80/66/64/1406806664.db2.gz ZSEHXBQQVHBPQR-UHFFFAOYSA-N 2 1 398.576 3.024 20 0 GGADMP C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)N2CCC([NH+]3CCCCC3)CC2)C1 ZINC000054720620 1406813039 /nfs/dbraw/zinc/81/30/39/1406813039.db2.gz ZDHBVNLWLZRABM-FPOVZHCZSA-N 2 1 384.568 3.482 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)NCc2cccc(C[NH+](C)C)c2)C1 ZINC000054720575 1406813074 /nfs/dbraw/zinc/81/30/74/1406813074.db2.gz IXJRVPZRXBVAQW-GCJKJVERSA-N 2 1 380.536 3.383 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)NCC[NH+](C)Cc1ccccc1 ZINC000054764651 1406820762 /nfs/dbraw/zinc/82/07/62/1406820762.db2.gz MUBDMRUYFMTOMX-UHFFFAOYSA-N 2 1 382.552 3.458 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)NCC[N@H+](C)Cc1ccccc1 ZINC000054764651 1406820765 /nfs/dbraw/zinc/82/07/65/1406820765.db2.gz MUBDMRUYFMTOMX-UHFFFAOYSA-N 2 1 382.552 3.458 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000054764651 1406820767 /nfs/dbraw/zinc/82/07/67/1406820767.db2.gz MUBDMRUYFMTOMX-UHFFFAOYSA-N 2 1 382.552 3.458 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)C[N@H+]3CC[C@@H]4CCCC[C@@H]4C3)cc2)CC1 ZINC000007241765 1398638553 /nfs/dbraw/zinc/63/85/53/1398638553.db2.gz FZIPBWQDZXENID-VQTJNVASSA-N 2 1 384.568 3.279 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@@H+]2CCC[C@@H](c3nc4ccccc4s3)C2)CC1 ZINC000007582353 1398709783 /nfs/dbraw/zinc/70/97/83/1398709783.db2.gz GMPNDHUERXHJBZ-MRXNPFEDSA-N 2 1 386.565 3.076 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@@H](c3nc4ccccc4s3)C2)CC1 ZINC000007582353 1398709785 /nfs/dbraw/zinc/70/97/85/1398709785.db2.gz GMPNDHUERXHJBZ-MRXNPFEDSA-N 2 1 386.565 3.076 20 0 GGADMP CC[N@H+](CC(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1)Cc1cccs1 ZINC000015485789 1399166309 /nfs/dbraw/zinc/16/63/09/1399166309.db2.gz ZQPQNWDPJPCMCQ-UHFFFAOYSA-N 2 1 386.565 3.351 20 0 GGADMP CC[N@@H+](CC(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1)Cc1cccs1 ZINC000015485789 1399166312 /nfs/dbraw/zinc/16/63/12/1399166312.db2.gz ZQPQNWDPJPCMCQ-UHFFFAOYSA-N 2 1 386.565 3.351 20 0 GGADMP CC[N@@H+]1CCc2[nH]c(=NC(=O)c3ccc(C[NH+]4CCCCC4)cc3)sc2C1 ZINC000021296121 1399373172 /nfs/dbraw/zinc/37/31/72/1399373172.db2.gz PVNDEZTVDRNOFL-UHFFFAOYSA-N 2 1 384.549 3.181 20 0 GGADMP CC[N@H+]1CCc2[nH]c(=NC(=O)c3ccc(C[NH+]4CCCCC4)cc3)sc2C1 ZINC000021296121 1399373179 /nfs/dbraw/zinc/37/31/79/1399373179.db2.gz PVNDEZTVDRNOFL-UHFFFAOYSA-N 2 1 384.549 3.181 20 0 GGADMP C[NH+]1CCN([C@@H](C[NH2+]Cc2cnn(-c3ccccc3)c2)c2cccs2)CC1 ZINC000024082327 1399600724 /nfs/dbraw/zinc/60/07/24/1399600724.db2.gz QKLVPBKCJMINDH-FQEVSTJZSA-N 2 1 381.549 3.012 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000026465967 1399892698 /nfs/dbraw/zinc/89/26/98/1399892698.db2.gz GXVUHRZNTLNBOM-WTIAFYNJSA-N 2 1 399.579 3.036 20 0 GGADMP C[C@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)[N@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000026465967 1399892702 /nfs/dbraw/zinc/89/27/02/1399892702.db2.gz GXVUHRZNTLNBOM-WTIAFYNJSA-N 2 1 399.579 3.036 20 0 GGADMP CCC[NH+]1CCC([NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)CC1 ZINC000028308965 1400148605 /nfs/dbraw/zinc/14/86/05/1400148605.db2.gz RPMHXMGAENRFIQ-UHFFFAOYSA-N 2 1 384.524 3.212 20 0 GGADMP CC1CC[NH+](CCC[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)CC1 ZINC000028323522 1400151068 /nfs/dbraw/zinc/15/10/68/1400151068.db2.gz VKBNWTGNBLJGSO-UHFFFAOYSA-N 2 1 398.551 3.460 20 0 GGADMP C[C@H](CNC(=O)NC[C@H](c1cccs1)[NH+](C)C)[N@@H+]1CCc2sccc2C1 ZINC000028380918 1400157564 /nfs/dbraw/zinc/15/75/64/1400157564.db2.gz FCPMQENFLFANMN-GDBMZVCRSA-N 2 1 392.594 3.158 20 0 GGADMP C[C@H](CNC(=O)NC[C@H](c1cccs1)[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000028380918 1400157572 /nfs/dbraw/zinc/15/75/72/1400157572.db2.gz FCPMQENFLFANMN-GDBMZVCRSA-N 2 1 392.594 3.158 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[N@@H+]1CCc2sccc2C1 ZINC000028380925 1400158168 /nfs/dbraw/zinc/15/81/68/1400158168.db2.gz FCPMQENFLFANMN-HOCLYGCPSA-N 2 1 392.594 3.158 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000028380925 1400158174 /nfs/dbraw/zinc/15/81/74/1400158174.db2.gz FCPMQENFLFANMN-HOCLYGCPSA-N 2 1 392.594 3.158 20 0 GGADMP CC[N@@H+](CC(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cc1)C1CC1 ZINC000029913450 1400377259 /nfs/dbraw/zinc/37/72/59/1400377259.db2.gz VVNVJGJWWRQFNA-UHFFFAOYSA-N 2 1 392.547 3.432 20 0 GGADMP C[NH+](C)CCCNC(=O)NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000042923586 1403674277 /nfs/dbraw/zinc/67/42/77/1403674277.db2.gz VUVMHTPPVONLPP-LJQANCHMSA-N 2 1 386.565 3.098 20 0 GGADMP C[NH+](C)CCCNC(=O)NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000042923586 1403674283 /nfs/dbraw/zinc/67/42/83/1403674283.db2.gz VUVMHTPPVONLPP-LJQANCHMSA-N 2 1 386.565 3.098 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@H](c2ccco2)[NH+](C)C)CC1 ZINC000043137735 1403714623 /nfs/dbraw/zinc/71/46/23/1403714623.db2.gz WXQYCYBTSJLILF-HXUWFJFHSA-N 2 1 384.524 3.155 20 0 GGADMP CCC(CC)[C@H](CNC(=O)Nc1cccc(C[NH+](C)C)c1)[NH+]1CCOCC1 ZINC000044277194 1403911565 /nfs/dbraw/zinc/91/15/65/1403911565.db2.gz XAIIWAPCLOSQML-FQEVSTJZSA-N 2 1 376.545 3.007 20 0 GGADMP O[C@@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccccc1)C[NH+]1CCCC1 ZINC000044339727 1403922010 /nfs/dbraw/zinc/92/20/10/1403922010.db2.gz BLRMVBKZQYKGPU-QFIPXVFZSA-N 2 1 376.504 3.086 20 0 GGADMP O[C@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccccc1)C[NH+]1CCCC1 ZINC000044339731 1403922073 /nfs/dbraw/zinc/92/20/73/1403922073.db2.gz BLRMVBKZQYKGPU-JOCHJYFZSA-N 2 1 376.504 3.086 20 0 GGADMP C[N@@H+]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)[C@H](c2ccccc2)C1 ZINC000045029506 1404039324 /nfs/dbraw/zinc/03/93/24/1404039324.db2.gz KLXKAOWKPBZYSL-QHCPKHFHSA-N 2 1 392.547 3.349 20 0 GGADMP C[N@H+]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)[C@H](c2ccccc2)C1 ZINC000045029506 1404039326 /nfs/dbraw/zinc/03/93/26/1404039326.db2.gz KLXKAOWKPBZYSL-QHCPKHFHSA-N 2 1 392.547 3.349 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)NCc1ccccc1C[NH+]1CCCC1 ZINC000045042305 1404043232 /nfs/dbraw/zinc/04/32/32/1404043232.db2.gz KCMUSEPVFAXSLP-UHFFFAOYSA-N 2 1 392.547 3.140 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)CC1 ZINC000045462131 1404126097 /nfs/dbraw/zinc/12/60/97/1404126097.db2.gz XKJRJCRHYBDQAT-UHFFFAOYSA-N 2 1 390.547 3.163 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)CC1 ZINC000045462131 1404126103 /nfs/dbraw/zinc/12/61/03/1404126103.db2.gz XKJRJCRHYBDQAT-UHFFFAOYSA-N 2 1 390.547 3.163 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N[C@@H]3CC[N@H+]4CCCC[C@H]34)cc2)CC1 ZINC000045777487 1404201059 /nfs/dbraw/zinc/20/10/59/1404201059.db2.gz PLSXILHOYLJRBZ-FGZHOGPDSA-N 2 1 384.568 3.345 20 0 GGADMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000045975945 1404257952 /nfs/dbraw/zinc/25/79/52/1404257952.db2.gz URRLNWFKAFCRRM-RBUKOAKNSA-N 2 1 387.572 3.131 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)NCC3([NH+](C)C)CCCCC3)cc2)C[C@@H](C)O1 ZINC000046430476 1404412103 /nfs/dbraw/zinc/41/21/03/1404412103.db2.gz QZGZOKKYMFEPGT-RTBURBONSA-N 2 1 387.568 3.290 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)cc1 ZINC000047277163 1404782931 /nfs/dbraw/zinc/78/29/31/1404782931.db2.gz MZOSKWNYNBYJOD-UHFFFAOYSA-N 2 1 395.547 3.291 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)C1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000047302487 1404796118 /nfs/dbraw/zinc/79/61/18/1404796118.db2.gz ZVQZYEWGXCQSJJ-QFIPXVFZSA-N 2 1 395.547 3.326 20 0 GGADMP C[C@@H](CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000047882917 1404982315 /nfs/dbraw/zinc/98/23/15/1404982315.db2.gz AROLMOBYAYORHM-GHTZIAJQSA-N 2 1 396.535 3.163 20 0 GGADMP C[C@@H](CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2sccc2C1 ZINC000047966034 1405012310 /nfs/dbraw/zinc/01/23/10/1405012310.db2.gz UGAQUEDZBZJSMO-PXNSSMCTSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2sccc2C1 ZINC000047966034 1405012320 /nfs/dbraw/zinc/01/23/20/1405012320.db2.gz UGAQUEDZBZJSMO-PXNSSMCTSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2sccc2C1 ZINC000047966034 1405012329 /nfs/dbraw/zinc/01/23/29/1405012329.db2.gz UGAQUEDZBZJSMO-PXNSSMCTSA-N 2 1 398.576 3.068 20 0 GGADMP C[C@@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2sccc2C1 ZINC000047966034 1405012339 /nfs/dbraw/zinc/01/23/39/1405012339.db2.gz UGAQUEDZBZJSMO-PXNSSMCTSA-N 2 1 398.576 3.068 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)Nc2ccccc2N2CC[NH+](C)CC2)CC1 ZINC000048059324 1405037485 /nfs/dbraw/zinc/03/74/85/1405037485.db2.gz YYPQLUCWCUTPTL-UHFFFAOYSA-N 2 1 387.572 3.023 20 0 GGADMP Cc1ccc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)cc1C ZINC000048778079 1405289034 /nfs/dbraw/zinc/28/90/34/1405289034.db2.gz KWEIXMXDXYZKBU-UHFFFAOYSA-N 2 1 381.520 3.254 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]Cc2cccc(Cl)c2)c1 ZINC000048778023 1405289495 /nfs/dbraw/zinc/28/94/95/1405289495.db2.gz UXLXJRSZXASEBE-UHFFFAOYSA-N 2 1 387.911 3.291 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000050136864 1405496507 /nfs/dbraw/zinc/49/65/07/1405496507.db2.gz HNHQGEJQSSYMQI-IBGZPJMESA-N 2 1 392.613 3.333 20 0 GGADMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[NH+](C2CCCC2)CC1 ZINC000050137028 1405496845 /nfs/dbraw/zinc/49/68/45/1405496845.db2.gz DIVVDUIEOLAJDZ-GOSISDBHSA-N 2 1 390.597 3.230 20 0 GGADMP C[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCCCC1 ZINC000050136839 1405497572 /nfs/dbraw/zinc/49/75/72/1405497572.db2.gz ITXYHNFLDMUHPL-MSOLQXFVSA-N 2 1 378.586 3.134 20 0 GGADMP O[C@@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1)C[NH+]1CCCC1 ZINC000051188010 1405741144 /nfs/dbraw/zinc/74/11/44/1405741144.db2.gz GDGHHKIOHCGZLR-IBGZPJMESA-N 2 1 382.533 3.147 20 0 GGADMP CCc1cccc(CC)c1NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000051959242 1405889905 /nfs/dbraw/zinc/88/99/05/1405889905.db2.gz KCNZTONEKJSUPL-GOSISDBHSA-N 2 1 387.568 3.183 20 0 GGADMP C[N@@H+](CCc1ccccc1)CC(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000052000424 1405895614 /nfs/dbraw/zinc/89/56/14/1405895614.db2.gz LWHHQQROFJCMNQ-UHFFFAOYSA-N 2 1 383.511 3.081 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)N(C)Cc2ccc(OC)c(F)c2)CC1 ZINC000052208713 1405983090 /nfs/dbraw/zinc/98/30/90/1405983090.db2.gz DOWPCILBDGTBCX-UHFFFAOYSA-N 2 1 393.547 3.237 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000052290412 1406009159 /nfs/dbraw/zinc/00/91/59/1406009159.db2.gz MZNBFMMPTJDXNC-QZTJIDSGSA-N 2 1 383.540 3.169 20 0 GGADMP O=C(C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)N[C@H]1CCOc2ccccc21 ZINC000052713742 1406135221 /nfs/dbraw/zinc/13/52/21/1406135221.db2.gz YYLQFLYSWUADJD-NRFANRHFSA-N 2 1 385.552 3.214 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCn1cc[nH+]c1C)[NH+]1CCCCC1 ZINC000056932174 1407476126 /nfs/dbraw/zinc/47/61/26/1407476126.db2.gz WHRDGDGTHCRWEI-FQEVSTJZSA-N 2 1 399.539 3.117 20 0 GGADMP COc1ccccc1[C@@H](CNC(=O)NCCCn1cc[nH+]c1C)[NH+]1CCCCC1 ZINC000056932175 1407476308 /nfs/dbraw/zinc/47/63/08/1407476308.db2.gz WHRDGDGTHCRWEI-HXUWFJFHSA-N 2 1 399.539 3.117 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000056950314 1407482531 /nfs/dbraw/zinc/48/25/31/1407482531.db2.gz PLYMIBBMECSCOU-RTWAWAEBSA-N 2 1 384.499 3.002 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)C[NH+]1CCCCC1 ZINC000057042269 1407507098 /nfs/dbraw/zinc/50/70/98/1407507098.db2.gz HCCVLGPJMGIEEI-LJQANCHMSA-N 2 1 390.547 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)C[NH+]1CCCCC1 ZINC000057042269 1407507100 /nfs/dbraw/zinc/50/71/00/1407507100.db2.gz HCCVLGPJMGIEEI-LJQANCHMSA-N 2 1 390.547 3.165 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cn1 ZINC000057127564 1407530120 /nfs/dbraw/zinc/53/01/20/1407530120.db2.gz RFSHWPCZTCZBNX-HDICACEKSA-N 2 1 398.555 3.133 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cn1 ZINC000057127564 1407530127 /nfs/dbraw/zinc/53/01/27/1407530127.db2.gz RFSHWPCZTCZBNX-HDICACEKSA-N 2 1 398.555 3.133 20 0 GGADMP COc1cccc([C@H](CNC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)[NH+](C)C)c1 ZINC000057127921 1407530375 /nfs/dbraw/zinc/53/03/75/1407530375.db2.gz IOCYEWHRXJFQQZ-GGAORHGYSA-N 2 1 395.547 3.326 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cn1 ZINC000057127566 1407530538 /nfs/dbraw/zinc/53/05/38/1407530538.db2.gz RFSHWPCZTCZBNX-ROUUACIJSA-N 2 1 398.555 3.133 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C(C)C)[NH+]2CCCCCC2)cn1 ZINC000057127977 1407531060 /nfs/dbraw/zinc/53/10/60/1407531060.db2.gz VZSMQFZYSWURPE-HXUWFJFHSA-N 2 1 398.555 3.276 20 0 GGADMP CC[N@@H+]1CCc2nc(NC(=O)[C@H]3CCC[NH+](Cc4ccccc4)C3)sc2C1 ZINC000057154268 1407538187 /nfs/dbraw/zinc/53/81/87/1407538187.db2.gz XNROVICZXHSSKM-KRWDZBQOSA-N 2 1 384.549 3.372 20 0 GGADMP CC[N@H+]1CCc2nc(NC(=O)[C@H]3CCC[NH+](Cc4ccccc4)C3)sc2C1 ZINC000057154268 1407538194 /nfs/dbraw/zinc/53/81/94/1407538194.db2.gz XNROVICZXHSSKM-KRWDZBQOSA-N 2 1 384.549 3.372 20 0 GGADMP CC[NH+]1CCc2nc(NC(=O)[C@H]3CCC[N@H+](Cc4ccccc4)C3)sc2C1 ZINC000057154268 1407538199 /nfs/dbraw/zinc/53/81/99/1407538199.db2.gz XNROVICZXHSSKM-KRWDZBQOSA-N 2 1 384.549 3.372 20 0 GGADMP CC[NH+]1CCc2nc(NC(=O)[C@H]3CCC[N@@H+](Cc4ccccc4)C3)sc2C1 ZINC000057154268 1407538204 /nfs/dbraw/zinc/53/82/04/1407538204.db2.gz XNROVICZXHSSKM-KRWDZBQOSA-N 2 1 384.549 3.372 20 0 GGADMP C[C@H](CNC(=O)C1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000057168958 1407542085 /nfs/dbraw/zinc/54/20/85/1407542085.db2.gz XYJACDUIWWXIPG-HXUWFJFHSA-N 2 1 391.559 3.462 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccn2)CC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000057174352 1407545348 /nfs/dbraw/zinc/54/53/48/1407545348.db2.gz ZPMNMWKWFVOQDT-OAQYLSRUSA-N 2 1 392.547 3.074 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccn2)CC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000057174351 1407545471 /nfs/dbraw/zinc/54/54/71/1407545471.db2.gz ZPMNMWKWFVOQDT-NRFANRHFSA-N 2 1 392.547 3.074 20 0 GGADMP CC(C)(C)[N@H+]1CCCN(C(=O)NC[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC000057631349 1407670853 /nfs/dbraw/zinc/67/08/53/1407670853.db2.gz KPUONSDMYWAEKG-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000057631349 1407670866 /nfs/dbraw/zinc/67/08/66/1407670866.db2.gz KPUONSDMYWAEKG-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)(C)[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000057631349 1407670875 /nfs/dbraw/zinc/67/08/75/1407670875.db2.gz KPUONSDMYWAEKG-NRFANRHFSA-N 2 1 386.584 3.414 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)N2CCc3ccccc3C2)CC1 ZINC000057843759 1407735685 /nfs/dbraw/zinc/73/56/85/1407735685.db2.gz GEUJZMNWEQMIAB-UHFFFAOYSA-N 2 1 391.559 3.415 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)NCc2ccccc2F)CC1 ZINC000057843958 1407736094 /nfs/dbraw/zinc/73/60/94/1407736094.db2.gz QMGGZKPEZOHMPK-UHFFFAOYSA-N 2 1 383.511 3.286 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1 ZINC000058231475 1407800645 /nfs/dbraw/zinc/80/06/45/1407800645.db2.gz PNRSZTUICOZWDV-RTBURBONSA-N 2 1 375.557 3.400 20 0 GGADMP Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000060368435 1407962815 /nfs/dbraw/zinc/96/28/15/1407962815.db2.gz YHNRVGLOYNCLJS-FGTMMUONSA-N 2 1 391.531 3.282 20 0 GGADMP Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000060368435 1407962820 /nfs/dbraw/zinc/96/28/20/1407962820.db2.gz YHNRVGLOYNCLJS-FGTMMUONSA-N 2 1 391.531 3.282 20 0 GGADMP CCN1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(OC)c(OC)c2)CC1 ZINC000061070304 1408073949 /nfs/dbraw/zinc/07/39/49/1408073949.db2.gz OOJBDNUALWYMAC-UHFFFAOYSA-N 2 1 383.536 3.131 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000061142275 1408082481 /nfs/dbraw/zinc/08/24/81/1408082481.db2.gz WTOKXQQYXDHELD-NHCUHLMSSA-N 2 1 396.535 3.380 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)Cc1ccccc1 ZINC000061195181 1408089549 /nfs/dbraw/zinc/08/95/49/1408089549.db2.gz BNMDWWSTEFAHCQ-PKTZIBPZSA-N 2 1 394.563 3.123 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000061256077 1408097453 /nfs/dbraw/zinc/09/74/53/1408097453.db2.gz ORNDJUCINVMCAR-XXBNENTESA-N 2 1 392.547 3.007 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000061256077 1408097462 /nfs/dbraw/zinc/09/74/62/1408097462.db2.gz ORNDJUCINVMCAR-XXBNENTESA-N 2 1 392.547 3.007 20 0 GGADMP C[C@H](CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000061256077 1408097473 /nfs/dbraw/zinc/09/74/73/1408097473.db2.gz ORNDJUCINVMCAR-XXBNENTESA-N 2 1 392.547 3.007 20 0 GGADMP C[C@@H](CNC(=O)NCCC[N@@H+](C)Cc1ccccc1)[NH+]1CCc2ccccc2C1 ZINC000061501262 1408138132 /nfs/dbraw/zinc/13/81/32/1408138132.db2.gz NJQNRGJJXKDMHT-FQEVSTJZSA-N 2 1 394.563 3.255 20 0 GGADMP C[C@@H](CNC(=O)NCCC[NH+](C)Cc1ccccc1)[N@@H+]1CCc2ccccc2C1 ZINC000061501262 1408138140 /nfs/dbraw/zinc/13/81/40/1408138140.db2.gz NJQNRGJJXKDMHT-FQEVSTJZSA-N 2 1 394.563 3.255 20 0 GGADMP C[C@@H](CNC(=O)NCCC[NH+](C)Cc1ccccc1)[N@H+]1CCc2ccccc2C1 ZINC000061501262 1408138153 /nfs/dbraw/zinc/13/81/53/1408138153.db2.gz NJQNRGJJXKDMHT-FQEVSTJZSA-N 2 1 394.563 3.255 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)[NH+]1CCC(C)CC1 ZINC000061788827 1408176355 /nfs/dbraw/zinc/17/63/55/1408176355.db2.gz WMERHXXYEXAUKJ-SFHVURJKSA-N 2 1 390.597 3.477 20 0 GGADMP C[N@@H+](CCNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000063150782 1408309904 /nfs/dbraw/zinc/30/99/04/1408309904.db2.gz UBYMIABSDLWPTR-UHFFFAOYSA-N 2 1 396.604 3.247 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3cnn(Cc4ccccc4)c3)c2)CCO1 ZINC000063524295 1408367835 /nfs/dbraw/zinc/36/78/35/1408367835.db2.gz VNFSTKJJECFBAZ-FQEVSTJZSA-N 2 1 390.531 3.442 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3cnn(Cc4ccccc4)c3)c2)CCO1 ZINC000063524295 1408367845 /nfs/dbraw/zinc/36/78/45/1408367845.db2.gz VNFSTKJJECFBAZ-FQEVSTJZSA-N 2 1 390.531 3.442 20 0 GGADMP CC[NH+](CC)CCOc1ccc(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000063711023 1408394980 /nfs/dbraw/zinc/39/49/80/1408394980.db2.gz VZRREPLKXRMFMP-IBGZPJMESA-N 2 1 375.557 3.257 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CCC[NH+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000063724164 1408397337 /nfs/dbraw/zinc/39/73/37/1408397337.db2.gz LMZZTQKZCXSQQX-KDURUIRLSA-N 2 1 387.568 3.242 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CCC[NH+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000063724164 1408397345 /nfs/dbraw/zinc/39/73/45/1408397345.db2.gz LMZZTQKZCXSQQX-KDURUIRLSA-N 2 1 387.568 3.242 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@@H+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000063724164 1408397350 /nfs/dbraw/zinc/39/73/50/1408397350.db2.gz LMZZTQKZCXSQQX-KDURUIRLSA-N 2 1 387.568 3.242 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@H+](C(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000063724164 1408397357 /nfs/dbraw/zinc/39/73/57/1408397357.db2.gz LMZZTQKZCXSQQX-KDURUIRLSA-N 2 1 387.568 3.242 20 0 GGADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C1 ZINC000063917526 1408445434 /nfs/dbraw/zinc/44/54/34/1408445434.db2.gz GEWJLUSXUQVZNH-QGZVFWFLSA-N 2 1 384.524 3.070 20 0 GGADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000063917404 1408445700 /nfs/dbraw/zinc/44/57/00/1408445700.db2.gz TXGIONQAEIIAKE-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000063917404 1408445707 /nfs/dbraw/zinc/44/57/07/1408445707.db2.gz TXGIONQAEIIAKE-AWEZNQCLSA-N 2 1 383.330 3.432 20 0 GGADMP CC[N@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000064229797 1408514869 /nfs/dbraw/zinc/51/48/69/1408514869.db2.gz QOYHDOMKJGBAMJ-UHFFFAOYSA-N 2 1 394.563 3.474 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000064229797 1408514879 /nfs/dbraw/zinc/51/48/79/1408514879.db2.gz QOYHDOMKJGBAMJ-UHFFFAOYSA-N 2 1 394.563 3.474 20 0 GGADMP C[C@H](CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000064251186 1408520951 /nfs/dbraw/zinc/52/09/51/1408520951.db2.gz OHCGHQWXAHUFIU-QZTJIDSGSA-N 2 1 392.613 3.380 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000064310044 1408532190 /nfs/dbraw/zinc/53/21/90/1408532190.db2.gz LAIRXNUPSGPBGM-KDURUIRLSA-N 2 1 387.568 3.242 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000064310044 1408532196 /nfs/dbraw/zinc/53/21/96/1408532196.db2.gz LAIRXNUPSGPBGM-KDURUIRLSA-N 2 1 387.568 3.242 20 0 GGADMP Cc1c(Cl)cccc1NC(=O)[C@@H](C)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000064344386 1408537368 /nfs/dbraw/zinc/53/73/68/1408537368.db2.gz CRLXLJIITBUVHM-QGZVFWFLSA-N 2 1 393.959 3.410 20 0 GGADMP CC(C)[NH+](CCNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)C ZINC000064644469 1408590085 /nfs/dbraw/zinc/59/00/85/1408590085.db2.gz XWIPVNJGXDIONM-GOSISDBHSA-N 2 1 380.602 3.378 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000176479159 1428334322 /nfs/dbraw/zinc/33/43/22/1428334322.db2.gz AXWGBXDOSSGVSX-CTNGQTDRSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)[C@@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000176479159 1428334329 /nfs/dbraw/zinc/33/43/29/1428334329.db2.gz AXWGBXDOSSGVSX-CTNGQTDRSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000176479159 1428334337 /nfs/dbraw/zinc/33/43/37/1428334337.db2.gz AXWGBXDOSSGVSX-CTNGQTDRSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000176479159 1428334345 /nfs/dbraw/zinc/33/43/45/1428334345.db2.gz AXWGBXDOSSGVSX-CTNGQTDRSA-N 2 1 375.532 3.371 20 0 GGADMP COc1ccc([C@@H](CNC(=O)C[N@@H+](C)C(C2CC2)C2CC2)[NH+]2CCCCC2)cc1 ZINC000065353296 1408662730 /nfs/dbraw/zinc/66/27/30/1408662730.db2.gz ZUALPAKLPYGUCS-JOCHJYFZSA-N 2 1 399.579 3.459 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)NC[C@H](c2ccccc2)[NH+]2CCC(C)CC2)C1 ZINC000065441021 1408669244 /nfs/dbraw/zinc/66/92/44/1408669244.db2.gz LRYLRDQEMQMVLP-IFMALSPDSA-N 2 1 386.584 3.489 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)NCc2ccccc2C[NH+]2CCC[C@@H](C)C2)C1 ZINC000065441325 1408669263 /nfs/dbraw/zinc/66/92/63/1408669263.db2.gz YVGSHISVXPARFL-WOJBJXKFSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@H](CNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000065441325 1408669269 /nfs/dbraw/zinc/66/92/69/1408669269.db2.gz YVGSHISVXPARFL-WOJBJXKFSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)[NH+]1CC[C@H](CNC(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000065441325 1408669275 /nfs/dbraw/zinc/66/92/75/1408669275.db2.gz YVGSHISVXPARFL-WOJBJXKFSA-N 2 1 386.584 3.448 20 0 GGADMP CC(C)c1ccc(C[NH+]2CCN(C(=O)NC[C@H]3CC[N@@H+](C(C)C)C3)CC2)cc1 ZINC000065441953 1408669865 /nfs/dbraw/zinc/66/98/65/1408669865.db2.gz WYJPNPFWYJRKHU-OAQYLSRUSA-N 2 1 386.584 3.368 20 0 GGADMP CC(C)c1ccc(C[NH+]2CCN(C(=O)NC[C@H]3CC[N@H+](C(C)C)C3)CC2)cc1 ZINC000065441953 1408669872 /nfs/dbraw/zinc/66/98/72/1408669872.db2.gz WYJPNPFWYJRKHU-OAQYLSRUSA-N 2 1 386.584 3.368 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000065441848 1408670149 /nfs/dbraw/zinc/67/01/49/1408670149.db2.gz WSDHHDABRSGFPJ-GOSISDBHSA-N 2 1 392.975 3.334 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[NH+]1CCCC[C@H]1C ZINC000065518399 1408683051 /nfs/dbraw/zinc/68/30/51/1408683051.db2.gz BZTOMIQYFHIKLD-KCZVDYSFSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[NH+](Cc2ccccc2)C1)[N@@H+]1CCCC[C@H]1C ZINC000065518399 1408683059 /nfs/dbraw/zinc/68/30/59/1408683059.db2.gz BZTOMIQYFHIKLD-KCZVDYSFSA-N 2 1 386.584 3.461 20 0 GGADMP C[C@H](CNC(=O)NC[C@H]1CCC[NH+](Cc2ccccc2)C1)[N@H+]1CCCC[C@H]1C ZINC000065518399 1408683065 /nfs/dbraw/zinc/68/30/65/1408683065.db2.gz BZTOMIQYFHIKLD-KCZVDYSFSA-N 2 1 386.584 3.461 20 0 GGADMP C[N@@H+](CCNC(=O)N[C@H]1CCC[NH+](Cc2ccccc2)C1)Cc1ccccc1 ZINC000065542608 1408686615 /nfs/dbraw/zinc/68/66/15/1408686615.db2.gz SFQWSSFHAKDWEM-QFIPXVFZSA-N 2 1 380.536 3.082 20 0 GGADMP C[NH+](CCNC(=O)N[C@H]1CCC[N@H+](Cc2ccccc2)C1)Cc1ccccc1 ZINC000065542608 1408686618 /nfs/dbraw/zinc/68/66/18/1408686618.db2.gz SFQWSSFHAKDWEM-QFIPXVFZSA-N 2 1 380.536 3.082 20 0 GGADMP C[NH+](CCNC(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)Cc1ccccc1 ZINC000065542608 1408686622 /nfs/dbraw/zinc/68/66/22/1408686622.db2.gz SFQWSSFHAKDWEM-QFIPXVFZSA-N 2 1 380.536 3.082 20 0 GGADMP C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000065549849 1408687332 /nfs/dbraw/zinc/68/73/32/1408687332.db2.gz CZWYTANYVIHNSY-HXUWFJFHSA-N 2 1 386.584 3.067 20 0 GGADMP C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000065549849 1408687336 /nfs/dbraw/zinc/68/73/36/1408687336.db2.gz CZWYTANYVIHNSY-HXUWFJFHSA-N 2 1 386.584 3.067 20 0 GGADMP C[C@@H](CNC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)[NH+]1CCc2ccccc2C1 ZINC000065550236 1408687532 /nfs/dbraw/zinc/68/75/32/1408687532.db2.gz MLIGMMBXWPZSET-MOPGFXCFSA-N 2 1 386.584 3.243 20 0 GGADMP C[C@@H](CNC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[N@@H+]1CCc2ccccc2C1 ZINC000065550236 1408687534 /nfs/dbraw/zinc/68/75/34/1408687534.db2.gz MLIGMMBXWPZSET-MOPGFXCFSA-N 2 1 386.584 3.243 20 0 GGADMP C[C@@H](CNC(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1)[N@H+]1CCc2ccccc2C1 ZINC000065550236 1408687540 /nfs/dbraw/zinc/68/75/40/1408687540.db2.gz MLIGMMBXWPZSET-MOPGFXCFSA-N 2 1 386.584 3.243 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000065872297 1408746028 /nfs/dbraw/zinc/74/60/28/1408746028.db2.gz OVHJAUXHHSBFNF-UHFFFAOYSA-N 2 1 375.476 3.426 20 0 GGADMP C[C@@H](CNC(=O)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)[NH+]1CCC(C)CC1 ZINC000065901189 1408750823 /nfs/dbraw/zinc/75/08/23/1408750823.db2.gz VLWFQTXGXRVBTA-ICSRJNTNSA-N 2 1 375.532 3.274 20 0 GGADMP CN(c1ccc(NC(=O)[C@@H](c2ccccc2)[NH+](C)C)cc1)C1CC[NH+](C)CC1 ZINC000066048123 1408778780 /nfs/dbraw/zinc/77/87/80/1408778780.db2.gz YFBDNVQTPCDGHU-JOCHJYFZSA-N 2 1 380.536 3.458 20 0 GGADMP CC[C@@H](C)[N@@H+](C)CCNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000066175944 1408787286 /nfs/dbraw/zinc/78/72/86/1408787286.db2.gz WDOZKJRCQMYBNS-MRXNPFEDSA-N 2 1 380.964 3.334 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000066190965 1408789546 /nfs/dbraw/zinc/78/95/46/1408789546.db2.gz ZEDWCYYVLXOQEV-OAQYLSRUSA-N 2 1 386.584 3.414 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cccc(OC(C)C)c3)CC2)CC1 ZINC000066568152 1408858450 /nfs/dbraw/zinc/85/84/50/1408858450.db2.gz RHWTYCNFXLZEGY-UHFFFAOYSA-N 2 1 387.568 3.240 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](CCc3ccccc3Cl)CC2)CC1 ZINC000066568085 1408858708 /nfs/dbraw/zinc/85/87/08/1408858708.db2.gz FTAGTYUUTQTZFZ-UHFFFAOYSA-N 2 1 377.960 3.149 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cc(F)cc4cccnc43)CC2)CC1 ZINC000066568212 1408858731 /nfs/dbraw/zinc/85/87/31/1408858731.db2.gz SUIXYCXAWVMDMY-UHFFFAOYSA-N 2 1 398.526 3.140 20 0 GGADMP CC[NH+]1CCC(n2nccc2NC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000066662677 1408879117 /nfs/dbraw/zinc/87/91/17/1408879117.db2.gz ZAKJPQZFXQQHIR-FQEVSTJZSA-N 2 1 395.551 3.391 20 0 GGADMP CC(C)[C@@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066896577 1408944662 /nfs/dbraw/zinc/94/46/62/1408944662.db2.gz DFRZOJLNLMRAQZ-JQVVWYNYSA-N 2 1 387.568 3.032 20 0 GGADMP CC(C)[C@@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066896577 1408944667 /nfs/dbraw/zinc/94/46/67/1408944667.db2.gz DFRZOJLNLMRAQZ-JQVVWYNYSA-N 2 1 387.568 3.032 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)NCc2ccccc2OC)CC1 ZINC000066960883 1408963430 /nfs/dbraw/zinc/96/34/30/1408963430.db2.gz ZOXPKAPPWAJURT-GOSISDBHSA-N 2 1 375.557 3.144 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc3c(c2)OCCO3)CC1 ZINC000066960903 1408963467 /nfs/dbraw/zinc/96/34/67/1408963467.db2.gz QUBLUQSYATVKPN-QGZVFWFLSA-N 2 1 389.540 3.229 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)NCc2cccc(OC)c2)CC1 ZINC000066960737 1408963515 /nfs/dbraw/zinc/96/35/15/1408963515.db2.gz CAKOUYADGIHRSB-SFHVURJKSA-N 2 1 375.557 3.144 20 0 GGADMP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(OC)cc2OC)CC1 ZINC000066960721 1408963684 /nfs/dbraw/zinc/96/36/84/1408963684.db2.gz FVWNKTBAEQQIFX-KRWDZBQOSA-N 2 1 391.556 3.475 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(OC)cc2OC)CC1 ZINC000066960721 1408963689 /nfs/dbraw/zinc/96/36/89/1408963689.db2.gz FVWNKTBAEQQIFX-KRWDZBQOSA-N 2 1 391.556 3.475 20 0 GGADMP CC(C)CN(CC[NH+](C)C)C(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000176561975 1428364013 /nfs/dbraw/zinc/36/40/13/1428364013.db2.gz JKBKFRRQDQONDT-SFHVURJKSA-N 2 1 376.545 3.131 20 0 GGADMP CC(C)CN(CC[NH+](C)C)C(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000176561959 1428364121 /nfs/dbraw/zinc/36/41/21/1428364121.db2.gz JKBKFRRQDQONDT-GOSISDBHSA-N 2 1 376.545 3.131 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]Cc3ccccc3N3CCOCC3)c2)CCO1 ZINC000066989575 1408973160 /nfs/dbraw/zinc/97/31/60/1408973160.db2.gz ZNXHDWQVFHJNAE-FQEVSTJZSA-N 2 1 395.547 3.034 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]Cc3ccccc3N3CCOCC3)c2)CCO1 ZINC000066989575 1408973165 /nfs/dbraw/zinc/97/31/65/1408973165.db2.gz ZNXHDWQVFHJNAE-FQEVSTJZSA-N 2 1 395.547 3.034 20 0 GGADMP C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2ccccc2Br)c1 ZINC000066994577 1408974898 /nfs/dbraw/zinc/97/48/98/1408974898.db2.gz TWJHRKQKDVTLHP-UHFFFAOYSA-N 2 1 390.325 3.030 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)cc1)[NH+]1CCOCC1 ZINC000176561747 1428364527 /nfs/dbraw/zinc/36/45/27/1428364527.db2.gz IWQHEUHTBQEAAA-RBUKOAKNSA-N 2 1 386.540 3.029 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000067121502 1409013439 /nfs/dbraw/zinc/01/34/39/1409013439.db2.gz YEUAWPQNTIPADR-UHFFFAOYSA-N 2 1 375.891 3.305 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000176583214 1428371414 /nfs/dbraw/zinc/37/14/14/1428371414.db2.gz BJKZDVFHVXGWJO-NMIHRBCNSA-N 2 1 384.568 3.308 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000176583214 1428371420 /nfs/dbraw/zinc/37/14/20/1428371420.db2.gz BJKZDVFHVXGWJO-NMIHRBCNSA-N 2 1 384.568 3.308 20 0 GGADMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000176583214 1428371427 /nfs/dbraw/zinc/37/14/27/1428371427.db2.gz BJKZDVFHVXGWJO-NMIHRBCNSA-N 2 1 384.568 3.308 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N2CCC(C[NH+](C)Cc3ccccc3)CC2)C1 ZINC000067280786 1409063005 /nfs/dbraw/zinc/06/30/05/1409063005.db2.gz CYDIJFPZWVRDCI-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1 ZINC000067280786 1409063011 /nfs/dbraw/zinc/06/30/11/1409063011.db2.gz CYDIJFPZWVRDCI-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C1 ZINC000067280786 1409063015 /nfs/dbraw/zinc/06/30/15/1409063015.db2.gz CYDIJFPZWVRDCI-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000067381876 1409094571 /nfs/dbraw/zinc/09/45/71/1409094571.db2.gz KVVKJJQJJNKHHA-UHFFFAOYSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+]Cc2cc3c(c(Br)c2)OCO3)C[C@H](C)O1 ZINC000067453138 1409122886 /nfs/dbraw/zinc/12/28/86/1409122886.db2.gz QMBJASMWAPHQNQ-OKILXGFUSA-N 2 1 399.329 3.157 20 0 GGADMP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1 ZINC000176604347 1428377479 /nfs/dbraw/zinc/37/74/79/1428377479.db2.gz KCEMIARGGBNCRE-FCHUYYIVSA-N 2 1 386.584 3.413 20 0 GGADMP Cn1cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(-c2cccnc2)n1 ZINC000067507071 1409140247 /nfs/dbraw/zinc/14/02/47/1409140247.db2.gz ZQAGCRVHRYFISP-FQEVSTJZSA-N 2 1 375.520 3.484 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C)[N@@H+]2CCCC[C@@H]2C)cc1F ZINC000067646526 1409195943 /nfs/dbraw/zinc/19/59/43/1409195943.db2.gz ZPPBIHKAXSJECQ-HOTGVXAUSA-N 2 1 387.503 3.382 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1F ZINC000067646526 1409195951 /nfs/dbraw/zinc/19/59/51/1409195951.db2.gz ZPPBIHKAXSJECQ-HOTGVXAUSA-N 2 1 387.503 3.382 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NCC[NH+](C(C)C)C(C)C)cc1F ZINC000067646303 1409196585 /nfs/dbraw/zinc/19/65/85/1409196585.db2.gz DVVQZMYTSRWILI-UHFFFAOYSA-N 2 1 375.492 3.238 20 0 GGADMP CC(C)[N@H+]1CC[C@H](CNC(=O)NC[C@@H](c2ccccc2)[NH+]2CCC(C)CC2)C1 ZINC000067684865 1409207091 /nfs/dbraw/zinc/20/70/91/1409207091.db2.gz LRYLRDQEMQMVLP-IRLDBZIGSA-N 2 1 386.584 3.489 20 0 GGADMP CC(C)[N@H+]1CC[C@@H](CNC(=O)NC[C@H](c2ccccc2)[NH+]2CCC(C)CC2)C1 ZINC000067684861 1409207192 /nfs/dbraw/zinc/20/71/92/1409207192.db2.gz LRYLRDQEMQMVLP-RBBKRZOGSA-N 2 1 386.584 3.489 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000067734504 1409217334 /nfs/dbraw/zinc/21/73/34/1409217334.db2.gz RTDZDCIKRNDFLQ-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000067735469 1409217443 /nfs/dbraw/zinc/21/74/43/1409217443.db2.gz FSUQGNHMQBSCDJ-VXKWHMMOSA-N 2 1 384.568 3.168 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CCC[C@@H]3C[NH+]3CCCCC3)cc2)C[C@H](C)O1 ZINC000068133589 1409311143 /nfs/dbraw/zinc/31/11/43/1409311143.db2.gz AVJPGGKKSICVOP-ZRCGQRJVSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CCC[C@@H]3C[NH+]3CCCCC3)cc2)C[C@H](C)O1 ZINC000068133589 1409311149 /nfs/dbraw/zinc/31/11/49/1409311149.db2.gz AVJPGGKKSICVOP-ZRCGQRJVSA-N 2 1 399.579 3.386 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000068209353 1409330172 /nfs/dbraw/zinc/33/01/72/1409330172.db2.gz LAIRXNUPSGPBGM-OALUTQOASA-N 2 1 387.568 3.242 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@H](C3CCCCC3)[NH+](C)C)CC2)cs1 ZINC000068277762 1409349879 /nfs/dbraw/zinc/34/98/79/1409349879.db2.gz QFLLFWQATCMKFN-HXUWFJFHSA-N 2 1 392.613 3.290 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@H](C)[N@@H+]3CCCC[C@@H]3C)CC2)cs1 ZINC000068278124 1409350759 /nfs/dbraw/zinc/35/07/59/1409350759.db2.gz FCQSJWXAYKKSKJ-HOTGVXAUSA-N 2 1 378.586 3.043 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NC[C@H](C)[N@H+]3CCCC[C@@H]3C)CC2)cs1 ZINC000068278124 1409350765 /nfs/dbraw/zinc/35/07/65/1409350765.db2.gz FCQSJWXAYKKSKJ-HOTGVXAUSA-N 2 1 378.586 3.043 20 0 GGADMP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000068325384 1409366581 /nfs/dbraw/zinc/36/65/81/1409366581.db2.gz BFTAAOSZWNLQKZ-HXUWFJFHSA-N 2 1 392.613 3.434 20 0 GGADMP CCCC[N@H+]1CCCC[C@@H]1CNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000068325384 1409366587 /nfs/dbraw/zinc/36/65/87/1409366587.db2.gz BFTAAOSZWNLQKZ-HXUWFJFHSA-N 2 1 392.613 3.434 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)Nc3ccc(CC[NH+](C)C)cc3)CC2)cs1 ZINC000068354974 1409377492 /nfs/dbraw/zinc/37/74/92/1409377492.db2.gz BJEIAXJVOWNQBY-UHFFFAOYSA-N 2 1 386.565 3.406 20 0 GGADMP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCC[NH+]1Cc2ccccc2C1 ZINC000068407112 1409393722 /nfs/dbraw/zinc/39/37/22/1409393722.db2.gz UDXMQWTZMVWDDT-UHFFFAOYSA-N 2 1 380.536 3.342 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)NCC[NH+]1Cc2ccccc2C1 ZINC000068407112 1409393730 /nfs/dbraw/zinc/39/37/30/1409393730.db2.gz UDXMQWTZMVWDDT-UHFFFAOYSA-N 2 1 380.536 3.342 20 0 GGADMP CC[NH+](CC)Cc1ccc(CNC(=O)NCC[NH+]2Cc3ccccc3C2)cc1 ZINC000068408110 1409394007 /nfs/dbraw/zinc/39/40/07/1409394007.db2.gz HAYUXADADVAWHO-UHFFFAOYSA-N 2 1 380.536 3.343 20 0 GGADMP CSc1ccc(NC(=O)C[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000069017042 1409544283 /nfs/dbraw/zinc/54/42/83/1409544283.db2.gz SLKGMRWCFPYEKY-CALCHBBNSA-N 2 1 391.581 3.168 20 0 GGADMP CSc1ccc(NC(=O)C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000069017042 1409544287 /nfs/dbraw/zinc/54/42/87/1409544287.db2.gz SLKGMRWCFPYEKY-CALCHBBNSA-N 2 1 391.581 3.168 20 0 GGADMP Cc1cc(C)c(NC(=O)C[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000069017212 1409544948 /nfs/dbraw/zinc/54/49/48/1409544948.db2.gz XEZCHWKDYJCZOM-PMACEKPBSA-N 2 1 387.568 3.372 20 0 GGADMP Cc1cc(Cl)ccc1NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000069029059 1409547008 /nfs/dbraw/zinc/54/70/08/1409547008.db2.gz BVEDDIVCJCZXJB-MRXNPFEDSA-N 2 1 379.932 3.020 20 0 GGADMP C[C@H]1C[C@H](NC(=O)CC2([NH+]3CCOCC3)CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000176720274 1428432842 /nfs/dbraw/zinc/43/28/42/1428432842.db2.gz WAMHKOVIGILPIM-RBBKRZOGSA-N 2 1 399.579 3.191 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)CC2([NH+]3CCOCC3)CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000176720291 1428433271 /nfs/dbraw/zinc/43/32/71/1428433271.db2.gz WAMHKOVIGILPIM-IRLDBZIGSA-N 2 1 399.579 3.191 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CC[NH+](C)C[C@@H]2c2ccccc2)C1 ZINC000071935856 1409831502 /nfs/dbraw/zinc/83/15/02/1409831502.db2.gz XUPFXQPNAVFHTK-RZUBCFFCSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N2CC[NH+](C)C[C@@H]2c2ccccc2)C1 ZINC000071935856 1409831505 /nfs/dbraw/zinc/83/15/05/1409831505.db2.gz XUPFXQPNAVFHTK-RZUBCFFCSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)C1 ZINC000071935856 1409831509 /nfs/dbraw/zinc/83/15/09/1409831509.db2.gz XUPFXQPNAVFHTK-RZUBCFFCSA-N 2 1 386.584 3.443 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)C1 ZINC000071935856 1409831514 /nfs/dbraw/zinc/83/15/14/1409831514.db2.gz XUPFXQPNAVFHTK-RZUBCFFCSA-N 2 1 386.584 3.443 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@@H](C(C)C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000072092399 1409848252 /nfs/dbraw/zinc/84/82/52/1409848252.db2.gz DTGZOVCXPKKNMC-XQBPLPMBSA-N 2 1 389.584 3.231 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@@H](C(C)C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000072092399 1409848254 /nfs/dbraw/zinc/84/82/54/1409848254.db2.gz DTGZOVCXPKKNMC-XQBPLPMBSA-N 2 1 389.584 3.231 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+](CC(=O)Nc2ccc(SC)cc2)CC1 ZINC000072694642 1409852470 /nfs/dbraw/zinc/85/24/70/1409852470.db2.gz IEGVQPPIJIIYDR-UHFFFAOYSA-N 2 1 379.570 3.170 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000073442812 1409861144 /nfs/dbraw/zinc/86/11/44/1409861144.db2.gz MRWSXPFZJGPUJI-OALUTQOASA-N 2 1 376.545 3.322 20 0 GGADMP CC[N@H+]1CCC[C@H]1CNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000073541811 1409861867 /nfs/dbraw/zinc/86/18/67/1409861867.db2.gz XBWWBNKWLAOSGO-IBGZPJMESA-N 2 1 378.948 3.088 20 0 GGADMP CC1CC[NH+](CCCNC(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000073536804 1409862144 /nfs/dbraw/zinc/86/21/44/1409862144.db2.gz VAZRXHJKXAFBRV-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000073618444 1409863240 /nfs/dbraw/zinc/86/32/40/1409863240.db2.gz JAKLMPQGNCRAGA-JOCHJYFZSA-N 2 1 386.584 3.209 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)CC1 ZINC000073620014 1409863282 /nfs/dbraw/zinc/86/32/82/1409863282.db2.gz YSAZSLMUYBRURE-QFIPXVFZSA-N 2 1 386.584 3.475 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3C)CC2)C1 ZINC000073619967 1409863318 /nfs/dbraw/zinc/86/33/18/1409863318.db2.gz KOQBFIOJGPJYRS-HXUWFJFHSA-N 2 1 386.584 3.333 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)CC1 ZINC000073620191 1409863406 /nfs/dbraw/zinc/86/34/06/1409863406.db2.gz YPXCXTDDFVAQAH-YADHBBJMSA-N 2 1 384.568 3.297 20 0 GGADMP C[C@@H](CNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[N@@H+]1CCc2sccc2C1 ZINC000073679454 1409864038 /nfs/dbraw/zinc/86/40/38/1409864038.db2.gz JACJYCNQPZWUGU-AWEZNQCLSA-N 2 1 378.586 3.103 20 0 GGADMP C[C@@H](CNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[N@H+]1CCc2sccc2C1 ZINC000073679454 1409864040 /nfs/dbraw/zinc/86/40/40/1409864040.db2.gz JACJYCNQPZWUGU-AWEZNQCLSA-N 2 1 378.586 3.103 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)N2CC[C@H]([NH+](C)Cc3ccccc3)C2)C1 ZINC000073677228 1409864196 /nfs/dbraw/zinc/86/41/96/1409864196.db2.gz PKBKRSOMYIZXOM-UNMCSNQZSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)N2CC[C@H]([N@H+](C)Cc3ccccc3)C2)C1 ZINC000073677228 1409864197 /nfs/dbraw/zinc/86/41/97/1409864197.db2.gz PKBKRSOMYIZXOM-UNMCSNQZSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@H]1CCC[NH+](CCCCNC(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)C1 ZINC000073677228 1409864200 /nfs/dbraw/zinc/86/42/00/1409864200.db2.gz PKBKRSOMYIZXOM-UNMCSNQZSA-N 2 1 386.584 3.414 20 0 GGADMP CC1CC[NH+](CCCCNC(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)CC1 ZINC000073675810 1409864239 /nfs/dbraw/zinc/86/42/39/1409864239.db2.gz SKXZJLCIQQMONE-QFIPXVFZSA-N 2 1 386.584 3.414 20 0 GGADMP C[C@@H](CNC(=O)N(C)CC[C@H]1CCCC[N@@H+]1C)[NH+]1CCc2sccc2C1 ZINC000073725381 1409864647 /nfs/dbraw/zinc/86/46/47/1409864647.db2.gz HTYHSMWMOCQRKM-FUHWJXTLSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(C)CC[C@H]1CCCC[N@H+]1C)[NH+]1CCc2sccc2C1 ZINC000073725381 1409864649 /nfs/dbraw/zinc/86/46/49/1409864649.db2.gz HTYHSMWMOCQRKM-FUHWJXTLSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(C)CC[C@H]1CCCC[NH+]1C)[N@@H+]1CCc2sccc2C1 ZINC000073725381 1409864651 /nfs/dbraw/zinc/86/46/51/1409864651.db2.gz HTYHSMWMOCQRKM-FUHWJXTLSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(C)CC[C@H]1CCCC[NH+]1C)[N@H+]1CCc2sccc2C1 ZINC000073725381 1409864652 /nfs/dbraw/zinc/86/46/52/1409864652.db2.gz HTYHSMWMOCQRKM-FUHWJXTLSA-N 2 1 378.586 3.011 20 0 GGADMP C[C@@H](CNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C[NH+]1CCCCC1 ZINC000073788434 1409865646 /nfs/dbraw/zinc/86/56/46/1409865646.db2.gz PCKODLNPXHAYAN-UNMCSNQZSA-N 2 1 386.584 3.272 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000073827461 1409865876 /nfs/dbraw/zinc/86/58/76/1409865876.db2.gz FGLUUYIMZAFCJX-SJBKTWHCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000073827461 1409865878 /nfs/dbraw/zinc/86/58/78/1409865878.db2.gz FGLUUYIMZAFCJX-SJBKTWHCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](C[NH+]1CCC[C@@H](C)C1)NC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000073827461 1409865883 /nfs/dbraw/zinc/86/58/83/1409865883.db2.gz FGLUUYIMZAFCJX-SJBKTWHCSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)C1 ZINC000074002413 1409868228 /nfs/dbraw/zinc/86/82/28/1409868228.db2.gz DFLVCIRKEKWUEB-QYZOEREBSA-N 2 1 376.545 3.178 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)C1 ZINC000074002413 1409868230 /nfs/dbraw/zinc/86/82/30/1409868230.db2.gz DFLVCIRKEKWUEB-QYZOEREBSA-N 2 1 376.545 3.178 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000074103395 1409868871 /nfs/dbraw/zinc/86/88/71/1409868871.db2.gz YJAOJSKQWJGQPZ-VXKWHMMOSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000074103395 1409868873 /nfs/dbraw/zinc/86/88/73/1409868873.db2.gz YJAOJSKQWJGQPZ-VXKWHMMOSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000074103395 1409868876 /nfs/dbraw/zinc/86/88/76/1409868876.db2.gz YJAOJSKQWJGQPZ-VXKWHMMOSA-N 2 1 386.584 3.270 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000074533676 1409873281 /nfs/dbraw/zinc/87/32/81/1409873281.db2.gz KEVGMETXLRVZNQ-AZUAARDMSA-N 2 1 375.561 3.268 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000074533676 1409873283 /nfs/dbraw/zinc/87/32/83/1409873283.db2.gz KEVGMETXLRVZNQ-AZUAARDMSA-N 2 1 375.561 3.268 20 0 GGADMP CCc1ccc([C@H](CNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)[NH+](C)C)cc1 ZINC000074833174 1409877246 /nfs/dbraw/zinc/87/72/46/1409877246.db2.gz GMTJJQWYKGQYOL-IRLDBZIGSA-N 2 1 386.584 3.225 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000074848830 1409877500 /nfs/dbraw/zinc/87/75/00/1409877500.db2.gz GDCSAYZIQZMCLZ-FQEVSTJZSA-N 2 1 386.584 3.400 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)N1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000074848830 1409877502 /nfs/dbraw/zinc/87/75/02/1409877502.db2.gz GDCSAYZIQZMCLZ-FQEVSTJZSA-N 2 1 386.584 3.400 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000074848830 1409877505 /nfs/dbraw/zinc/87/75/05/1409877505.db2.gz GDCSAYZIQZMCLZ-FQEVSTJZSA-N 2 1 386.584 3.400 20 0 GGADMP CC(C)[C@H](CNC(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1)[NH+]1CCC(C)CC1 ZINC000074850584 1409877630 /nfs/dbraw/zinc/87/76/30/1409877630.db2.gz LBZMHKBRHFCGHD-RTWAWAEBSA-N 2 1 378.605 3.116 20 0 GGADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)N2CC[C@H](C[NH+](C)CC3CC3)C2)C1 ZINC000074858059 1409877938 /nfs/dbraw/zinc/87/79/38/1409877938.db2.gz ZGWHBWGOSIYBKZ-UZKOGDIHSA-N 2 1 384.568 3.195 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)C1 ZINC000074858059 1409877941 /nfs/dbraw/zinc/87/79/41/1409877941.db2.gz ZGWHBWGOSIYBKZ-UZKOGDIHSA-N 2 1 384.568 3.195 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)C1 ZINC000074858059 1409877944 /nfs/dbraw/zinc/87/79/44/1409877944.db2.gz ZGWHBWGOSIYBKZ-UZKOGDIHSA-N 2 1 384.568 3.195 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NC2CC[NH+](CC3CCCCC3)CC2)C1 ZINC000074868202 1409878189 /nfs/dbraw/zinc/87/81/89/1409878189.db2.gz GVEPIEFMZFIRRT-NRFANRHFSA-N 2 1 390.616 3.404 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(C)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000074876233 1409878820 /nfs/dbraw/zinc/87/88/20/1409878820.db2.gz ULKHVRXDCWFDSQ-FCHUYYIVSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000074876233 1409878823 /nfs/dbraw/zinc/87/88/23/1409878823.db2.gz ULKHVRXDCWFDSQ-FCHUYYIVSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000074876233 1409878824 /nfs/dbraw/zinc/87/88/24/1409878824.db2.gz ULKHVRXDCWFDSQ-FCHUYYIVSA-N 2 1 386.584 3.413 20 0 GGADMP COc1ccc(Cl)cc1NC(=O)CC[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000075835599 1409883346 /nfs/dbraw/zinc/88/33/46/1409883346.db2.gz HIJTWGSHBFRCGN-INIZCTEOSA-N 2 1 379.932 3.485 20 0 GGADMP CC1CC[NH+](Cc2cccc(CNC(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)c2)CC1 ZINC000076554180 1409889336 /nfs/dbraw/zinc/88/93/36/1409889336.db2.gz SIPPYVIBONEADF-NRFANRHFSA-N 2 1 384.568 3.202 20 0 GGADMP CC(C)[N@H+](CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)Cc1ccccn1 ZINC000076777193 1409891576 /nfs/dbraw/zinc/89/15/76/1409891576.db2.gz FFXRWPJOTAIAGL-UHFFFAOYSA-N 2 1 380.536 3.204 20 0 GGADMP CC(C)[N@@H+](CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)Cc1ccccn1 ZINC000076777193 1409891577 /nfs/dbraw/zinc/89/15/77/1409891577.db2.gz FFXRWPJOTAIAGL-UHFFFAOYSA-N 2 1 380.536 3.204 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]2CCC[C@H]2c2ccc[nH]2)CC1 ZINC000077171298 1409893753 /nfs/dbraw/zinc/89/37/53/1409893753.db2.gz BZAFQCSLCQCPER-QFIPXVFZSA-N 2 1 380.536 3.241 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@H]2c2ccc[nH]2)CC1 ZINC000077171298 1409893754 /nfs/dbraw/zinc/89/37/54/1409893754.db2.gz BZAFQCSLCQCPER-QFIPXVFZSA-N 2 1 380.536 3.241 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)N1CCC[NH+]2CCC[C@@H]2C1 ZINC000077763980 1409899808 /nfs/dbraw/zinc/89/98/08/1409899808.db2.gz VFXOBUFWHLWUMP-SIKLNZKXSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N1CCC[N@@H+]2CCC[C@@H]2C1 ZINC000077763980 1409899810 /nfs/dbraw/zinc/89/98/10/1409899810.db2.gz VFXOBUFWHLWUMP-SIKLNZKXSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000077763980 1409899814 /nfs/dbraw/zinc/89/98/14/1409899814.db2.gz VFXOBUFWHLWUMP-SIKLNZKXSA-N 2 1 384.568 3.441 20 0 GGADMP C[C@@H](CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000077774184 1409899860 /nfs/dbraw/zinc/89/98/60/1409899860.db2.gz YLAWYWUEQGKEPK-UXHICEINSA-N 2 1 386.584 3.113 20 0 GGADMP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CCC[NH+]1Cc1ccccn1 ZINC000077981569 1409906622 /nfs/dbraw/zinc/90/66/22/1409906622.db2.gz NIWZUNDJVREJNM-QFIPXVFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CCC[NH+]1Cc1ccccn1 ZINC000077981569 1409906629 /nfs/dbraw/zinc/90/66/29/1409906629.db2.gz NIWZUNDJVREJNM-QFIPXVFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000077981569 1409906645 /nfs/dbraw/zinc/90/66/45/1409906645.db2.gz NIWZUNDJVREJNM-QFIPXVFZSA-N 2 1 380.536 3.203 20 0 GGADMP CC(C)[NH+](C)Cc1ccccc1CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1 ZINC000077981569 1409906656 /nfs/dbraw/zinc/90/66/56/1409906656.db2.gz NIWZUNDJVREJNM-QFIPXVFZSA-N 2 1 380.536 3.203 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC000078322904 1409913159 /nfs/dbraw/zinc/91/31/59/1409913159.db2.gz HUUZNAWBMUOGGA-UHFFFAOYSA-N 2 1 380.536 3.166 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)cc2)CC1 ZINC000079168916 1409961009 /nfs/dbraw/zinc/96/10/09/1409961009.db2.gz OKPDMVIUJGSQDD-NRFANRHFSA-N 2 1 384.568 3.202 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)NC[C@@H]1CC[NH+](C2CC2)C1 ZINC000079169118 1409961099 /nfs/dbraw/zinc/96/10/99/1409961099.db2.gz VQCGEVWDGYDSED-OALUTQOASA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000079169118 1409961108 /nfs/dbraw/zinc/96/11/08/1409961108.db2.gz VQCGEVWDGYDSED-OALUTQOASA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000079169118 1409961118 /nfs/dbraw/zinc/96/11/18/1409961118.db2.gz VQCGEVWDGYDSED-OALUTQOASA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)NC[C@@H]2CC[NH+](C3CC3)C2)cc1 ZINC000079169045 1409961605 /nfs/dbraw/zinc/96/16/05/1409961605.db2.gz VYBUKTNNPDUIOM-RXVVDRJESA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000079169045 1409961614 /nfs/dbraw/zinc/96/16/14/1409961614.db2.gz VYBUKTNNPDUIOM-RXVVDRJESA-N 2 1 384.568 3.345 20 0 GGADMP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000079169045 1409961626 /nfs/dbraw/zinc/96/16/26/1409961626.db2.gz VYBUKTNNPDUIOM-RXVVDRJESA-N 2 1 384.568 3.345 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000079227910 1409963430 /nfs/dbraw/zinc/96/34/30/1409963430.db2.gz YRDRGZRPOGBMQP-XLIONFOSSA-N 2 1 378.536 3.240 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000079256840 1409963944 /nfs/dbraw/zinc/96/39/44/1409963944.db2.gz SUZSTDZQPCXRJP-NRFANRHFSA-N 2 1 384.568 3.093 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000176742088 1428444850 /nfs/dbraw/zinc/44/48/50/1428444850.db2.gz WTRGGQBTJAJDIX-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@H]1CCCC[NH+]1CCNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000176742088 1428444854 /nfs/dbraw/zinc/44/48/54/1428444854.db2.gz WTRGGQBTJAJDIX-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@H]1CCCC[NH+]1CCNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000176742088 1428444857 /nfs/dbraw/zinc/44/48/57/1428444857.db2.gz WTRGGQBTJAJDIX-VXKWHMMOSA-N 2 1 386.584 3.414 20 0 GGADMP CC(C)(CNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1)[N@H+]1CCc2ccccc2C1 ZINC000079493655 1409978604 /nfs/dbraw/zinc/97/86/04/1409978604.db2.gz ZHAVRORVLOPIGB-NRFANRHFSA-N 2 1 384.568 3.093 20 0 GGADMP CC[NH+](CC)CCN(Cc1cccs1)C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000079551692 1409981038 /nfs/dbraw/zinc/98/10/38/1409981038.db2.gz BURWDOPYJAAQSW-RTBURBONSA-N 2 1 378.586 3.228 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CCC([NH+]2CCCCC2)CC1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000079640830 1409983538 /nfs/dbraw/zinc/98/35/38/1409983538.db2.gz VXQGYHXVXUGUJM-XCJHPPCASA-N 2 1 379.589 3.034 20 0 GGADMP CC(C)[C@@H](C(=O)NC1CCC([NH+]2CCCCC2)CC1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000079640830 1409983555 /nfs/dbraw/zinc/98/35/55/1409983555.db2.gz VXQGYHXVXUGUJM-XCJHPPCASA-N 2 1 379.589 3.034 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NCCC[NH+]2CCc3ccccc3C2)CC1 ZINC000079610346 1409983729 /nfs/dbraw/zinc/98/37/29/1409983729.db2.gz AUOJQDXMYJNSRR-UHFFFAOYSA-N 2 1 386.584 3.197 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)NCCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC000079610346 1409983745 /nfs/dbraw/zinc/98/37/45/1409983745.db2.gz AUOJQDXMYJNSRR-UHFFFAOYSA-N 2 1 386.584 3.197 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)NCCC[N@H+]2CCc3ccccc3C2)CC1 ZINC000079610346 1409983757 /nfs/dbraw/zinc/98/37/57/1409983757.db2.gz AUOJQDXMYJNSRR-UHFFFAOYSA-N 2 1 386.584 3.197 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@@H](C)[NH+]2CCc3ccccc3C2)CC1 ZINC000079620864 1409984331 /nfs/dbraw/zinc/98/43/31/1409984331.db2.gz HIFKAEAVIPGEPP-LJQANCHMSA-N 2 1 386.584 3.195 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)NC[C@@H](C)[N@@H+]2CCc3ccccc3C2)CC1 ZINC000079620864 1409984346 /nfs/dbraw/zinc/98/43/46/1409984346.db2.gz HIFKAEAVIPGEPP-LJQANCHMSA-N 2 1 386.584 3.195 20 0 GGADMP CC(C)[NH+](C)CC1CCN(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000079620864 1409984361 /nfs/dbraw/zinc/98/43/61/1409984361.db2.gz HIFKAEAVIPGEPP-LJQANCHMSA-N 2 1 386.584 3.195 20 0 GGADMP CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)CC1 ZINC000079652121 1409985650 /nfs/dbraw/zinc/98/56/50/1409985650.db2.gz QLUDQKWJUTWEIF-FQEVSTJZSA-N 2 1 378.536 3.190 20 0 GGADMP O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)NC1CCC([NH+]2CCCCC2)CC1 ZINC000080057101 1409999527 /nfs/dbraw/zinc/99/95/27/1409999527.db2.gz FQRYZYBTJVEZAW-ORFBVSJDSA-N 2 1 384.568 3.357 20 0 GGADMP CCc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(OCC[NH+](CC)CC)CC2)cc1 ZINC000080650709 1410008779 /nfs/dbraw/zinc/00/87/79/1410008779.db2.gz BJQHCWICLQMOGU-GOSISDBHSA-N 2 1 375.557 3.399 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)C1 ZINC000080657275 1410008888 /nfs/dbraw/zinc/00/88/88/1410008888.db2.gz ZWCNFVMCVMQIJJ-UNMCSNQZSA-N 2 1 384.568 3.197 20 0 GGADMP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)C(=O)Nc2cc(C)cc(C)c2)CC1 ZINC000080650681 1410009436 /nfs/dbraw/zinc/00/94/36/1410009436.db2.gz ICFSZONCWAWNGI-IBGZPJMESA-N 2 1 375.557 3.453 20 0 GGADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)C1 ZINC000080664481 1410010124 /nfs/dbraw/zinc/01/01/24/1410010124.db2.gz RAGHHZSJMUFBDP-UNMCSNQZSA-N 2 1 384.568 3.197 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000081156067 1410015760 /nfs/dbraw/zinc/01/57/60/1410015760.db2.gz WTMSIKFUEBIGRW-IBGZPJMESA-N 2 1 380.536 3.103 20 0 GGADMP CC[NH+](CC)C[C@H]1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)C1 ZINC000081333736 1410017470 /nfs/dbraw/zinc/01/74/70/1410017470.db2.gz AHSHVLMUEYJLDV-UXHICEINSA-N 2 1 375.532 3.228 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3CCSCC3)cc2)C1 ZINC000081361737 1410018478 /nfs/dbraw/zinc/01/84/78/1410018478.db2.gz GJWOAIRGMBUBAJ-IBGZPJMESA-N 2 1 375.582 3.039 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)[C@@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)CC1 ZINC000081725349 1410024309 /nfs/dbraw/zinc/02/43/09/1410024309.db2.gz FQCUTEMVUXFMNR-NRFANRHFSA-N 2 1 375.532 3.371 20 0 GGADMP C[NH+](C)CCC1CCN(C(=O)[C@@H]2CCCC[N@H+]2Cc2ccc(F)cc2)CC1 ZINC000081725349 1410024318 /nfs/dbraw/zinc/02/43/18/1410024318.db2.gz FQCUTEMVUXFMNR-NRFANRHFSA-N 2 1 375.532 3.371 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCC(=O)Nc3cc(N)ccc3F)C2)CC1 ZINC000083173882 1410027670 /nfs/dbraw/zinc/02/76/70/1410027670.db2.gz AFJIEFBXHIALBG-KRWDZBQOSA-N 2 1 376.520 3.180 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2cc(N)ccc2F)C1 ZINC000083173087 1410027956 /nfs/dbraw/zinc/02/79/56/1410027956.db2.gz CEXYCZMOYNVWOR-IAGOWNOFSA-N 2 1 376.520 3.323 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCC(=O)Nc2cc(N)ccc2F)C1 ZINC000083173087 1410027963 /nfs/dbraw/zinc/02/79/63/1410027963.db2.gz CEXYCZMOYNVWOR-IAGOWNOFSA-N 2 1 376.520 3.323 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc(N)ccc2F)C1 ZINC000083173087 1410027967 /nfs/dbraw/zinc/02/79/67/1410027967.db2.gz CEXYCZMOYNVWOR-IAGOWNOFSA-N 2 1 376.520 3.323 20 0 GGADMP Cc1ncc(C[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)n1-c1ccccc1 ZINC000084051130 1410034111 /nfs/dbraw/zinc/03/41/11/1410034111.db2.gz ONGQYCUZXISHFL-UHFFFAOYSA-N 2 1 376.508 3.346 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N(C)[C@@H]3CC[NH+](C)C[C@@H]3C)cc2)C1 ZINC000085389945 1410040475 /nfs/dbraw/zinc/04/04/75/1410040475.db2.gz WTYCWUTVORDHEO-XQBPLPMBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N(C)[C@@H]3CC[N@H+](C)C[C@@H]3C)cc2)C1 ZINC000085389945 1410040482 /nfs/dbraw/zinc/04/04/82/1410040482.db2.gz WTYCWUTVORDHEO-XQBPLPMBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N(C)[C@@H]3CC[N@@H+](C)C[C@@H]3C)cc2)C1 ZINC000085389945 1410040489 /nfs/dbraw/zinc/04/04/89/1410040489.db2.gz WTYCWUTVORDHEO-XQBPLPMBSA-N 2 1 386.584 3.400 20 0 GGADMP CC(C)CN(CC[NH+](C)C)C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000085579535 1410042207 /nfs/dbraw/zinc/04/22/07/1410042207.db2.gz LNHJXIIRUUMJJM-UHFFFAOYSA-N 2 1 378.586 3.287 20 0 GGADMP Cc1csc(N2CCC([NH2+]CC3([NH+]4CCCCC4)CCOCC3)CC2)n1 ZINC000089594489 1410055865 /nfs/dbraw/zinc/05/58/65/1410055865.db2.gz LDYYDNFGKANMKZ-UHFFFAOYSA-N 2 1 378.586 3.045 20 0 GGADMP CN1CCC([NH+]2CCC(N[C@@H]3C[N@H+](Cc4ccccc4)C(C)(C)C3)CC2)CC1 ZINC000090172032 1410062984 /nfs/dbraw/zinc/06/29/84/1410062984.db2.gz ZOTHPNSWQHPHFZ-QFIPXVFZSA-N 2 1 384.612 3.188 20 0 GGADMP CN1CCC([NH+]2CCC(N[C@@H]3C[N@@H+](Cc4ccccc4)C(C)(C)C3)CC2)CC1 ZINC000090172032 1410062993 /nfs/dbraw/zinc/06/29/93/1410062993.db2.gz ZOTHPNSWQHPHFZ-QFIPXVFZSA-N 2 1 384.612 3.188 20 0 GGADMP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000090585702 1410065095 /nfs/dbraw/zinc/06/50/95/1410065095.db2.gz GDFANFXKHNAJDX-ROUUACIJSA-N 2 1 381.586 3.467 20 0 GGADMP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)ccc1S(C)(=O)=O ZINC000090586822 1410065368 /nfs/dbraw/zinc/06/53/68/1410065368.db2.gz JOSXMMDPNIVJOP-DLBZAZTESA-N 2 1 382.570 3.117 20 0 GGADMP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)ccc1S(C)(=O)=O ZINC000090586822 1410065377 /nfs/dbraw/zinc/06/53/77/1410065377.db2.gz JOSXMMDPNIVJOP-DLBZAZTESA-N 2 1 382.570 3.117 20 0 GGADMP C[C@H]([NH2+]CCN1CC[NH+](Cc2ccccc2)CC1)c1nc2ccccc2n1C ZINC000091265347 1410071652 /nfs/dbraw/zinc/07/16/52/1410071652.db2.gz LIUQHEICURIEFS-IBGZPJMESA-N 2 1 377.536 3.042 20 0 GGADMP C[C@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1nc2ccc(Cl)cc2n1C ZINC000091333140 1410072365 /nfs/dbraw/zinc/07/23/65/1410072365.db2.gz BYPPAJJGSKAMFB-HNNXBMFYSA-N 2 1 377.964 3.151 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2nc3ccc(Cl)cc3n2C)CC1 ZINC000091285176 1410072580 /nfs/dbraw/zinc/07/25/80/1410072580.db2.gz LOMGFZITQJMRKG-MRXNPFEDSA-N 2 1 377.964 3.295 20 0 GGADMP Cc1noc([C@@H]2CCC[N@H+](Cc3ccccc3N(C)C3CC[NH+](C)CC3)C2)n1 ZINC000091832890 1410084366 /nfs/dbraw/zinc/08/43/66/1410084366.db2.gz FNLRRSKOEVWOAD-LJQANCHMSA-N 2 1 383.540 3.288 20 0 GGADMP C[C@@H]1CC[N@@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@@H]1n1ccnc1 ZINC000091960576 1410095096 /nfs/dbraw/zinc/09/50/96/1410095096.db2.gz WWVFRRZWVXXSFD-XXBNENTESA-N 2 1 381.568 3.497 20 0 GGADMP Cc1ccc(NC(=O)[C@H]2CCC[N@H+](Cc3ccc(OCC[NH+](C)C)cc3)C2)nc1 ZINC000092003956 1410096404 /nfs/dbraw/zinc/09/64/04/1410096404.db2.gz IQTYOCQTHZVCBR-FQEVSTJZSA-N 2 1 396.535 3.181 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(Cl)c(F)c2)CC1 ZINC000092427159 1410157127 /nfs/dbraw/zinc/15/71/27/1410157127.db2.gz JYDRNMGQXDKHJE-UHFFFAOYSA-N 2 1 383.939 3.395 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2cc(Cl)ccc2F)CC1 ZINC000092426885 1410157316 /nfs/dbraw/zinc/15/73/16/1410157316.db2.gz OSUFNRYJVRMCDB-UHFFFAOYSA-N 2 1 383.939 3.395 20 0 GGADMP COc1cc(OC)c(C[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(OC)c1 ZINC000092587391 1410176142 /nfs/dbraw/zinc/17/61/42/1410176142.db2.gz SWJNWDKVWKEQBN-CALCHBBNSA-N 2 1 392.540 3.034 20 0 GGADMP COc1cc(OC)c(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(OC)c1 ZINC000092587391 1410176153 /nfs/dbraw/zinc/17/61/53/1410176153.db2.gz SWJNWDKVWKEQBN-CALCHBBNSA-N 2 1 392.540 3.034 20 0 GGADMP COCCOc1ccccc1C[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000092587425 1410176210 /nfs/dbraw/zinc/17/62/10/1410176210.db2.gz YBOJEDIMUHDNGB-KDURUIRLSA-N 2 1 376.541 3.033 20 0 GGADMP CCOc1cc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1OC ZINC000092587249 1410176426 /nfs/dbraw/zinc/17/64/26/1410176426.db2.gz IVLIKTXMDAFHOR-HDICACEKSA-N 2 1 376.541 3.415 20 0 GGADMP COCCOc1cccc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000092587094 1410176753 /nfs/dbraw/zinc/17/67/53/1410176753.db2.gz YZEBHIDOXGYEQP-KDURUIRLSA-N 2 1 376.541 3.033 20 0 GGADMP COCCOc1ccc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000092587496 1410176919 /nfs/dbraw/zinc/17/69/19/1410176919.db2.gz FVNQOCARFNXQAM-KDURUIRLSA-N 2 1 376.541 3.033 20 0 GGADMP COc1cc(C[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc(OC)c1OC ZINC000092587439 1410177327 /nfs/dbraw/zinc/17/73/27/1410177327.db2.gz OSOSSDGQKRQWKN-CALCHBBNSA-N 2 1 392.540 3.034 20 0 GGADMP Cc1cccc(-c2n[nH]cc2C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1 ZINC000092665287 1410184694 /nfs/dbraw/zinc/18/46/94/1410184694.db2.gz CYZRWMLQJATUDP-PMACEKPBSA-N 2 1 381.568 3.376 20 0 GGADMP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](Cc2ccc(OCC(F)F)cc2)CC1 ZINC000092664810 1410185059 /nfs/dbraw/zinc/18/50/59/1410185059.db2.gz QVLYLOLCRLUIGH-ROUUACIJSA-N 2 1 381.511 3.321 20 0 GGADMP COc1ccc(-c2n[nH]cc2C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000092666262 1410185998 /nfs/dbraw/zinc/18/59/98/1410185998.db2.gz CZIYZIISLUTAHJ-KDURUIRLSA-N 2 1 397.567 3.076 20 0 GGADMP COc1ccc(-c2n[nH]cc2C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000092666262 1410186002 /nfs/dbraw/zinc/18/60/02/1410186002.db2.gz CZIYZIISLUTAHJ-KDURUIRLSA-N 2 1 397.567 3.076 20 0 GGADMP CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000092706614 1410191607 /nfs/dbraw/zinc/19/16/07/1410191607.db2.gz YZDHALFRUWMCCK-OAQYLSRUSA-N 2 1 387.568 3.145 20 0 GGADMP CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000092730415 1410194251 /nfs/dbraw/zinc/19/42/51/1410194251.db2.gz GGASRRNYCJHPCS-UYAOXDASSA-N 2 1 375.557 3.144 20 0 GGADMP C[C@@H](C1CC1)N(C(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)C1CC1 ZINC000092821386 1410204070 /nfs/dbraw/zinc/20/40/70/1410204070.db2.gz GORLGDOMYYVKIN-SFHVURJKSA-N 2 1 384.568 3.409 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCN(c2ccccc2)C1=O ZINC000092821371 1410204185 /nfs/dbraw/zinc/20/41/85/1410204185.db2.gz CAKZBNQYYXQGQK-QFIPXVFZSA-N 2 1 378.520 3.425 20 0 GGADMP C[C@@H](C(=O)NCc1ccccc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092820974 1410204341 /nfs/dbraw/zinc/20/43/41/1410204341.db2.gz SINWJUGWAIBLNQ-IBGZPJMESA-N 2 1 380.536 3.325 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)N1CCc2ccccc21 ZINC000092820942 1410204409 /nfs/dbraw/zinc/20/44/09/1410204409.db2.gz DYYCFMQRMMXILU-UHFFFAOYSA-N 2 1 378.520 3.209 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3cn(C)nc3-c3ccccc3)CC2)nc(C)[nH+]1 ZINC000093079672 1410220058 /nfs/dbraw/zinc/22/00/58/1410220058.db2.gz YITDGGFDBIBJAR-UHFFFAOYSA-N 2 1 376.508 3.253 20 0 GGADMP CCCCOc1cc(C[N@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)ccc1OC ZINC000093132966 1410223089 /nfs/dbraw/zinc/22/30/89/1410223089.db2.gz DUMIUOFLTIWBRS-FQEVSTJZSA-N 2 1 375.557 3.086 20 0 GGADMP CCCCCOc1cc(C[N@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)ccc1OC ZINC000093133098 1410223152 /nfs/dbraw/zinc/22/31/52/1410223152.db2.gz ZBVONHRKVDDZKB-NRFANRHFSA-N 2 1 389.584 3.476 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cn(-c4ccccc4)nc3C(C)(C)C)C2)CC1 ZINC000093133006 1410223214 /nfs/dbraw/zinc/22/32/14/1410223214.db2.gz UXKPEYWICOSFGN-JOCHJYFZSA-N 2 1 395.595 3.382 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(-n4cnc5ccccc54)cc3)C2)CC1 ZINC000093133050 1410223404 /nfs/dbraw/zinc/22/34/04/1410223404.db2.gz IRGDLWZKBYYZBH-JOCHJYFZSA-N 2 1 389.547 3.237 20 0 GGADMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(-n4cnc5ccccc54)cc3)C2)CC1 ZINC000093133051 1410223811 /nfs/dbraw/zinc/22/38/11/1410223811.db2.gz IRGDLWZKBYYZBH-QFIPXVFZSA-N 2 1 389.547 3.237 20 0 GGADMP CCCOc1ccc(C[N@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)cc1OCC ZINC000093133046 1410224250 /nfs/dbraw/zinc/22/42/50/1410224250.db2.gz XEHYRZRDYYXSFH-FQEVSTJZSA-N 2 1 375.557 3.086 20 0 GGADMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cn(-c4ccccc4)nc3C(C)C)C2)CC1 ZINC000093132624 1410224273 /nfs/dbraw/zinc/22/42/73/1410224273.db2.gz LRYYAUDTIZRNMW-JOCHJYFZSA-N 2 1 381.568 3.208 20 0 GGADMP c1cc(OCC[NH+]2CCCC2)ccc1C[N@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000093134539 1410225244 /nfs/dbraw/zinc/22/52/44/1410225244.db2.gz SMMRMQFDCLIRQJ-HXUWFJFHSA-N 2 1 395.551 3.079 20 0 GGADMP COc1ccc(OC(F)F)c(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000093735040 1410261710 /nfs/dbraw/zinc/26/17/10/1410261710.db2.gz WXVQUCDVQXEFPQ-UHFFFAOYSA-N 2 1 384.467 3.373 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2ccccc2N2CCOCC2)CC1 ZINC000093769466 1410265876 /nfs/dbraw/zinc/26/58/76/1410265876.db2.gz NJCDVOXZUIUDLD-UHFFFAOYSA-N 2 1 389.584 3.094 20 0 GGADMP Cc1cc(C[NH+]2CCC(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1-n1cncn1 ZINC000093844193 1410274999 /nfs/dbraw/zinc/27/49/99/1410274999.db2.gz OYKKMGXMEYNCIH-BGYRXZFFSA-N 2 1 397.567 3.287 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3c[nH]nc3-c3cccnc3)CC2)C[C@H](C)O1 ZINC000093844403 1410275532 /nfs/dbraw/zinc/27/55/32/1410275532.db2.gz INMDPDDRVKAEIU-HDICACEKSA-N 2 1 383.540 3.183 20 0 GGADMP O=C([C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000096626722 1410335280 /nfs/dbraw/zinc/33/52/80/1410335280.db2.gz XQABQDDTFHBCMT-JOCHJYFZSA-N 2 1 395.522 3.382 20 0 GGADMP O=C([C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000096626722 1410335287 /nfs/dbraw/zinc/33/52/87/1410335287.db2.gz XQABQDDTFHBCMT-JOCHJYFZSA-N 2 1 395.522 3.382 20 0 GGADMP COc1cccc([C@@H](CNC(=O)NCCC[N@@H+](C)C2CCCCC2)[NH+](C)C)c1 ZINC000097357809 1410365842 /nfs/dbraw/zinc/36/58/42/1410365842.db2.gz CSQQMONNKNYXTR-OAQYLSRUSA-N 2 1 390.572 3.252 20 0 GGADMP C[C@@H](C[NH+]1CCCCC1)NC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000097428484 1410369347 /nfs/dbraw/zinc/36/93/47/1410369347.db2.gz DGYABZVHRXSMKW-SFHVURJKSA-N 2 1 392.975 3.432 20 0 GGADMP C[C@@H](C[NH+]1CCCCC1)NC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000097428484 1410369355 /nfs/dbraw/zinc/36/93/55/1410369355.db2.gz DGYABZVHRXSMKW-SFHVURJKSA-N 2 1 392.975 3.432 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1ccc(Oc2cccnc2)cc1 ZINC000101518396 1410444407 /nfs/dbraw/zinc/44/44/07/1410444407.db2.gz LVCIVOXQWPIUQS-FQEVSTJZSA-N 2 1 396.535 3.362 20 0 GGADMP Cc1cc(F)ccc1C[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000101593799 1410474781 /nfs/dbraw/zinc/47/47/81/1410474781.db2.gz QRBKNDXPNKLUAZ-UHFFFAOYSA-N 2 1 385.483 3.085 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCC2)cc1 ZINC000101644967 1410484492 /nfs/dbraw/zinc/48/44/92/1410484492.db2.gz UYCFPKOZBLZQSU-UHFFFAOYSA-N 2 1 397.523 3.425 20 0 GGADMP CCC[N@H+]1CC[C@@H](CNC(=O)N2CCC[NH+](CCCc3ccccc3)CC2)C1 ZINC000101749209 1410498622 /nfs/dbraw/zinc/49/86/22/1410498622.db2.gz KDJMICAOQHGAOK-QFIPXVFZSA-N 2 1 386.584 3.068 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC[N@H+](CCCc3ccccc3)CC2)C1 ZINC000101749209 1410498624 /nfs/dbraw/zinc/49/86/24/1410498624.db2.gz KDJMICAOQHGAOK-QFIPXVFZSA-N 2 1 386.584 3.068 20 0 GGADMP CCC[NH+]1CC[C@@H](CNC(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)C1 ZINC000101749209 1410498628 /nfs/dbraw/zinc/49/86/28/1410498628.db2.gz KDJMICAOQHGAOK-QFIPXVFZSA-N 2 1 386.584 3.068 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)CC2)[nH+]c1 ZINC000176832512 1428491661 /nfs/dbraw/zinc/49/16/61/1428491661.db2.gz VEPBYRZLCIODKG-SFHVURJKSA-N 2 1 375.561 3.024 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)CC2)[nH+]c1 ZINC000176832529 1428491911 /nfs/dbraw/zinc/49/19/11/1428491911.db2.gz VEPBYRZLCIODKG-GOSISDBHSA-N 2 1 375.561 3.024 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1F ZINC000101993472 1410538493 /nfs/dbraw/zinc/53/84/93/1410538493.db2.gz QXTVIKXYKOYGOI-JKSUJKDBSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1F ZINC000101993472 1410538502 /nfs/dbraw/zinc/53/85/02/1410538502.db2.gz QXTVIKXYKOYGOI-JKSUJKDBSA-N 2 1 387.503 3.239 20 0 GGADMP CC[NH+](CC)CCC[C@@H](C)NC(=O)[C@H](c1ccccc1)[NH+]1CCSCC1 ZINC000102636789 1410681272 /nfs/dbraw/zinc/68/12/72/1410681272.db2.gz RXHZEKFEPSCUEP-QUCCMNQESA-N 2 1 377.598 3.403 20 0 GGADMP C[N@@H+](CCOc1cccc(C[NH2+]Cc2cccc3c2OCO3)c1)C1CCOCC1 ZINC000102781485 1410752209 /nfs/dbraw/zinc/75/22/09/1410752209.db2.gz ZCVXZAJVUHXFPI-UHFFFAOYSA-N 2 1 398.503 3.195 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)[nH+]c1 ZINC000176882445 1428511015 /nfs/dbraw/zinc/51/10/15/1428511015.db2.gz ABIKCCMGDGBFJS-OAQYLSRUSA-N 2 1 395.551 3.356 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)[nH+]c1 ZINC000176882445 1428511022 /nfs/dbraw/zinc/51/10/22/1428511022.db2.gz ABIKCCMGDGBFJS-OAQYLSRUSA-N 2 1 395.551 3.356 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@H](O)COc2ccc(F)cc2)CC1 ZINC000103143036 1410831326 /nfs/dbraw/zinc/83/13/26/1410831326.db2.gz ZSECLTDIFHIXLZ-QFIPXVFZSA-N 2 1 386.511 3.409 20 0 GGADMP COc1ccc(CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c(OC)c1OC ZINC000103173945 1410834285 /nfs/dbraw/zinc/83/42/85/1410834285.db2.gz KSEQIUZWDRGAKR-LJQANCHMSA-N 2 1 384.520 3.367 20 0 GGADMP COc1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c(OC)c1OC ZINC000103173945 1410834288 /nfs/dbraw/zinc/83/42/88/1410834288.db2.gz KSEQIUZWDRGAKR-LJQANCHMSA-N 2 1 384.520 3.367 20 0 GGADMP COc1ccc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)c(OC)c1OC ZINC000103173945 1410834290 /nfs/dbraw/zinc/83/42/90/1410834290.db2.gz KSEQIUZWDRGAKR-LJQANCHMSA-N 2 1 384.520 3.367 20 0 GGADMP C[C@H](C(=O)Nc1cc(C[NH+](C)C)ccn1)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000176901514 1428516516 /nfs/dbraw/zinc/51/65/16/1428516516.db2.gz JXLDTQXTSPGWOO-GOSISDBHSA-N 2 1 380.536 3.425 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@H](O)COCc2cccs2)CC1 ZINC000103228023 1410838632 /nfs/dbraw/zinc/83/86/32/1410838632.db2.gz GRJLDEHOSMBLAF-NRFANRHFSA-N 2 1 388.577 3.470 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCCNC(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1 ZINC000103247307 1410840567 /nfs/dbraw/zinc/84/05/67/1410840567.db2.gz MPKMAWNDAGSNQP-UNMCSNQZSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCNC(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000103247307 1410840568 /nfs/dbraw/zinc/84/05/68/1410840568.db2.gz MPKMAWNDAGSNQP-UNMCSNQZSA-N 2 1 386.584 3.115 20 0 GGADMP C[C@H]1CCCC[NH+]1CCCNC(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000103247307 1410840569 /nfs/dbraw/zinc/84/05/69/1410840569.db2.gz MPKMAWNDAGSNQP-UNMCSNQZSA-N 2 1 386.584 3.115 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000103268275 1410842030 /nfs/dbraw/zinc/84/20/30/1410842030.db2.gz IZPKHEWTEVHCCO-HSZRJFAPSA-N 2 1 394.563 3.112 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NCCC3CC[NH+](C)CC3)cc2)C1 ZINC000103303351 1410844586 /nfs/dbraw/zinc/84/45/86/1410844586.db2.gz BTIDFWBSHDPNCK-LJQANCHMSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(NCCC[NH2+]C1CCCCC1)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000103319207 1410846829 /nfs/dbraw/zinc/84/68/29/1410846829.db2.gz SOWQNRXOKUVBBB-NRFANRHFSA-N 2 1 386.584 3.163 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000103319450 1410846850 /nfs/dbraw/zinc/84/68/50/1410846850.db2.gz NFPUEYOEIKSDDZ-OAQYLSRUSA-N 2 1 386.584 3.067 20 0 GGADMP C[NH+]1CCC(CCNC(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)CC1 ZINC000103321047 1410846987 /nfs/dbraw/zinc/84/69/87/1410846987.db2.gz NMECRUJVZKBDCB-UHFFFAOYSA-N 2 1 386.584 3.068 20 0 GGADMP CC[NH+](Cc1cnn(C)c1)Cc1cccc(C[N@@H+](CC)Cc2cnn(C)c2)c1 ZINC000103474250 1410861552 /nfs/dbraw/zinc/86/15/52/1410861552.db2.gz QRWSOCHWNOXAQD-UHFFFAOYSA-N 2 1 380.540 3.198 20 0 GGADMP Cc1cc2ncn(C[NH+]3CCN(CC[N@@H+](C)Cc4ccccc4)CC3)c2cc1C ZINC000104653297 1410919881 /nfs/dbraw/zinc/91/98/81/1410919881.db2.gz LLGDHNKSARRVQF-UHFFFAOYSA-N 2 1 391.563 3.360 20 0 GGADMP Cc1cc2ncn(C[NH+]3CCN(CC[N@H+](C)Cc4ccccc4)CC3)c2cc1C ZINC000104653297 1410919900 /nfs/dbraw/zinc/91/99/00/1410919900.db2.gz LLGDHNKSARRVQF-UHFFFAOYSA-N 2 1 391.563 3.360 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@@H]1CCC[NH+](Cc2cccs2)C1)C1CCCC1 ZINC000104793633 1410964817 /nfs/dbraw/zinc/96/48/17/1410964817.db2.gz XTZRTTIRCWCEBI-KRWDZBQOSA-N 2 1 378.586 3.134 20 0 GGADMP C[NH+](CCNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)C1CCCC1 ZINC000104793633 1410964823 /nfs/dbraw/zinc/96/48/23/1410964823.db2.gz XTZRTTIRCWCEBI-KRWDZBQOSA-N 2 1 378.586 3.134 20 0 GGADMP C[NH+](CCNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCCC1 ZINC000104793633 1410964827 /nfs/dbraw/zinc/96/48/27/1410964827.db2.gz XTZRTTIRCWCEBI-KRWDZBQOSA-N 2 1 378.586 3.134 20 0 GGADMP COc1ccc([C@@H](CNC(=O)NC[C@@H](C)[N@@H+](C)C2CC2)[NH+]2CCCCC2)cc1 ZINC000105077936 1411025234 /nfs/dbraw/zinc/02/52/34/1411025234.db2.gz OFLKRIZZMJMHRE-DYESRHJHSA-N 2 1 388.556 3.004 20 0 GGADMP CC[N@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000105093648 1411027852 /nfs/dbraw/zinc/02/78/52/1411027852.db2.gz MCLARAFISPIOII-GOSISDBHSA-N 2 1 392.975 3.336 20 0 GGADMP CC[N@H+]1CCC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000105112852 1411030057 /nfs/dbraw/zinc/03/00/57/1411030057.db2.gz OMVYAOPWWFEYGL-QFIPXVFZSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(NCCCCNc1ccccn1)NCCC[N@H+]1CCc2ccccc2C1 ZINC000105128699 1411032843 /nfs/dbraw/zinc/03/28/43/1411032843.db2.gz XVGWWSNJZOZLAN-UHFFFAOYSA-N 2 1 381.524 3.021 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@H]1C[NH+]1CCCCC1)[N@@H+]1CCc2sccc2C1 ZINC000105150398 1411035566 /nfs/dbraw/zinc/03/55/66/1411035566.db2.gz UYXCDRFBKQZAKG-HKUYNNGSSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H](CNC(=O)N1CCC[C@H]1C[NH+]1CCCCC1)[N@H+]1CCc2sccc2C1 ZINC000105150398 1411035575 /nfs/dbraw/zinc/03/55/75/1411035575.db2.gz UYXCDRFBKQZAKG-HKUYNNGSSA-N 2 1 390.597 3.155 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000105208210 1411041933 /nfs/dbraw/zinc/04/19/33/1411041933.db2.gz WEXVPRSSQZWECB-IBGZPJMESA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCCC1 ZINC000105209374 1411042098 /nfs/dbraw/zinc/04/20/98/1411042098.db2.gz VNJQLGRGZMYRIK-QUCCMNQESA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000105209294 1411042306 /nfs/dbraw/zinc/04/23/06/1411042306.db2.gz WJJNPNLCOPUBJS-OALUTQOASA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000105209294 1411042313 /nfs/dbraw/zinc/04/23/13/1411042313.db2.gz WJJNPNLCOPUBJS-OALUTQOASA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000105209294 1411042324 /nfs/dbraw/zinc/04/23/24/1411042324.db2.gz WJJNPNLCOPUBJS-OALUTQOASA-N 2 1 392.613 3.380 20 0 GGADMP CC(C)[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[NH+]1CCCC1 ZINC000105209366 1411042406 /nfs/dbraw/zinc/04/24/06/1411042406.db2.gz VNJQLGRGZMYRIK-ICSRJNTNSA-N 2 1 392.613 3.380 20 0 GGADMP Cc1ccc([C@@H](CNC(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)[NH+]2CCCC2)o1 ZINC000105222174 1411044141 /nfs/dbraw/zinc/04/41/41/1411044141.db2.gz INGFAFUYOPSFIR-RTBURBONSA-N 2 1 376.545 3.145 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)[NH+](C)C1CC1 ZINC000105268695 1411047713 /nfs/dbraw/zinc/04/77/13/1411047713.db2.gz SEEJLXDGYLPWAY-MRXNPFEDSA-N 2 1 378.948 3.040 20 0 GGADMP C[C@H](CNC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)[NH+](C)C1CC1 ZINC000105268695 1411047723 /nfs/dbraw/zinc/04/77/23/1411047723.db2.gz SEEJLXDGYLPWAY-MRXNPFEDSA-N 2 1 378.948 3.040 20 0 GGADMP C[C@H](CNC(=O)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1)[N@H+](C)C1CC1 ZINC000105268695 1411047731 /nfs/dbraw/zinc/04/77/31/1411047731.db2.gz SEEJLXDGYLPWAY-MRXNPFEDSA-N 2 1 378.948 3.040 20 0 GGADMP C[C@H](CNC(=O)N1CCC[NH+](Cc2ccc(Cl)cc2)CC1)[N@@H+](C)C1CC1 ZINC000105268695 1411047738 /nfs/dbraw/zinc/04/77/38/1411047738.db2.gz SEEJLXDGYLPWAY-MRXNPFEDSA-N 2 1 378.948 3.040 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2F)C1 ZINC000105273550 1411048656 /nfs/dbraw/zinc/04/86/56/1411048656.db2.gz SGSXOUCHURSEPJ-KRWDZBQOSA-N 2 1 396.526 3.158 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)C1 ZINC000105273540 1411049034 /nfs/dbraw/zinc/04/90/34/1411049034.db2.gz RKEZGPVOZBSJII-GOSISDBHSA-N 2 1 396.526 3.158 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)C1 ZINC000105273531 1411049464 /nfs/dbraw/zinc/04/94/64/1411049464.db2.gz QHGQBDUBOPDONS-LJQANCHMSA-N 2 1 378.536 3.019 20 0 GGADMP C[N@H+](CCN1CC[NH+](C[C@H](O)c2ccc(Cl)cc2)CC1)Cc1ccccc1 ZINC000105414223 1411064653 /nfs/dbraw/zinc/06/46/53/1411064653.db2.gz NYOGVYAHWWCPSM-QFIPXVFZSA-N 2 1 387.955 3.123 20 0 GGADMP C[N@@H+](CCN1CC[NH+](C[C@H](O)c2ccc(Cl)cc2)CC1)Cc1ccccc1 ZINC000105414223 1411064663 /nfs/dbraw/zinc/06/46/63/1411064663.db2.gz NYOGVYAHWWCPSM-QFIPXVFZSA-N 2 1 387.955 3.123 20 0 GGADMP Cc1cc(C[NH2+]Cc2cccc(NC(=O)CC[NH+]3CCOCC3)c2)ccc1F ZINC000105421128 1411065004 /nfs/dbraw/zinc/06/50/04/1411065004.db2.gz LAKGJFYCGCEFHD-UHFFFAOYSA-N 2 1 385.483 3.085 20 0 GGADMP COc1ccc(C[NH2+]CCCN2CCC[N@@H+](C)CC2)cc1OCc1ccccc1 ZINC000105477154 1411070682 /nfs/dbraw/zinc/07/06/82/1411070682.db2.gz YONAWCATLAPDPG-UHFFFAOYSA-N 2 1 397.563 3.391 20 0 GGADMP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000106518950 1411228956 /nfs/dbraw/zinc/22/89/56/1411228956.db2.gz NHRPCOJZAOJGLB-FUHWJXTLSA-N 2 1 376.570 3.201 20 0 GGADMP CCC[NH+]1CCC(NC(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000107327739 1411360780 /nfs/dbraw/zinc/36/07/80/1411360780.db2.gz VVYJDRROUSJRCR-UHFFFAOYSA-N 2 1 386.584 3.414 20 0 GGADMP CCC[NH+]1CCC(NC(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)CC1 ZINC000107329376 1411361054 /nfs/dbraw/zinc/36/10/54/1411361054.db2.gz HMQNZWXEEDWAGP-UHFFFAOYSA-N 2 1 386.584 3.211 20 0 GGADMP CSc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000108420736 1411496725 /nfs/dbraw/zinc/49/67/25/1411496725.db2.gz CGJZFSICNUACQV-FQEVSTJZSA-N 2 1 383.561 3.396 20 0 GGADMP O=C([C@@H]1CCC[N@H+]1Cc1ccccc1)N1CCC[NH+](Cc2ccccc2)CC1 ZINC000108710231 1411581135 /nfs/dbraw/zinc/58/11/35/1411581135.db2.gz WWQVSSHAQVAUHJ-QHCPKHFHSA-N 2 1 377.532 3.386 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccccc1)N1CCC[N@H+](Cc2ccccc2)CC1 ZINC000108710231 1411581138 /nfs/dbraw/zinc/58/11/38/1411581138.db2.gz WWQVSSHAQVAUHJ-QHCPKHFHSA-N 2 1 377.532 3.386 20 0 GGADMP O=C([C@@H]1CCC[NH+]1Cc1ccccc1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000108710231 1411581147 /nfs/dbraw/zinc/58/11/47/1411581147.db2.gz WWQVSSHAQVAUHJ-QHCPKHFHSA-N 2 1 377.532 3.386 20 0 GGADMP CCC[N@H+]1CCC[C@@H]1C(=O)Nc1cccc(NC(=O)CC[NH+]2CCCCC2)c1 ZINC000108996155 1411657563 /nfs/dbraw/zinc/65/75/63/1411657563.db2.gz MCCHYGSQIDMQNW-HXUWFJFHSA-N 2 1 386.540 3.314 20 0 GGADMP CN1CC[NH+](Cc2ccc(NC(=O)c3cccc(C[NH+]4CCCC4)c3)cc2)CC1 ZINC000109127794 1411690293 /nfs/dbraw/zinc/69/02/93/1411690293.db2.gz WGBGOZWVIZXZNA-UHFFFAOYSA-N 2 1 392.547 3.282 20 0 GGADMP C[C@H](CNC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)[NH+]1CCC(C)CC1 ZINC000109301417 1411736395 /nfs/dbraw/zinc/73/63/95/1411736395.db2.gz QXWPHKLWCUZCEH-VAMGGRTRSA-N 2 1 387.568 3.146 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)c1ccccc1 ZINC000109339910 1411744535 /nfs/dbraw/zinc/74/45/35/1411744535.db2.gz MUOVOAQYHMHEFD-RBBKRZOGSA-N 2 1 383.511 3.457 20 0 GGADMP C[N@@H+](CCNC(=O)[C@H]1CCC[NH+](Cc2cccc(F)c2)C1)Cc1ccccc1 ZINC000109343991 1411745195 /nfs/dbraw/zinc/74/51/95/1411745195.db2.gz CQJDYNJHBOQNAT-NRFANRHFSA-N 2 1 383.511 3.286 20 0 GGADMP C[NH+](CCNC(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)Cc1ccccc1 ZINC000109343991 1411745202 /nfs/dbraw/zinc/74/52/02/1411745202.db2.gz CQJDYNJHBOQNAT-NRFANRHFSA-N 2 1 383.511 3.286 20 0 GGADMP C[NH+](CCNC(=O)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)Cc1ccccc1 ZINC000109343991 1411745210 /nfs/dbraw/zinc/74/52/10/1411745210.db2.gz CQJDYNJHBOQNAT-NRFANRHFSA-N 2 1 383.511 3.286 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1C(=O)NC[C@@H](c1cccc(OC)c1)[NH+](CC)CC ZINC000109444043 1411764939 /nfs/dbraw/zinc/76/49/39/1411764939.db2.gz XTEZLAOGMPMVBA-RTWAWAEBSA-N 2 1 375.557 3.459 20 0 GGADMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2ccc(C[NH+]3CCSCC3)cc2)C1 ZINC000109677993 1411803106 /nfs/dbraw/zinc/80/31/06/1411803106.db2.gz CWIQQSGTZGXXCW-FQEVSTJZSA-N 2 1 398.576 3.472 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2ccc(C[NH+]3CCSCC3)cc2)C1 ZINC000109677990 1411803144 /nfs/dbraw/zinc/80/31/44/1411803144.db2.gz CWIQQSGTZGXXCW-HXUWFJFHSA-N 2 1 398.576 3.472 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)[C@@H]2CCCC[N@@H+]2Cc2cccnc2)C1 ZINC000109951001 1411820632 /nfs/dbraw/zinc/82/06/32/1411820632.db2.gz LCWWWXJRTQNCPU-SJBKTWHCSA-N 2 1 386.584 3.310 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)[C@@H]2CCCC[N@H+]2Cc2cccnc2)C1 ZINC000109951001 1411820633 /nfs/dbraw/zinc/82/06/33/1411820633.db2.gz LCWWWXJRTQNCPU-SJBKTWHCSA-N 2 1 386.584 3.310 20 0 GGADMP C[C@H](c1ccc(NC(=O)NC[C@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1)[NH+]1CCOCC1 ZINC000110072923 1411829846 /nfs/dbraw/zinc/82/98/46/1411829846.db2.gz DYDJPPNXKZMVMM-CEXWTWQISA-N 2 1 388.556 3.322 20 0 GGADMP C[C@H](c1ccc(NC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1)[NH+]1CCOCC1 ZINC000110072923 1411829848 /nfs/dbraw/zinc/82/98/48/1411829848.db2.gz DYDJPPNXKZMVMM-CEXWTWQISA-N 2 1 388.556 3.322 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](CC(C)C)[NH+]2CCOCC2)cc1)C(C)C ZINC000110171739 1411835430 /nfs/dbraw/zinc/83/54/30/1411835430.db2.gz GDXFWHRLKKJFPY-JOCHJYFZSA-N 2 1 389.584 3.394 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC[C@@H](CC(C)C)[NH+]2CCOCC2)cc1)C(C)C ZINC000110171739 1411835431 /nfs/dbraw/zinc/83/54/31/1411835431.db2.gz GDXFWHRLKKJFPY-JOCHJYFZSA-N 2 1 389.584 3.394 20 0 GGADMP C[C@H](C(=O)N[C@@H]1CCC[C@H](C)[C@H]1C)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110428610 1411850327 /nfs/dbraw/zinc/85/03/27/1411850327.db2.gz PGTWCXVSYGWYOI-RUTNFUQLSA-N 2 1 393.616 3.137 20 0 GGADMP Cc1ccc(-c2noc(C[NH+]3CCC(C[NH+]4C[C@H](C)O[C@@H](C)C4)CC3)n2)cc1 ZINC000110429284 1411850388 /nfs/dbraw/zinc/85/03/88/1411850388.db2.gz FVYQIFMUDZAMBR-ROUUACIJSA-N 2 1 384.524 3.366 20 0 GGADMP Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000110427918 1411850447 /nfs/dbraw/zinc/85/04/47/1411850447.db2.gz OBVDZTFTIBZNRM-HSALFYBXSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000110427918 1411850448 /nfs/dbraw/zinc/85/04/48/1411850448.db2.gz OBVDZTFTIBZNRM-HSALFYBXSA-N 2 1 387.568 3.452 20 0 GGADMP CCc1cccc(C)c1NC(=O)C[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000110432613 1411850757 /nfs/dbraw/zinc/85/07/57/1411850757.db2.gz CGXCOSUWFDQUIL-OALUTQOASA-N 2 1 387.568 3.317 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110552483 1411857016 /nfs/dbraw/zinc/85/70/16/1411857016.db2.gz LXWNZJDXXUFUIT-ZACQAIPSSA-N 2 1 393.959 3.488 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)[C@@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000110639376 1411861906 /nfs/dbraw/zinc/86/19/06/1411861906.db2.gz UWIZANULHBRBFC-RTBURBONSA-N 2 1 382.552 3.287 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)[C@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000110639381 1411861920 /nfs/dbraw/zinc/86/19/20/1411861920.db2.gz UWIZANULHBRBFC-MOPGFXCFSA-N 2 1 382.552 3.287 20 0 GGADMP Cc1ccccc1CCNC(=O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000110908500 1411876593 /nfs/dbraw/zinc/87/65/93/1411876593.db2.gz CZDJGDQLUOBGFW-UHFFFAOYSA-N 2 1 393.575 3.498 20 0 GGADMP CC[NH+](CC)[C@H](C(=O)NC[C@H](c1ccccc1OC)[NH+](C)C)c1ccccc1 ZINC000111034648 1411883357 /nfs/dbraw/zinc/88/33/57/1411883357.db2.gz PHFCWWSUPNLWRN-IRLDBZIGSA-N 2 1 383.536 3.497 20 0 GGADMP O=C(NCCC[NH+]1CCCCCC1)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000111067402 1411885712 /nfs/dbraw/zinc/88/57/12/1411885712.db2.gz RMBCPAHBAJZFBP-HXUWFJFHSA-N 2 1 375.532 3.420 20 0 GGADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000111386836 1411939011 /nfs/dbraw/zinc/93/90/11/1411939011.db2.gz LPETXIZZVHSGQJ-GOSISDBHSA-N 2 1 396.457 3.218 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3ccc(-n4cncn4)cc3)CC2)cs1 ZINC000111397388 1411939999 /nfs/dbraw/zinc/93/99/99/1411939999.db2.gz KBVKJUHUFIHNTG-UHFFFAOYSA-N 2 1 396.564 3.288 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3cccc4c3OCCCO4)CC2)oc1C ZINC000111412308 1411945842 /nfs/dbraw/zinc/94/58/42/1411945842.db2.gz XIGPKWATBSXRQX-UHFFFAOYSA-N 2 1 385.508 3.455 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]Cc3c[nH]nc3-c3cccnc3)CC2)oc1C ZINC000111412516 1411946740 /nfs/dbraw/zinc/94/67/40/1411946740.db2.gz MGANCOIYRWZUMI-UHFFFAOYSA-N 2 1 380.496 3.078 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+](C)Cc1ccccc1 ZINC000111418877 1411949158 /nfs/dbraw/zinc/94/91/58/1411949158.db2.gz SUROXHHWLWZHEF-HXUWFJFHSA-N 2 1 394.563 3.471 20 0 GGADMP C[C@@H](CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)[N@@H+](C)Cc1ccccc1 ZINC000111433729 1411952444 /nfs/dbraw/zinc/95/24/44/1411952444.db2.gz TUJRDFNYEQWINL-ICSRJNTNSA-N 2 1 384.524 3.236 20 0 GGADMP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)C1 ZINC000111466376 1411970411 /nfs/dbraw/zinc/97/04/11/1411970411.db2.gz NNACKKYTQQQPPA-GOSISDBHSA-N 2 1 398.555 3.276 20 0 GGADMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)C1 ZINC000111466376 1411970427 /nfs/dbraw/zinc/97/04/27/1411970427.db2.gz NNACKKYTQQQPPA-GOSISDBHSA-N 2 1 398.555 3.276 20 0 GGADMP CC[N@H+]1CCCC[C@H]1CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000111482167 1411977439 /nfs/dbraw/zinc/97/74/39/1411977439.db2.gz GCPHQVODBKHFAV-SFHVURJKSA-N 2 1 378.586 3.134 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)[C@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC000111562564 1411992372 /nfs/dbraw/zinc/99/23/72/1411992372.db2.gz VMKABGIQLMKHGL-HSZRJFAPSA-N 2 1 392.547 3.348 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)[C@H]1CCCC[N@H+]1Cc1cccnc1 ZINC000111562564 1411992381 /nfs/dbraw/zinc/99/23/81/1411992381.db2.gz VMKABGIQLMKHGL-HSZRJFAPSA-N 2 1 392.547 3.348 20 0 GGADMP C[C@H](C(=O)NCc1ccc(OCCC[NH+](C)C)cc1)[N@@H+]1CCc2ccccc2C1 ZINC000111607502 1412000663 /nfs/dbraw/zinc/00/06/63/1412000663.db2.gz SBUWNHQVBNMQLM-LJQANCHMSA-N 2 1 395.547 3.080 20 0 GGADMP C[C@H](C(=O)NCc1ccc(OCCC[NH+](C)C)cc1)[N@H+]1CCc2ccccc2C1 ZINC000111607502 1412000670 /nfs/dbraw/zinc/00/06/70/1412000670.db2.gz SBUWNHQVBNMQLM-LJQANCHMSA-N 2 1 395.547 3.080 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@H](C)[NH+]3[C@@H](C)CC[C@@H]3C)CC2)cs1 ZINC000111646520 1412007719 /nfs/dbraw/zinc/00/77/19/1412007719.db2.gz PAOCPDIQIDRNLQ-ULQDDVLXSA-N 2 1 392.613 3.295 20 0 GGADMP CC(C)[NH2+]C1CCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)CC1 ZINC000111742306 1412021955 /nfs/dbraw/zinc/02/19/55/1412021955.db2.gz COIOYYPFMPCVBS-UHFFFAOYSA-N 2 1 376.570 3.230 20 0 GGADMP C[C@@H](CCc1ccccc1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000112532801 1412164279 /nfs/dbraw/zinc/16/42/79/1412164279.db2.gz KVBHZRFMVVJSIK-FQEVSTJZSA-N 2 1 395.547 3.458 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](CCC(=O)Nc2ccc(Cl)cc2)CC1 ZINC000112649025 1412186667 /nfs/dbraw/zinc/18/66/67/1412186667.db2.gz SHLWERSOIKXYKF-HDICACEKSA-N 2 1 392.975 3.159 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCCCC1)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000112743979 1412208874 /nfs/dbraw/zinc/20/88/74/1412208874.db2.gz NDGQXAXBYGPZCT-IBGZPJMESA-N 2 1 384.568 3.346 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)[C@]2(C(F)(F)F)CC[NH+](Cc3ccccc3)C2)C[N@H+]1C1CC1 ZINC000177215625 1428636376 /nfs/dbraw/zinc/63/63/76/1428636376.db2.gz HNEPDHXMJHKCQS-SYNHAJSKSA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)[C@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)C[NH+]1C1CC1 ZINC000177215625 1428636383 /nfs/dbraw/zinc/63/63/83/1428636383.db2.gz HNEPDHXMJHKCQS-SYNHAJSKSA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C[NH+]1C1CC1 ZINC000177215625 1428636389 /nfs/dbraw/zinc/63/63/89/1428636389.db2.gz HNEPDHXMJHKCQS-SYNHAJSKSA-N 2 1 395.469 3.182 20 0 GGADMP C[C@@H]([NH2+]C1(CNC(=O)C[N@H+](C)Cc2ccccc2)CCOCC1)c1ccccc1 ZINC000113236117 1412280760 /nfs/dbraw/zinc/28/07/60/1412280760.db2.gz NKXFKHHMBASXOP-HXUWFJFHSA-N 2 1 395.547 3.135 20 0 GGADMP C[C@@H]([NH2+]C1(CNC(=O)C[N@@H+](C)Cc2ccccc2)CCOCC1)c1ccccc1 ZINC000113236117 1412280770 /nfs/dbraw/zinc/28/07/70/1412280770.db2.gz NKXFKHHMBASXOP-HXUWFJFHSA-N 2 1 395.547 3.135 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]CCCN3CCC[N@@H+](C)CC3)cs2)cc1 ZINC000113336931 1412294229 /nfs/dbraw/zinc/29/42/29/1412294229.db2.gz YTIJWGVDUBWSSR-UHFFFAOYSA-N 2 1 388.581 3.148 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]CCCN3CCC[N@H+](C)CC3)cs2)cc1 ZINC000113336931 1412294232 /nfs/dbraw/zinc/29/42/32/1412294232.db2.gz YTIJWGVDUBWSSR-UHFFFAOYSA-N 2 1 388.581 3.148 20 0 GGADMP Cc1ccc(OCc2nc(C[NH2+]C[C@H](C)CN3CC[NH+](C)CC3)cs2)cc1 ZINC000113335720 1412294292 /nfs/dbraw/zinc/29/42/92/1412294292.db2.gz XKUXEZYESGJNGQ-SFHVURJKSA-N 2 1 388.581 3.004 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc(N2CC[NH+](C)CC2)cc1C ZINC000113364833 1412299038 /nfs/dbraw/zinc/29/90/38/1412299038.db2.gz GFORLYKMEKETON-LJQANCHMSA-N 2 1 387.572 3.133 20 0 GGADMP Cc1ccccc1[C@H](OC[C@@H](O)C[N@@H+]1CC[C@H](C[NH+](C)C)C1)c1ccccc1 ZINC000113514811 1412311584 /nfs/dbraw/zinc/31/15/84/1412311584.db2.gz HLPNEIIPIRRSJZ-JCTONOIOSA-N 2 1 382.548 3.345 20 0 GGADMP CN(C(=O)NC[C@H](c1ccco1)[NH+](C)C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000113578610 1412317696 /nfs/dbraw/zinc/31/76/96/1412317696.db2.gz PJXKMOKYXBHHAC-HXUWFJFHSA-N 2 1 384.524 3.188 20 0 GGADMP C[C@@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000113591529 1412318972 /nfs/dbraw/zinc/31/89/72/1412318972.db2.gz BGWDQQGIQUBZKQ-UXHICEINSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H]([NH2+]C1(CNC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CCCC1)c1ccccc1 ZINC000113595024 1412319738 /nfs/dbraw/zinc/31/97/38/1412319738.db2.gz DADKRAQNBFGOGV-OALUTQOASA-N 2 1 384.568 3.434 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000113602233 1412320801 /nfs/dbraw/zinc/32/08/01/1412320801.db2.gz RRJAXXSVUIZNAD-WOJBJXKFSA-N 2 1 386.584 3.413 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)[nH+]c1 ZINC000114020514 1412369930 /nfs/dbraw/zinc/36/99/30/1412369930.db2.gz WRLWKDQJNVAKRJ-PMACEKPBSA-N 2 1 387.572 3.488 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)[nH+]c1 ZINC000114020514 1412369935 /nfs/dbraw/zinc/36/99/35/1412369935.db2.gz WRLWKDQJNVAKRJ-PMACEKPBSA-N 2 1 387.572 3.488 20 0 GGADMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)NC(=O)Nc2cccc(C)c2C)CC1 ZINC000114197038 1412393124 /nfs/dbraw/zinc/39/31/24/1412393124.db2.gz YXLOGGYJJGISGV-UHFFFAOYSA-N 2 1 388.556 3.395 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+](C)CCCOc2cccc(Cl)c2)CC1 ZINC000114455489 1412436389 /nfs/dbraw/zinc/43/63/89/1412436389.db2.gz RGHAYQPIUVZHFA-UHFFFAOYSA-N 2 1 381.948 3.030 20 0 GGADMP Cc1ccc(NC(=O)COc2ccc(CC[NH2+]C3CC[NH+](C)CC3)cc2)cc1 ZINC000177261132 1428659368 /nfs/dbraw/zinc/65/93/68/1428659368.db2.gz ORTFQOKYLCEXPU-UHFFFAOYSA-N 2 1 381.520 3.239 20 0 GGADMP C[C@@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000177269321 1428663747 /nfs/dbraw/zinc/66/37/47/1428663747.db2.gz FOBRIUKVHAQDMI-QGZVFWFLSA-N 2 1 393.597 3.242 20 0 GGADMP CC1CC[NH+](Cc2ccc(CNC(=O)N(C)C[C@@H]3CCC[N@@H+](C)C3)cc2)CC1 ZINC000115794826 1412790374 /nfs/dbraw/zinc/79/03/74/1412790374.db2.gz YDKBHNXBQPZZHH-JOCHJYFZSA-N 2 1 386.584 3.402 20 0 GGADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1 ZINC000177298194 1428677463 /nfs/dbraw/zinc/67/74/63/1428677463.db2.gz OEAGTHIJXJAXLN-KRWDZBQOSA-N 2 1 389.565 3.239 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000177306497 1428680847 /nfs/dbraw/zinc/68/08/47/1428680847.db2.gz MVHRNNYJNMDOED-OAQYLSRUSA-N 2 1 381.520 3.286 20 0 GGADMP Cc1ccc(C[NH+](C)C)cc1NC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000177306497 1428680863 /nfs/dbraw/zinc/68/08/63/1428680863.db2.gz MVHRNNYJNMDOED-OAQYLSRUSA-N 2 1 381.520 3.286 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc1F ZINC000116424465 1412858402 /nfs/dbraw/zinc/85/84/02/1412858402.db2.gz NOSNISPOKGUKOB-IBGZPJMESA-N 2 1 389.519 3.485 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000116540947 1412874585 /nfs/dbraw/zinc/87/45/85/1412874585.db2.gz SHJWLEYXBKTLNV-MSOLQXFVSA-N 2 1 383.540 3.352 20 0 GGADMP CC(C)[NH+](CCNC(=O)N1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000177345136 1428700400 /nfs/dbraw/zinc/70/04/00/1428700400.db2.gz IPARYFNDUJLLGC-BGYRXZFFSA-N 2 1 396.620 3.026 20 0 GGADMP C[C@@H](CNC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)[NH+]1CCC(C)CC1 ZINC000118029499 1413098689 /nfs/dbraw/zinc/09/86/89/1413098689.db2.gz GYSDQKNHVGYRFI-OALUTQOASA-N 2 1 388.556 3.322 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)CC1 ZINC000118421218 1413159452 /nfs/dbraw/zinc/15/94/52/1413159452.db2.gz ZCLJVDAEPCSJQS-UWJYYQICSA-N 2 1 375.582 3.154 20 0 GGADMP CC(C)[NH+]1CCC(NC(=O)C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)CC1 ZINC000118421218 1413159469 /nfs/dbraw/zinc/15/94/69/1413159469.db2.gz ZCLJVDAEPCSJQS-UWJYYQICSA-N 2 1 375.582 3.154 20 0 GGADMP COc1ccc([C@@H](CNC(=O)CCn2cc[nH+]c2C(C)C)[NH+]2CCCC2)cc1 ZINC000118754380 1413215684 /nfs/dbraw/zinc/21/56/84/1413215684.db2.gz FBFWLNDFJCQQQC-HXUWFJFHSA-N 2 1 384.524 3.359 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@H+](C)C[C@H]3CCC[NH+](C)C3)cc(=O)oc2c1 ZINC000118841447 1413242545 /nfs/dbraw/zinc/24/25/45/1413242545.db2.gz SKMKXFVEFGJFJT-HNNXBMFYSA-N 2 1 387.480 3.135 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[N@@H+](C)C[C@H]3CCC[NH+](C)C3)cc(=O)oc2c1 ZINC000118841447 1413242552 /nfs/dbraw/zinc/24/25/52/1413242552.db2.gz SKMKXFVEFGJFJT-HNNXBMFYSA-N 2 1 387.480 3.135 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[NH+](C)C[C@H]3CCC[N@H+](C)C3)cc(=O)oc2c1 ZINC000118841447 1413242561 /nfs/dbraw/zinc/24/25/61/1413242561.db2.gz SKMKXFVEFGJFJT-HNNXBMFYSA-N 2 1 387.480 3.135 20 0 GGADMP CCOC(=O)Nc1ccc2c(C[NH+](C)C[C@H]3CCC[N@@H+](C)C3)cc(=O)oc2c1 ZINC000118841447 1413242568 /nfs/dbraw/zinc/24/25/68/1413242568.db2.gz SKMKXFVEFGJFJT-HNNXBMFYSA-N 2 1 387.480 3.135 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000118868226 1413255093 /nfs/dbraw/zinc/25/50/93/1413255093.db2.gz MUCDGZWCFMWEQU-LJQANCHMSA-N 2 1 397.567 3.480 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000118868227 1413255811 /nfs/dbraw/zinc/25/58/11/1413255811.db2.gz MUCDGZWCFMWEQU-IBGZPJMESA-N 2 1 397.567 3.480 20 0 GGADMP Cc1c(C(=O)Nc2ccc(OCC[NH+](C)C)c(Cl)c2)cnn1-c1cc[nH+]cc1 ZINC000118947374 1413269614 /nfs/dbraw/zinc/26/96/14/1413269614.db2.gz DFWJLAZFRCBRGZ-UHFFFAOYSA-N 2 1 399.882 3.422 20 0 GGADMP Cc1c(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)cnn1-c1cc[nH+]cc1 ZINC000119002474 1413300135 /nfs/dbraw/zinc/30/01/35/1413300135.db2.gz ZZLZNKGZIROBGU-NRFANRHFSA-N 2 1 375.476 3.143 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC1 ZINC000119050201 1413316380 /nfs/dbraw/zinc/31/63/80/1413316380.db2.gz FODIKUCJCJSHEE-QUCCMNQESA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000119050201 1413316389 /nfs/dbraw/zinc/31/63/89/1413316389.db2.gz FODIKUCJCJSHEE-QUCCMNQESA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC1 ZINC000119050201 1413316397 /nfs/dbraw/zinc/31/63/97/1413316397.db2.gz FODIKUCJCJSHEE-QUCCMNQESA-N 2 1 376.589 3.157 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)CC1 ZINC000119050310 1413317368 /nfs/dbraw/zinc/31/73/68/1413317368.db2.gz FODIKUCJCJSHEE-ICSRJNTNSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@H]1CCCC[NH+]1CCC1CCN(C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000119050310 1413317382 /nfs/dbraw/zinc/31/73/82/1413317382.db2.gz FODIKUCJCJSHEE-ICSRJNTNSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@H]1CCCC[NH+]1CCC1CCN(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)CC1 ZINC000119050310 1413317390 /nfs/dbraw/zinc/31/73/90/1413317390.db2.gz FODIKUCJCJSHEE-ICSRJNTNSA-N 2 1 376.589 3.157 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cc(Cl)ccc3F)c2)C1 ZINC000119145758 1413354694 /nfs/dbraw/zinc/35/46/94/1413354694.db2.gz DUTXIUICQUTJPC-QGZVFWFLSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(Cl)ccc3F)c2)C1 ZINC000119145758 1413354703 /nfs/dbraw/zinc/35/47/03/1413354703.db2.gz DUTXIUICQUTJPC-QGZVFWFLSA-N 2 1 389.902 3.466 20 0 GGADMP CCOc1cc(C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc(Br)c1OC ZINC000119412582 1413438695 /nfs/dbraw/zinc/43/86/95/1413438695.db2.gz SCMRVJMLUWFWOZ-CYBMUJFWSA-N 2 1 383.330 3.430 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H](C)C(C)(C)C[NH+](C)C)cc1F ZINC000119415358 1413439703 /nfs/dbraw/zinc/43/97/03/1413439703.db2.gz YDYIPDGUCROORR-CQSZACIVSA-N 2 1 375.492 3.095 20 0 GGADMP O=C(CCc1ccccc1)N1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000119462604 1413456344 /nfs/dbraw/zinc/45/63/44/1413456344.db2.gz VAJPBIRVTINZIP-XMMPIXPASA-N 2 1 391.559 3.474 20 0 GGADMP Cc1nn(Cc2ccccc2)c(Cl)c1C[NH2+]CCCCN1CC[NH+](C)CC1 ZINC000119631155 1413509238 /nfs/dbraw/zinc/50/92/38/1413509238.db2.gz KFADQBABFUVPPE-UHFFFAOYSA-N 2 1 389.975 3.010 20 0 GGADMP COC(=O)c1ccc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000119665712 1413522797 /nfs/dbraw/zinc/52/27/97/1413522797.db2.gz MVPKCFUNKJDGEU-IYBDPMFKSA-N 2 1 380.554 3.246 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NC3CC[NH+](C4CCCCC4)CC3)CC2)c1 ZINC000119853138 1413594225 /nfs/dbraw/zinc/59/42/25/1413594225.db2.gz AEYLVPHDNNNKMM-UHFFFAOYSA-N 2 1 385.556 3.019 20 0 GGADMP Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(C[NH+]4CCOCC4)CC3)o2)cc1C ZINC000119856914 1413595725 /nfs/dbraw/zinc/59/57/25/1413595725.db2.gz CGTVTSPQJPAKCX-GOSISDBHSA-N 2 1 384.524 3.459 20 0 GGADMP Cc1[nH+]c(N2CCOCC2)ccc1NCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000119954608 1413630884 /nfs/dbraw/zinc/63/08/84/1413630884.db2.gz WJTLLRBXLBFRBW-UHFFFAOYSA-N 2 1 396.535 3.313 20 0 GGADMP COc1cccc([C@@H](CNC(=O)N(C)CCCn2cc[nH+]c2C)[NH+]2CCCC2)c1 ZINC000120107384 1413690664 /nfs/dbraw/zinc/69/06/64/1413690664.db2.gz GBNHHBVNDWRHPS-OAQYLSRUSA-N 2 1 399.539 3.069 20 0 GGADMP CC1CC[NH+](C2CCC(NC(=O)NC[C@@H](c3ccco3)[NH+](C)C)CC2)CC1 ZINC000120157705 1413710809 /nfs/dbraw/zinc/71/08/09/1413710809.db2.gz LPEMCZWBONXQKN-ACBHZAAOSA-N 2 1 376.545 3.225 20 0 GGADMP Cc1c(C(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)cnn1-c1cc[nH+]cc1 ZINC000120326707 1413788243 /nfs/dbraw/zinc/78/82/43/1413788243.db2.gz WUSCTPHTLFIBGP-UHFFFAOYSA-N 2 1 381.524 3.349 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(CC[NH+](C)C)C2CCCC2)cc1F ZINC000120333285 1413790774 /nfs/dbraw/zinc/79/07/74/1413790774.db2.gz AUIJYYIPEXNHDR-UHFFFAOYSA-N 2 1 387.503 3.336 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C)cc2O[C@@H]2CCOC2)[C@H](C)C1 ZINC000120576368 1413847278 /nfs/dbraw/zinc/84/72/78/1413847278.db2.gz NNXSESXJXIWJQJ-FCEUIQTBSA-N 2 1 390.568 3.389 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(C)cc2O[C@@H]2CCOC2)[C@H](C)C1 ZINC000120576368 1413847280 /nfs/dbraw/zinc/84/72/80/1413847280.db2.gz NNXSESXJXIWJQJ-FCEUIQTBSA-N 2 1 390.568 3.389 20 0 GGADMP C[C@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000120685311 1413874695 /nfs/dbraw/zinc/87/46/95/1413874695.db2.gz IKSZTBPBSZICJI-AVRDEDQJSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000120685311 1413874696 /nfs/dbraw/zinc/87/46/96/1413874696.db2.gz IKSZTBPBSZICJI-AVRDEDQJSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@H]1C[NH+](C)CC[C@@H]1N(C)C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000120685311 1413874700 /nfs/dbraw/zinc/87/47/00/1413874700.db2.gz IKSZTBPBSZICJI-AVRDEDQJSA-N 2 1 398.551 3.393 20 0 GGADMP C[C@H]1C[NH+](C)CC[C@@H]1N(C)C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000120685311 1413874704 /nfs/dbraw/zinc/87/47/04/1413874704.db2.gz IKSZTBPBSZICJI-AVRDEDQJSA-N 2 1 398.551 3.393 20 0 GGADMP CC(C)N(C(=O)[C@H](C)[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000177487614 1428764411 /nfs/dbraw/zinc/76/44/11/1428764411.db2.gz HMTNZGJQWMOWAF-ZCNNSNEGSA-N 2 1 381.605 3.232 20 0 GGADMP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Br)c(OC(F)F)c(OC)c2)C1 ZINC000120809939 1413910368 /nfs/dbraw/zinc/91/03/68/1413910368.db2.gz MJFGZPCYLXVYAR-NSHDSACASA-N 2 1 393.272 3.491 20 0 GGADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Br)c(OC(F)F)c(OC)c2)C1 ZINC000120809939 1413910371 /nfs/dbraw/zinc/91/03/71/1413910371.db2.gz MJFGZPCYLXVYAR-NSHDSACASA-N 2 1 393.272 3.491 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CC[NH+](Cc3cc4ccccc4[nH]c3=O)CC2)C[C@H](C)O1 ZINC000177501103 1428771355 /nfs/dbraw/zinc/77/13/55/1428771355.db2.gz VYBMLSJZKHIJOX-HDICACEKSA-N 2 1 383.536 3.239 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@H]1CCC[N@@H+]1CC1CCCCC1 ZINC000121093220 1414004856 /nfs/dbraw/zinc/00/48/56/1414004856.db2.gz DEQVDUBUQGUOOS-HXUWFJFHSA-N 2 1 375.561 3.268 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@H]1CCC[N@H+]1CC1CCCCC1 ZINC000121093220 1414004860 /nfs/dbraw/zinc/00/48/60/1414004860.db2.gz DEQVDUBUQGUOOS-HXUWFJFHSA-N 2 1 375.561 3.268 20 0 GGADMP CC(C)c1ccc(C[NH+]2CCN(C(=O)NC[C@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000121152095 1414026630 /nfs/dbraw/zinc/02/66/30/1414026630.db2.gz GZEXUJZJSBJHQZ-HXUWFJFHSA-N 2 1 384.568 3.122 20 0 GGADMP CC(C)c1ccc(C[NH+]2CCN(C(=O)NC[C@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000121152095 1414026636 /nfs/dbraw/zinc/02/66/36/1414026636.db2.gz GZEXUJZJSBJHQZ-HXUWFJFHSA-N 2 1 384.568 3.122 20 0 GGADMP C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000177509033 1428775263 /nfs/dbraw/zinc/77/52/63/1428775263.db2.gz KCCGNOJMNUCANL-KSZLIROESA-N 2 1 399.539 3.404 20 0 GGADMP C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000177509033 1428775272 /nfs/dbraw/zinc/77/52/72/1428775272.db2.gz KCCGNOJMNUCANL-KSZLIROESA-N 2 1 399.539 3.404 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3coc4ccccc34)c2)C1 ZINC000121354506 1414092798 /nfs/dbraw/zinc/09/27/98/1414092798.db2.gz WWNAUTRKDLGNGU-LJQANCHMSA-N 2 1 377.488 3.420 20 0 GGADMP C[C@@H](C(=O)Nc1nc2ccc(F)cc2s1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000121631481 1414206836 /nfs/dbraw/zinc/20/68/36/1414206836.db2.gz VPWWYYKPFHCTGQ-ZDUSSCGKSA-N 2 1 378.517 3.426 20 0 GGADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)CC2)cs1 ZINC000121791038 1414258024 /nfs/dbraw/zinc/25/80/24/1414258024.db2.gz CSXWGECDPJILAZ-SXLOBPIMSA-N 2 1 375.582 3.465 20 0 GGADMP Cc1cc(NC(=O)C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)n(C(C)(C)C)n1 ZINC000121801674 1414261747 /nfs/dbraw/zinc/26/17/47/1414261747.db2.gz DPCHVVRQGSTSOB-UHFFFAOYSA-N 2 1 389.588 3.473 20 0 GGADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)CC1 ZINC000121949945 1414320098 /nfs/dbraw/zinc/32/00/98/1414320098.db2.gz FPCFCFRYSKZXQE-KRWDZBQOSA-N 2 1 381.586 3.242 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cc(=O)oc3cc(O)ccc23)CC1 ZINC000122080480 1414357902 /nfs/dbraw/zinc/35/79/02/1414357902.db2.gz KRQGQCNETXEHTH-UHFFFAOYSA-N 2 1 388.508 3.069 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+](Cc2nc(-c3ccsc3)no2)CC1 ZINC000122088707 1414360210 /nfs/dbraw/zinc/36/02/10/1414360210.db2.gz ZJUZWFZNJGCANJ-UHFFFAOYSA-N 2 1 378.542 3.369 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2nc(-c3ccsc3)no2)CC1 ZINC000122088707 1414360220 /nfs/dbraw/zinc/36/02/20/1414360220.db2.gz ZJUZWFZNJGCANJ-UHFFFAOYSA-N 2 1 378.542 3.369 20 0 GGADMP CC(=O)Nc1cccc(NC(=O)C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000122125221 1414369025 /nfs/dbraw/zinc/36/90/25/1414369025.db2.gz ITJNYTKXVKVQIB-UHFFFAOYSA-N 2 1 386.540 3.172 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2C)CC1 ZINC000122137390 1414370554 /nfs/dbraw/zinc/37/05/54/1414370554.db2.gz UPZZKGLOWUJLOO-LJQANCHMSA-N 2 1 375.557 3.392 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2cccc(C)c2)CC1 ZINC000122136886 1414371074 /nfs/dbraw/zinc/37/10/74/1414371074.db2.gz YOSXAWRMQBNZMU-LJQANCHMSA-N 2 1 375.557 3.392 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)N2CCc3ccccc32)CC1 ZINC000122136395 1414371119 /nfs/dbraw/zinc/37/11/19/1414371119.db2.gz XCCBGBCLDOPDQH-LJQANCHMSA-N 2 1 387.568 3.035 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2ccc(F)c(F)c2)CC1 ZINC000122170913 1414379188 /nfs/dbraw/zinc/37/91/88/1414379188.db2.gz NDRFSHKZMDTCOD-MRXNPFEDSA-N 2 1 397.510 3.362 20 0 GGADMP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1 ZINC000122278253 1414409469 /nfs/dbraw/zinc/40/94/69/1414409469.db2.gz LUYZHDUSOFFNOO-MAUKXSAKSA-N 2 1 379.932 3.039 20 0 GGADMP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1 ZINC000122278253 1414409471 /nfs/dbraw/zinc/40/94/71/1414409471.db2.gz LUYZHDUSOFFNOO-MAUKXSAKSA-N 2 1 379.932 3.039 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000122342372 1414429039 /nfs/dbraw/zinc/42/90/39/1414429039.db2.gz GJJTUKXCRHTXCH-HNNXBMFYSA-N 2 1 394.512 3.020 20 0 GGADMP C[NH+](C)CCN(C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCCC1 ZINC000122603416 1414514024 /nfs/dbraw/zinc/51/40/24/1414514024.db2.gz HOSMLLVKVJJPAM-SFHVURJKSA-N 2 1 392.613 3.476 20 0 GGADMP CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000122915065 1414595539 /nfs/dbraw/zinc/59/55/39/1414595539.db2.gz XKRNHKCRZUGBIC-ZWKOTPCHSA-N 2 1 381.561 3.057 20 0 GGADMP C[NH+](C)CCCC1CC[NH+](CC(=O)Nc2nc3ccc(F)cc3s2)CC1 ZINC000123250231 1414678597 /nfs/dbraw/zinc/67/85/97/1414678597.db2.gz SVXRTZGPAWCRTI-UHFFFAOYSA-N 2 1 378.517 3.428 20 0 GGADMP COc1ccc(OC)c(NC(=O)[C@@H](C)[NH+]2CCC(CCC[NH+](C)C)CC2)c1 ZINC000123321815 1414696401 /nfs/dbraw/zinc/69/64/01/1414696401.db2.gz MYZICRMWTSAQGR-MRXNPFEDSA-N 2 1 377.529 3.085 20 0 GGADMP CCN1CC[NH+](Cc2ccc(C[NH2+]Cc3cc4ccccc4[nH]c3=O)cc2)CC1 ZINC000123330723 1414698370 /nfs/dbraw/zinc/69/83/70/1414698370.db2.gz KRMLORKVOPJUAV-UHFFFAOYSA-N 2 1 390.531 3.368 20 0 GGADMP C[N@@H+](CCCNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)Cc1ccccc1 ZINC000123349678 1414703220 /nfs/dbraw/zinc/70/32/20/1414703220.db2.gz ZHMXOXPITRXBSA-IRLDBZIGSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)Cc1ccccc1 ZINC000123349678 1414703227 /nfs/dbraw/zinc/70/32/27/1414703227.db2.gz ZHMXOXPITRXBSA-IRLDBZIGSA-N 2 1 384.568 3.167 20 0 GGADMP C[NH+](CCCNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)Cc1ccccc1 ZINC000123349678 1414703232 /nfs/dbraw/zinc/70/32/32/1414703232.db2.gz ZHMXOXPITRXBSA-IRLDBZIGSA-N 2 1 384.568 3.167 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123650123 1414803909 /nfs/dbraw/zinc/80/39/09/1414803909.db2.gz PKILVNBCPIZJAS-UHFFFAOYSA-N 2 1 397.567 3.481 20 0 GGADMP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+]([C@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000123677307 1414808016 /nfs/dbraw/zinc/80/80/16/1414808016.db2.gz PDGZVPLXJFKYHP-UGKGYDQZSA-N 2 1 380.536 3.428 20 0 GGADMP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+]([C@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000123677307 1414808020 /nfs/dbraw/zinc/80/80/20/1414808020.db2.gz PDGZVPLXJFKYHP-UGKGYDQZSA-N 2 1 380.536 3.428 20 0 GGADMP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](CC(=O)N2CCC(Cc3ccccc3)CC2)C1 ZINC000123826389 1414830167 /nfs/dbraw/zinc/83/01/67/1414830167.db2.gz UVWPTCOCXNAOIP-QFIPXVFZSA-N 2 1 394.563 3.156 20 0 GGADMP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](CC(=O)N2CCC(Cc3ccccc3)CC2)C1 ZINC000123826389 1414830168 /nfs/dbraw/zinc/83/01/68/1414830168.db2.gz UVWPTCOCXNAOIP-QFIPXVFZSA-N 2 1 394.563 3.156 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000123834032 1414831389 /nfs/dbraw/zinc/83/13/89/1414831389.db2.gz YCPNHNYCVPBRML-FYYLOGMGSA-N 2 1 396.579 3.093 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000123834032 1414831390 /nfs/dbraw/zinc/83/13/90/1414831390.db2.gz YCPNHNYCVPBRML-FYYLOGMGSA-N 2 1 396.579 3.093 20 0 GGADMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000123834032 1414831393 /nfs/dbraw/zinc/83/13/93/1414831393.db2.gz YCPNHNYCVPBRML-FYYLOGMGSA-N 2 1 396.579 3.093 20 0 GGADMP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000123860030 1414836660 /nfs/dbraw/zinc/83/66/60/1414836660.db2.gz FBNZUJJQHVGPHL-FYYLOGMGSA-N 2 1 396.579 3.441 20 0 GGADMP CC[C@@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000123922420 1414850523 /nfs/dbraw/zinc/85/05/23/1414850523.db2.gz BJMRILBPXDCZQJ-DHIUTWEWSA-N 2 1 395.547 3.158 20 0 GGADMP CC[C@@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000123922420 1414850525 /nfs/dbraw/zinc/85/05/25/1414850525.db2.gz BJMRILBPXDCZQJ-DHIUTWEWSA-N 2 1 395.547 3.158 20 0 GGADMP OC[C@@H](Cc1c[nH]c2ccccc12)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000123995521 1414865849 /nfs/dbraw/zinc/86/58/49/1414865849.db2.gz KTKYUEDBGPSWML-JOCHJYFZSA-N 2 1 377.532 3.368 20 0 GGADMP CC(C)[NH+](CCNC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)C(C)C ZINC000124060262 1414878157 /nfs/dbraw/zinc/87/81/57/1414878157.db2.gz DQLQAPMPZDZMBF-UHFFFAOYSA-N 2 1 396.526 3.347 20 0 GGADMP CCOc1ccc(NC(=O)C[NH+]2CCC(CC[NH+](C)C)CC2)cc1OCC ZINC000124156506 1414897167 /nfs/dbraw/zinc/89/71/67/1414897167.db2.gz HQHWBMYPZBJIMM-UHFFFAOYSA-N 2 1 377.529 3.086 20 0 GGADMP CCC[N@H+]1CCC[C@@H]1C(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCC2)cc1 ZINC000124318854 1414937687 /nfs/dbraw/zinc/93/76/87/1414937687.db2.gz HJEAFNUYOOECPB-HXUWFJFHSA-N 2 1 386.540 3.314 20 0 GGADMP Cc1ccc(NC(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)c(OCC[NH+](C)C)c1 ZINC000124484035 1414979022 /nfs/dbraw/zinc/97/90/22/1414979022.db2.gz AEZMNIAWQAIABI-SFHVURJKSA-N 2 1 376.545 3.035 20 0 GGADMP COc1ccc(CNC(=O)C2CC[NH+](CCCCn3cc[nH+]c3C)CC2)cc1 ZINC000124871783 1415064098 /nfs/dbraw/zinc/06/40/98/1415064098.db2.gz XZNNLGZKAQWRBQ-UHFFFAOYSA-N 2 1 384.524 3.009 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)NCc2cccc(C[NH+](C)C)c2)C[N@H+]1Cc1ccccc1 ZINC000124882814 1415065950 /nfs/dbraw/zinc/06/59/50/1415065950.db2.gz IBKCHXUCGBZINS-GCJKJVERSA-N 2 1 380.536 3.210 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000124932172 1415075431 /nfs/dbraw/zinc/07/54/31/1415075431.db2.gz BUJFUTWKIZUDRR-SFHLNBCPSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000124932172 1415075438 /nfs/dbraw/zinc/07/54/38/1415075438.db2.gz BUJFUTWKIZUDRR-SFHLNBCPSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000124932172 1415075444 /nfs/dbraw/zinc/07/54/44/1415075444.db2.gz BUJFUTWKIZUDRR-SFHLNBCPSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](Cc1ccsc1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000124991215 1415087786 /nfs/dbraw/zinc/08/77/86/1415087786.db2.gz KJZCEWFFGSRXAZ-QGZVFWFLSA-N 2 1 387.549 3.130 20 0 GGADMP COc1ccc(OC)c([C@@H](O)C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1 ZINC000125003253 1415089985 /nfs/dbraw/zinc/08/99/85/1415089985.db2.gz USUUVZLWWJWUER-NRFANRHFSA-N 2 1 376.541 3.372 20 0 GGADMP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125014116 1415091797 /nfs/dbraw/zinc/09/17/97/1415091797.db2.gz XSAUVQWHTOPGHJ-KOSHJBKYSA-N 2 1 393.531 3.371 20 0 GGADMP C[C@@H](CCc1ccco1)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000125018767 1415092895 /nfs/dbraw/zinc/09/28/95/1415092895.db2.gz MOGZXQSFTRSYHQ-SFHVURJKSA-N 2 1 385.508 3.051 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@H]2CCC[C@H](C3CC3)C2)c1 ZINC000125042240 1415098060 /nfs/dbraw/zinc/09/80/60/1415098060.db2.gz SEJGGQXWTQVBSB-SFTDATJTSA-N 2 1 385.552 3.406 20 0 GGADMP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000177812225 1428863094 /nfs/dbraw/zinc/86/30/94/1428863094.db2.gz NCPLAKKCTIEUEH-MOPGFXCFSA-N 2 1 388.581 3.326 20 0 GGADMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000177812225 1428863097 /nfs/dbraw/zinc/86/30/97/1428863097.db2.gz NCPLAKKCTIEUEH-MOPGFXCFSA-N 2 1 388.581 3.326 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000177849158 1428872313 /nfs/dbraw/zinc/87/23/13/1428872313.db2.gz NJXIMTSLKPHUBB-FQEVSTJZSA-N 2 1 386.584 3.402 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000125479315 1415211332 /nfs/dbraw/zinc/21/13/32/1415211332.db2.gz JNNIVLQSKPBMBO-GCJKJVERSA-N 2 1 384.568 3.213 20 0 GGADMP CCOc1ccc2cc(C(=O)N(CC[NH+](C)C)C[C@@H]3CCC[N@H+]3CC)[nH]c2c1 ZINC000125588854 1415233218 /nfs/dbraw/zinc/23/32/18/1415233218.db2.gz CCDSTXOUETULJZ-SFHVURJKSA-N 2 1 386.540 3.055 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000125654558 1415247083 /nfs/dbraw/zinc/24/70/83/1415247083.db2.gz HYWAFPWPRZICJV-OAQYLSRUSA-N 2 1 378.605 3.404 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000125658329 1415248094 /nfs/dbraw/zinc/24/80/94/1415248094.db2.gz JHXQVVPPHOXCHV-MWXLCCTBSA-N 2 1 378.605 3.449 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000125827767 1415291504 /nfs/dbraw/zinc/29/15/04/1415291504.db2.gz MNOUJGGDJIPXAH-YFVAEKQCSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1)[NH+]1CCOCC1 ZINC000125827767 1415291507 /nfs/dbraw/zinc/29/15/07/1415291507.db2.gz MNOUJGGDJIPXAH-YFVAEKQCSA-N 2 1 386.540 3.028 20 0 GGADMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1 ZINC000177969759 1428906693 /nfs/dbraw/zinc/90/66/93/1428906693.db2.gz ZIVBQMTXHKRNKA-GOSISDBHSA-N 2 1 376.508 3.020 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)[NH+](C)C)cc1 ZINC000126066648 1415349417 /nfs/dbraw/zinc/34/94/17/1415349417.db2.gz AJXCNMXSCCYZKZ-HJNYFJLDSA-N 2 1 384.568 3.256 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]C[C@H]3COC4(CCCCC4)O3)CC2)cc1 ZINC000126209842 1415385232 /nfs/dbraw/zinc/38/52/32/1415385232.db2.gz NIHRXIKUDFEOCA-NRFANRHFSA-N 2 1 376.516 3.498 20 0 GGADMP CCN1CC[NH+](Cc2ccc(C[NH2+][C@@H](C)CC(=O)Nc3ccccc3)cc2)CC1 ZINC000126352441 1415424312 /nfs/dbraw/zinc/42/43/12/1415424312.db2.gz ZQIUDVOLSZRJLQ-FQEVSTJZSA-N 2 1 394.563 3.331 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1)c1ccco1 ZINC000126399611 1415438647 /nfs/dbraw/zinc/43/86/47/1415438647.db2.gz MDUUWOVWOYGHJZ-IBGZPJMESA-N 2 1 384.524 3.018 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1)c1ccco1 ZINC000126399611 1415438653 /nfs/dbraw/zinc/43/86/53/1415438653.db2.gz MDUUWOVWOYGHJZ-IBGZPJMESA-N 2 1 384.524 3.018 20 0 GGADMP C[C@@H](c1cn(-c2ccccc2)nn1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000126415559 1415445220 /nfs/dbraw/zinc/44/52/20/1415445220.db2.gz FRLDJTLVENEUQL-QRVBRYPASA-N 2 1 383.540 3.150 20 0 GGADMP CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c1 ZINC000126644789 1415515786 /nfs/dbraw/zinc/51/57/86/1415515786.db2.gz SLQCBSALOCOTMB-SFHVURJKSA-N 2 1 380.536 3.243 20 0 GGADMP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCN(C)CC3)cc1)CCCO2 ZINC000126653964 1415518323 /nfs/dbraw/zinc/51/83/23/1415518323.db2.gz MRFWVXBNCJOPQC-HSZRJFAPSA-N 2 1 395.547 3.446 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)[NH+](C)Cc1ccccc1 ZINC000126686286 1415526526 /nfs/dbraw/zinc/52/65/26/1415526526.db2.gz JZILQKCZPBNQQW-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)[N@H+](C)Cc1ccccc1 ZINC000126686286 1415526534 /nfs/dbraw/zinc/52/65/34/1415526534.db2.gz JZILQKCZPBNQQW-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000126686286 1415526544 /nfs/dbraw/zinc/52/65/44/1415526544.db2.gz JZILQKCZPBNQQW-UZKOGDIHSA-N 2 1 384.568 3.165 20 0 GGADMP O=C(NCCCCC[NH+]1CCCCC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126738631 1415543455 /nfs/dbraw/zinc/54/34/55/1415543455.db2.gz BRALGLYOBSQAJM-TZIWHRDSSA-N 2 1 376.589 3.301 20 0 GGADMP O=C(NCCCCC[NH+]1CCCCC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126738863 1415544115 /nfs/dbraw/zinc/54/41/15/1415544115.db2.gz BRALGLYOBSQAJM-CTNGQTDRSA-N 2 1 376.589 3.301 20 0 GGADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N2CCOC2=O)cc1 ZINC000178034624 1428947766 /nfs/dbraw/zinc/94/77/66/1428947766.db2.gz FVLSHXWQUBBSSB-KSZLIROESA-N 2 1 375.513 3.183 20 0 GGADMP CCc1ccccc1NC(=O)C[C@@H](C)[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000178036980 1428949459 /nfs/dbraw/zinc/94/94/59/1428949459.db2.gz YDUPXLACUVUTEW-QRVBRYPASA-N 2 1 375.557 3.445 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H](c1cccc(F)c1)[NH+](C)C ZINC000126846942 1415583298 /nfs/dbraw/zinc/58/32/98/1415583298.db2.gz ZLMOZHRCCBKGSG-XLIONFOSSA-N 2 1 378.536 3.382 20 0 GGADMP O=C1OCCN1c1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000127016684 1415637539 /nfs/dbraw/zinc/63/75/39/1415637539.db2.gz XFZRQYCDXZAKBP-UHFFFAOYSA-N 2 1 379.504 3.440 20 0 GGADMP CCN1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)CC1 ZINC000127295096 1415723335 /nfs/dbraw/zinc/72/33/35/1415723335.db2.gz JAACZZAIXBEHBS-QZTJIDSGSA-N 2 1 376.564 3.349 20 0 GGADMP C[C@H]1C[N@H+](Cc2cccc(CNC(=O)[C@@H]3CC[NH+](C4CCCCC4)C3)c2)CCO1 ZINC000178155018 1429002033 /nfs/dbraw/zinc/00/20/33/1429002033.db2.gz ZGBPBBRWSFMMNY-SIKLNZKXSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@H]1C[N@@H+](Cc2cccc(CNC(=O)[C@@H]3CC[NH+](C4CCCCC4)C3)c2)CCO1 ZINC000178155018 1429002037 /nfs/dbraw/zinc/00/20/37/1429002037.db2.gz ZGBPBBRWSFMMNY-SIKLNZKXSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@H]1C[NH+](Cc2cccc(CNC(=O)[C@@H]3CC[N@@H+](C4CCCCC4)C3)c2)CCO1 ZINC000178155018 1429002042 /nfs/dbraw/zinc/00/20/42/1429002042.db2.gz ZGBPBBRWSFMMNY-SIKLNZKXSA-N 2 1 399.579 3.178 20 0 GGADMP C[C@H]1C[NH+](Cc2cccc(CNC(=O)[C@@H]3CC[N@H+](C4CCCCC4)C3)c2)CCO1 ZINC000178155018 1429002046 /nfs/dbraw/zinc/00/20/46/1429002046.db2.gz ZGBPBBRWSFMMNY-SIKLNZKXSA-N 2 1 399.579 3.178 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000127669717 1415829766 /nfs/dbraw/zinc/82/97/66/1415829766.db2.gz HMIUKQKHZJSVJE-PXNSSMCTSA-N 2 1 378.536 3.096 20 0 GGADMP O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000127748680 1415843566 /nfs/dbraw/zinc/84/35/66/1415843566.db2.gz CMBGZQKEVWIWOM-YMPZKCBVSA-N 2 1 396.579 3.482 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)cc1 ZINC000127836522 1415860356 /nfs/dbraw/zinc/86/03/56/1415860356.db2.gz YKCUXAXGMIBYMF-UHFFFAOYSA-N 2 1 398.526 3.305 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cc1 ZINC000127836522 1415860360 /nfs/dbraw/zinc/86/03/60/1415860360.db2.gz YKCUXAXGMIBYMF-UHFFFAOYSA-N 2 1 398.526 3.305 20 0 GGADMP C[C@@H](C[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(F)cc1 ZINC000127898832 1415872533 /nfs/dbraw/zinc/87/25/33/1415872533.db2.gz UNGPQAPZCYYIGV-UWJYYQICSA-N 2 1 383.511 3.416 20 0 GGADMP CC[NH+](CC)[C@H](C(=O)NC1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccccc1 ZINC000178186427 1429012277 /nfs/dbraw/zinc/01/22/77/1429012277.db2.gz UANGYTMHRXPASD-QFIPXVFZSA-N 2 1 395.551 3.262 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc(SCC(F)F)cc1 ZINC000127955139 1415882790 /nfs/dbraw/zinc/88/27/90/1415882790.db2.gz MORXDNXYXNGAAI-HOCLYGCPSA-N 2 1 385.524 3.282 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000127987202 1415888515 /nfs/dbraw/zinc/88/85/15/1415888515.db2.gz OHCUUQXDWDLRDC-ZWKOTPCHSA-N 2 1 398.576 3.365 20 0 GGADMP CCC[NH+](CCC)CCCC(=O)NC1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000178193087 1429015047 /nfs/dbraw/zinc/01/50/47/1429015047.db2.gz DAFRYMSQJAIWRG-UHFFFAOYSA-N 2 1 375.561 3.081 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(NC(=O)NC(C)C)cc2)[C@H](C)C1 ZINC000128005682 1415892235 /nfs/dbraw/zinc/89/22/35/1415892235.db2.gz MFPBNNPFNIAUPN-WIYYLYMNSA-N 2 1 390.572 3.443 20 0 GGADMP C[C@@H]1C[N@@H+](CCC2CCN(C(=O)[C@@H](c3ccccc3)[NH+](C)C)CC2)C[C@H](C)O1 ZINC000178235448 1429026142 /nfs/dbraw/zinc/02/61/42/1429026142.db2.gz OZPMAYSVOZGFFD-XQBPLPMBSA-N 2 1 387.568 3.027 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CCN(C(=O)[C@@H](c3ccccc3)[NH+](C)C)CC2)C[C@H](C)O1 ZINC000178235448 1429026150 /nfs/dbraw/zinc/02/61/50/1429026150.db2.gz OZPMAYSVOZGFFD-XQBPLPMBSA-N 2 1 387.568 3.027 20 0 GGADMP CCC(CC)[C@@H](CNC(=O)N1CCC(Cc2[nH+]ccn2C)CC1)[NH+]1CCCC1 ZINC000128178658 1415931991 /nfs/dbraw/zinc/93/19/91/1415931991.db2.gz HQKZEDPKVNSUPS-HXUWFJFHSA-N 2 1 389.588 3.285 20 0 GGADMP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CCCN2CCC[N@@H+](C)CC2)cc1 ZINC000128240196 1415946263 /nfs/dbraw/zinc/94/62/63/1415946263.db2.gz KPKZHGZSTILWCP-IBGZPJMESA-N 2 1 389.588 3.239 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000128542828 1416009659 /nfs/dbraw/zinc/00/96/59/1416009659.db2.gz JROSKFXQERAJRJ-HXUWFJFHSA-N 2 1 384.524 3.017 20 0 GGADMP C[NH+](C)CCN(Cc1ccco1)C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000128542586 1416009749 /nfs/dbraw/zinc/00/97/49/1416009749.db2.gz JROSKFXQERAJRJ-FQEVSTJZSA-N 2 1 384.524 3.017 20 0 GGADMP C[C@H](c1ccc(NC(=O)N[C@@H](C)C(C)(C)C[NH+](C)C)cc1)[NH+]1CCOCC1 ZINC000129079073 1416139578 /nfs/dbraw/zinc/13/95/78/1416139578.db2.gz WKZOTWDQEZKHOA-SJORKVTESA-N 2 1 376.545 3.178 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[NH+]1CCSCC1)C(C)(C)C[NH+](C)C ZINC000129394947 1416202216 /nfs/dbraw/zinc/20/22/16/1416202216.db2.gz RPPQQIDZNWCJLK-MRXNPFEDSA-N 2 1 378.586 3.333 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)[C@@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000130310661 1416355878 /nfs/dbraw/zinc/35/58/78/1416355878.db2.gz MUOCGMRQPSHHJZ-LJQANCHMSA-N 2 1 382.552 3.431 20 0 GGADMP c1cc(COc2ccc(C[NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)cc2)ccn1 ZINC000130402554 1416372258 /nfs/dbraw/zinc/37/22/58/1416372258.db2.gz IUPBSVACPUPRBO-NRFANRHFSA-N 2 1 381.520 3.251 20 0 GGADMP CC[C@H](C)Oc1cc(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)ccc1OC ZINC000130405874 1416372498 /nfs/dbraw/zinc/37/24/98/1416372498.db2.gz SLPMHHYEVLMMKQ-PKOBYXMFSA-N 2 1 376.541 3.463 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1C[NH+]1CCSCC1)C[NH+]1CCCC1 ZINC000130667185 1416421684 /nfs/dbraw/zinc/42/16/84/1416421684.db2.gz VHJGFIALCRFPHB-QGZVFWFLSA-N 2 1 376.570 3.089 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N(CC[NH+](C)C)Cc2cccs2)C1 ZINC000130677923 1416423350 /nfs/dbraw/zinc/42/33/50/1416423350.db2.gz CFEZBYZGHLINIS-GOSISDBHSA-N 2 1 380.602 3.189 20 0 GGADMP Cc1nccn1CCC[N@H+](C)CC(=O)NCC1(c2ccc(F)cc2)CCCC1 ZINC000130689311 1416425792 /nfs/dbraw/zinc/42/57/92/1416425792.db2.gz DIEGXUONCIXNSU-UHFFFAOYSA-N 2 1 386.515 3.281 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)NCC1(c2ccc(F)cc2)CCCC1 ZINC000130689311 1416425794 /nfs/dbraw/zinc/42/57/94/1416425794.db2.gz DIEGXUONCIXNSU-UHFFFAOYSA-N 2 1 386.515 3.281 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC000130734252 1416437920 /nfs/dbraw/zinc/43/79/20/1416437920.db2.gz SPZQQQZUYPJBIN-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC000130734252 1416437924 /nfs/dbraw/zinc/43/79/24/1416437924.db2.gz SPZQQQZUYPJBIN-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP CC(C)C[NH+]1CCC[C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC000130734252 1416437928 /nfs/dbraw/zinc/43/79/28/1416437928.db2.gz SPZQQQZUYPJBIN-QFIPXVFZSA-N 2 1 386.584 3.272 20 0 GGADMP Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)C[N@H+](C)CCCn1cc[nH+]c1C ZINC000130776093 1416448586 /nfs/dbraw/zinc/44/85/86/1416448586.db2.gz SELZGEASDJDKNV-UHFFFAOYSA-N 2 1 394.523 3.263 20 0 GGADMP Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)C[N@@H+](C)CCCn1cc[nH+]c1C ZINC000130776093 1416448589 /nfs/dbraw/zinc/44/85/89/1416448589.db2.gz SELZGEASDJDKNV-UHFFFAOYSA-N 2 1 394.523 3.263 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000130813177 1416457293 /nfs/dbraw/zinc/45/72/93/1416457293.db2.gz KCXIUXRTBBUSOZ-QFIPXVFZSA-N 2 1 380.536 3.449 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000130813404 1416457770 /nfs/dbraw/zinc/45/77/70/1416457770.db2.gz KCXIUXRTBBUSOZ-JOCHJYFZSA-N 2 1 380.536 3.449 20 0 GGADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000130849507 1416466850 /nfs/dbraw/zinc/46/68/50/1416466850.db2.gz JVAVTUYBWLLGJL-OAHLLOKOSA-N 2 1 385.537 3.170 20 0 GGADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000130849507 1416466858 /nfs/dbraw/zinc/46/68/58/1416466858.db2.gz JVAVTUYBWLLGJL-OAHLLOKOSA-N 2 1 385.537 3.170 20 0 GGADMP CC[NH+]1CCN(c2ccc(NC(=O)N3CC[C@@H]4[C@H](CCC[N@H+]4C)C3)c(C)c2)CC1 ZINC000178539237 1429101828 /nfs/dbraw/zinc/10/18/28/1429101828.db2.gz KPPXXVCEEKANDV-DENIHFKCSA-N 2 1 399.583 3.085 20 0 GGADMP C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131261840 1416531246 /nfs/dbraw/zinc/53/12/46/1416531246.db2.gz CWWSIDVFPWZGII-HZPDHXFCSA-N 2 1 390.478 3.172 20 0 GGADMP C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131261840 1416531248 /nfs/dbraw/zinc/53/12/48/1416531248.db2.gz CWWSIDVFPWZGII-HZPDHXFCSA-N 2 1 390.478 3.172 20 0 GGADMP C[C@H](C(=O)N1CCC[C@H]1c1cccs1)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131298298 1416536617 /nfs/dbraw/zinc/53/66/17/1416536617.db2.gz FCVUZCSVQYXOOB-KURKYZTESA-N 2 1 386.565 3.488 20 0 GGADMP C[C@H](C(=O)N1CCC[C@H]1c1cccs1)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131298298 1416536620 /nfs/dbraw/zinc/53/66/20/1416536620.db2.gz FCVUZCSVQYXOOB-KURKYZTESA-N 2 1 386.565 3.488 20 0 GGADMP CSc1ccc(CN(C)C(=O)C[N@H+]2CCC[C@H](Cc3nccn3C)C2)cc1 ZINC000131312874 1416538844 /nfs/dbraw/zinc/53/88/44/1416538844.db2.gz VAZKIAJOTQVGFD-GOSISDBHSA-N 2 1 386.565 3.055 20 0 GGADMP CSc1ccc(CN(C)C(=O)C[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)cc1 ZINC000131312874 1416538847 /nfs/dbraw/zinc/53/88/47/1416538847.db2.gz VAZKIAJOTQVGFD-GOSISDBHSA-N 2 1 386.565 3.055 20 0 GGADMP CSc1ccc(CN(C)C(=O)C[N@H+]2CCC[C@@H](Cc3nccn3C)C2)cc1 ZINC000131312639 1416538869 /nfs/dbraw/zinc/53/88/69/1416538869.db2.gz VAZKIAJOTQVGFD-SFHVURJKSA-N 2 1 386.565 3.055 20 0 GGADMP CSc1ccc(CN(C)C(=O)C[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)cc1 ZINC000131312639 1416538871 /nfs/dbraw/zinc/53/88/71/1416538871.db2.gz VAZKIAJOTQVGFD-SFHVURJKSA-N 2 1 386.565 3.055 20 0 GGADMP C[C@H](OC[C@H](O)C[N@H+]1CCC[C@H](Cc2nccn2C)C1)c1ccc(Cl)cc1 ZINC000131322755 1416539836 /nfs/dbraw/zinc/53/98/36/1416539836.db2.gz DMNMBEXYIZJMAL-SQGPQFPESA-N 2 1 391.943 3.467 20 0 GGADMP C[C@H](OC[C@@H](O)C[N@H+]1CCC[C@H](Cc2nccn2C)C1)c1ccc(Cl)cc1 ZINC000131323183 1416539987 /nfs/dbraw/zinc/53/99/87/1416539987.db2.gz DMNMBEXYIZJMAL-QKLQHJQFSA-N 2 1 391.943 3.467 20 0 GGADMP CC[C@H]1c2ccsc2CCN1C(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131400020 1416551436 /nfs/dbraw/zinc/55/14/36/1416551436.db2.gz ULOXINRZNPTJOD-AEFFLSMTSA-N 2 1 386.565 3.272 20 0 GGADMP CC[C@H]1c2ccsc2CCN1C(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000131400020 1416551437 /nfs/dbraw/zinc/55/14/37/1416551437.db2.gz ULOXINRZNPTJOD-AEFFLSMTSA-N 2 1 386.565 3.272 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)c1cnn(-c2cc[nH+]cc2)c1C ZINC000131456503 1416560628 /nfs/dbraw/zinc/56/06/28/1416560628.db2.gz NQTFDDCMOBQDGL-UHFFFAOYSA-N 2 1 377.492 3.300 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N(CC[NH+](C)C)Cc2ccco2)CC[N@H+]1Cc1ccccc1 ZINC000131699403 1416599298 /nfs/dbraw/zinc/59/92/98/1416599298.db2.gz RPWMWIPZXKTYNX-CTNGQTDRSA-N 2 1 398.551 3.406 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1C[NH+]1CCCCCC1)[NH+]1CCSCC1 ZINC000132083057 1416691360 /nfs/dbraw/zinc/69/13/60/1416691360.db2.gz KSKOCJHKBNJHFB-GOSISDBHSA-N 2 1 375.582 3.116 20 0 GGADMP CC(C)N(C)S(=O)(=O)c1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000178620041 1429123649 /nfs/dbraw/zinc/12/36/49/1429123649.db2.gz WIMRFURPAXCRDG-UHFFFAOYSA-N 2 1 381.586 3.068 20 0 GGADMP C[N@@H+](C[C@H](O)COc1cccc2[nH]ccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000132506299 1416774995 /nfs/dbraw/zinc/77/49/95/1416774995.db2.gz WAPPYKSCFQVZSH-RTWAWAEBSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C[C@H](O)COc1cccc2[nH]ccc21)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000132506299 1416775000 /nfs/dbraw/zinc/77/50/00/1416775000.db2.gz WAPPYKSCFQVZSH-RTWAWAEBSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C[C@H](O)COc1cccc2[nH]ccc21)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000132506299 1416775018 /nfs/dbraw/zinc/77/50/18/1416775018.db2.gz WAPPYKSCFQVZSH-RTWAWAEBSA-N 2 1 393.531 3.362 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+]([C@H]3CCCc4ccc(F)cc43)CC2)CC1 ZINC000132768133 1416812656 /nfs/dbraw/zinc/81/26/56/1416812656.db2.gz LHCLKFNDOOKFIS-QFIPXVFZSA-N 2 1 387.543 3.469 20 0 GGADMP Cc1cc(NC(=O)CC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)no1 ZINC000178660847 1429131047 /nfs/dbraw/zinc/13/10/47/1429131047.db2.gz BWEQTFVYZLEEPJ-WOJBJXKFSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)no1 ZINC000178660847 1429131053 /nfs/dbraw/zinc/13/10/53/1429131053.db2.gz BWEQTFVYZLEEPJ-WOJBJXKFSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)no1 ZINC000178660847 1429131068 /nfs/dbraw/zinc/13/10/68/1429131068.db2.gz BWEQTFVYZLEEPJ-WOJBJXKFSA-N 2 1 382.508 3.298 20 0 GGADMP Cc1cc(NC(=O)CC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)no1 ZINC000178660847 1429131080 /nfs/dbraw/zinc/13/10/80/1429131080.db2.gz BWEQTFVYZLEEPJ-WOJBJXKFSA-N 2 1 382.508 3.298 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1nnc2ccccn21 ZINC000132831331 1416820401 /nfs/dbraw/zinc/82/04/01/1416820401.db2.gz KBWMWJYFXFLACK-QGZVFWFLSA-N 2 1 378.524 3.111 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000132881778 1416826679 /nfs/dbraw/zinc/82/66/79/1416826679.db2.gz FZUDDQWBKFRRJG-RXVVDRJESA-N 2 1 387.572 3.171 20 0 GGADMP COC(=O)c1ccc(-c2ccc(C[NH2+]C[C@H](C(C)C)N3CC[NH+](C)CC3)o2)cc1 ZINC000132965337 1416836738 /nfs/dbraw/zinc/83/67/38/1416836738.db2.gz CLZFAOPVFYLRJW-OAQYLSRUSA-N 2 1 399.535 3.095 20 0 GGADMP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000178667110 1429133378 /nfs/dbraw/zinc/13/33/78/1429133378.db2.gz NLARYDIPOOWCPC-IBGZPJMESA-N 2 1 381.520 3.080 20 0 GGADMP CC(C)OCCN1CCC([NH2+][C@@H](C)C(=O)N2c3ccccc3CC[C@H]2C)CC1 ZINC000133015134 1416842262 /nfs/dbraw/zinc/84/22/62/1416842262.db2.gz HOAGKTSCHACFSR-MOPGFXCFSA-N 2 1 387.568 3.222 20 0 GGADMP C[C@H]1C[C@H]([NH2+]C[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)CC[N@H+]1C ZINC000133076838 1416849542 /nfs/dbraw/zinc/84/95/42/1416849542.db2.gz KTPOXKYPUBTGRO-IPELMVKDSA-N 2 1 385.474 3.151 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1 ZINC000133101477 1416851896 /nfs/dbraw/zinc/85/18/96/1416851896.db2.gz OLYJOQIWZQBVFM-YKCBXCCJSA-N 2 1 399.501 3.397 20 0 GGADMP C[C@@H](C(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)[NH+]1CCSCC1 ZINC000133335489 1416879734 /nfs/dbraw/zinc/87/97/34/1416879734.db2.gz UBFSDNJYBCNVRA-SFHVURJKSA-N 2 1 375.582 3.116 20 0 GGADMP O=C1C[C@@H]([NH2+]C2CCN(CCc3ccccc3)CC2)CN1c1c(F)cccc1F ZINC000133339996 1416880579 /nfs/dbraw/zinc/88/05/79/1416880579.db2.gz ZAFXCBSGXCLMEU-LJQANCHMSA-N 2 1 399.485 3.367 20 0 GGADMP C[N@@H+](Cc1ccccc1CNC(=O)C[C@H]1CSCC[NH2+]1)C1CCCCC1 ZINC000133569410 1416906376 /nfs/dbraw/zinc/90/63/76/1416906376.db2.gz KMJPKFXXWKJKMZ-IBGZPJMESA-N 2 1 375.582 3.162 20 0 GGADMP O[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)COc1ccc(F)c(F)c1 ZINC000133680230 1416938836 /nfs/dbraw/zinc/93/88/36/1416938836.db2.gz JOPFGSVBLMGDBR-LJQANCHMSA-N 2 1 390.474 3.001 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000133863339 1416981648 /nfs/dbraw/zinc/98/16/48/1416981648.db2.gz YKKIXZIVCFCVGK-OTWHNJEPSA-N 2 1 387.572 3.027 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000133909107 1416992556 /nfs/dbraw/zinc/99/25/56/1416992556.db2.gz ZKOIXJCUXXMRDI-VXKWHMMOSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000133909107 1416992561 /nfs/dbraw/zinc/99/25/61/1416992561.db2.gz ZKOIXJCUXXMRDI-VXKWHMMOSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000133909107 1416992563 /nfs/dbraw/zinc/99/25/63/1416992563.db2.gz ZKOIXJCUXXMRDI-VXKWHMMOSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000134040278 1417013500 /nfs/dbraw/zinc/01/35/00/1417013500.db2.gz MCHDILFPPYSIKM-QFIPXVFZSA-N 2 1 386.584 3.450 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cccc(Cl)c3F)c2)C1 ZINC000134055709 1417015556 /nfs/dbraw/zinc/01/55/56/1417015556.db2.gz JQURUQXQEOCFCT-GOSISDBHSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cccc(Cl)c3F)c2)C1 ZINC000134055709 1417015564 /nfs/dbraw/zinc/01/55/64/1417015564.db2.gz JQURUQXQEOCFCT-GOSISDBHSA-N 2 1 389.902 3.466 20 0 GGADMP Cc1cccc2nc(C[NH2+]Cc3ccccc3N(C)C3CC[NH+](C)CC3)cn21 ZINC000134104150 1417022961 /nfs/dbraw/zinc/02/29/61/1417022961.db2.gz PFZNZIBKPQMMML-UHFFFAOYSA-N 2 1 377.536 3.463 20 0 GGADMP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)cc1)C(C)C ZINC000134153581 1417030433 /nfs/dbraw/zinc/03/04/33/1417030433.db2.gz MJKYNYMEBPHVBS-NRFANRHFSA-N 2 1 375.557 3.004 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)cc1)C(C)C ZINC000134153581 1417030440 /nfs/dbraw/zinc/03/04/40/1417030440.db2.gz MJKYNYMEBPHVBS-NRFANRHFSA-N 2 1 375.557 3.004 20 0 GGADMP C[NH+]1CCN(C/C=C/CN2CC[N@H+](C)CC23CCCCC3)C2(CCCCC2)C1 ZINC000178725487 1429152262 /nfs/dbraw/zinc/15/22/62/1429152262.db2.gz SSPYSMRXBVUJTQ-MDZDMXLPSA-N 2 1 388.644 3.443 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+][C@@H]3CCCC[C@@H]3Cc3ccccc3)cn2)CC1 ZINC000134277757 1417048567 /nfs/dbraw/zinc/04/85/67/1417048567.db2.gz UPPZTGPOAIICGT-FGZHOGPDSA-N 2 1 379.552 3.120 20 0 GGADMP CCCC[C@@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(OC)cc1 ZINC000134278723 1417048703 /nfs/dbraw/zinc/04/87/03/1417048703.db2.gz MHFJZAKPQUYDDV-OAQYLSRUSA-N 2 1 383.540 3.258 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]CC3CCC(c4ccccc4)CC3)cn2)CC1 ZINC000134301361 1417052480 /nfs/dbraw/zinc/05/24/80/1417052480.db2.gz NIINZRKDEBCBMZ-UHFFFAOYSA-N 2 1 379.552 3.292 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]C3(c4ccc(Cl)cc4)CCCC3)cn2)CC1 ZINC000134332039 1417056706 /nfs/dbraw/zinc/05/67/06/1417056706.db2.gz JNFHNHHMYKFJPN-UHFFFAOYSA-N 2 1 385.943 3.441 20 0 GGADMP C[C@@H]1C[C@@H]1[C@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)c1ccc(Cl)cc1 ZINC000134367768 1417061597 /nfs/dbraw/zinc/06/15/97/1417061597.db2.gz IJUIBCNRDSJFKM-UIAACRFSSA-N 2 1 385.943 3.369 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH2+]CCc3cccc(-c4ccccc4)c3)cn2)CC1 ZINC000134415671 1417067224 /nfs/dbraw/zinc/06/72/24/1417067224.db2.gz NAHGHMOPNVMAEK-UHFFFAOYSA-N 2 1 387.531 3.228 20 0 GGADMP C[N@H+]1CC[C@@H](CNC(=O)NCC[NH+]2CCCCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000134506341 1417078450 /nfs/dbraw/zinc/07/84/50/1417078450.db2.gz BHRKNKINWGAQJT-LPHOPBHVSA-N 2 1 396.938 3.257 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000178734819 1429156864 /nfs/dbraw/zinc/15/68/64/1429156864.db2.gz VKIZAQFZIFQHRJ-OALUTQOASA-N 2 1 376.545 3.084 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)C1NC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000134722061 1417116832 /nfs/dbraw/zinc/11/68/32/1417116832.db2.gz WUPGAIMMGJIYDJ-VSOVRNOCSA-N 2 1 384.568 3.069 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000134733222 1417118151 /nfs/dbraw/zinc/11/81/51/1417118151.db2.gz RJPVOMSOMYBZJA-UIAACRFSSA-N 2 1 376.932 3.143 20 0 GGADMP C[C@H](C(=O)Nc1ccc(OCCC[NH+](C)C)cc1)[N@@H+]1CCc2ccccc2C1 ZINC000134873994 1417137686 /nfs/dbraw/zinc/13/76/86/1417137686.db2.gz FGTRCQORKNHSDI-GOSISDBHSA-N 2 1 381.520 3.402 20 0 GGADMP C[C@H](C(=O)Nc1ccc(OCCC[NH+](C)C)cc1)[N@H+]1CCc2ccccc2C1 ZINC000134873994 1417137690 /nfs/dbraw/zinc/13/76/90/1417137690.db2.gz FGTRCQORKNHSDI-GOSISDBHSA-N 2 1 381.520 3.402 20 0 GGADMP Cc1cc(C)c(CCNC(=O)CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(C)c1 ZINC000134904443 1417142541 /nfs/dbraw/zinc/14/25/41/1417142541.db2.gz GIJYTBQRVWGDMQ-NFBKMPQASA-N 2 1 383.580 3.219 20 0 GGADMP Cc1nc(CNC(=O)OC(C)(C)C)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000134914569 1417144312 /nfs/dbraw/zinc/14/43/12/1417144312.db2.gz ZJBJIUGEIKSXGV-RDJZCZTQSA-N 2 1 376.545 3.407 20 0 GGADMP C[C@@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000135266510 1417199608 /nfs/dbraw/zinc/19/96/08/1417199608.db2.gz WJLWBRQGVXUPMS-YLJYHZDGSA-N 2 1 394.531 3.271 20 0 GGADMP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(F)cc3Cl)c2)C1 ZINC000136090108 1417291234 /nfs/dbraw/zinc/29/12/34/1417291234.db2.gz BHRQIFAQWSVDNH-GOSISDBHSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(F)cc3Cl)c2)C1 ZINC000136090108 1417291248 /nfs/dbraw/zinc/29/12/48/1417291248.db2.gz BHRQIFAQWSVDNH-GOSISDBHSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(F)cc3Cl)c2)C1 ZINC000136090059 1417291281 /nfs/dbraw/zinc/29/12/81/1417291281.db2.gz BHRQIFAQWSVDNH-SFHVURJKSA-N 2 1 389.902 3.466 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3ccc(F)cc3Cl)c2)C1 ZINC000136090059 1417291286 /nfs/dbraw/zinc/29/12/86/1417291286.db2.gz BHRQIFAQWSVDNH-SFHVURJKSA-N 2 1 389.902 3.466 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1F ZINC000136242798 1417304373 /nfs/dbraw/zinc/30/43/73/1417304373.db2.gz ZXBOWWNMUICKFC-RXVVDRJESA-N 2 1 388.531 3.046 20 0 GGADMP C[NH+](C)Cc1ccc(CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1F ZINC000136242687 1417304575 /nfs/dbraw/zinc/30/45/75/1417304575.db2.gz ZXBOWWNMUICKFC-WIYYLYMNSA-N 2 1 388.531 3.046 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)CC[C@@H]21 ZINC000136376197 1417312367 /nfs/dbraw/zinc/31/23/67/1417312367.db2.gz FFDYWEHTGVGFNE-SQNIBIBYSA-N 2 1 376.570 3.011 20 0 GGADMP CCCOc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)ccc1OC ZINC000136582289 1417329521 /nfs/dbraw/zinc/32/95/21/1417329521.db2.gz LMVJMKANHXFBID-UXHICEINSA-N 2 1 376.541 3.342 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)CC1 ZINC000136745230 1417343428 /nfs/dbraw/zinc/34/34/28/1417343428.db2.gz YZHAURPYADVYRF-RBBKRZOGSA-N 2 1 384.568 3.085 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1)c1ccsc1 ZINC000136810355 1417347284 /nfs/dbraw/zinc/34/72/84/1417347284.db2.gz RPIGETCCQNBPMJ-NZSAHSFTSA-N 2 1 378.586 3.257 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC2CC[NH+](C[C@H]3CCOC3)CC2)cc1)C(C)C ZINC000136816129 1417347694 /nfs/dbraw/zinc/34/76/94/1417347694.db2.gz VFJGPVXMRYDLCN-HXUWFJFHSA-N 2 1 387.568 3.148 20 0 GGADMP C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)CCCOc1ccccc1C(N)=O ZINC000138210686 1417407338 /nfs/dbraw/zinc/40/73/38/1417407338.db2.gz TUJNVGHKIQSJLL-ZSYWTGECSA-N 2 1 375.557 3.289 20 0 GGADMP C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)CCCOc1ccccc1C(N)=O ZINC000138210686 1417407341 /nfs/dbraw/zinc/40/73/41/1417407341.db2.gz TUJNVGHKIQSJLL-ZSYWTGECSA-N 2 1 375.557 3.289 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C)C3)CC[C@H]21 ZINC000139968924 1417483099 /nfs/dbraw/zinc/48/30/99/1417483099.db2.gz YAFGOAGETMJLIC-YCAMKHIRSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C)C3)CC[C@H]21 ZINC000139968924 1417483100 /nfs/dbraw/zinc/48/31/00/1417483100.db2.gz YAFGOAGETMJLIC-YCAMKHIRSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@@H]2C[NH+](CCCCCC[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C)C3)CC[C@H]21 ZINC000139968924 1417483101 /nfs/dbraw/zinc/48/31/01/1417483101.db2.gz YAFGOAGETMJLIC-YCAMKHIRSA-N 4 1 390.660 3.379 20 0 GGADMP CCOc1ccc([C@@H]2CCCN2C(=O)C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000140057464 1417486827 /nfs/dbraw/zinc/48/68/27/1417486827.db2.gz OFHMSTDATVDBJX-FCEUIQTBSA-N 2 1 385.552 3.165 20 0 GGADMP CCOc1ccc([C@@H]2CCCN2C(=O)C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000140057464 1417486830 /nfs/dbraw/zinc/48/68/30/1417486830.db2.gz OFHMSTDATVDBJX-FCEUIQTBSA-N 2 1 385.552 3.165 20 0 GGADMP CCOc1ccc([C@@H]2CCCN2C(=O)C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC000140057464 1417486834 /nfs/dbraw/zinc/48/68/34/1417486834.db2.gz OFHMSTDATVDBJX-FCEUIQTBSA-N 2 1 385.552 3.165 20 0 GGADMP CCOc1ccc([C@@H]2CCCN2C(=O)C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC000140057464 1417486838 /nfs/dbraw/zinc/48/68/38/1417486838.db2.gz OFHMSTDATVDBJX-FCEUIQTBSA-N 2 1 385.552 3.165 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)NCC(C)(C)[NH2+][C@@H](C)c3ccccc3)CC2)c1 ZINC000140399538 1417500885 /nfs/dbraw/zinc/50/08/85/1417500885.db2.gz FTVHCVUMHHUHCW-IBGZPJMESA-N 2 1 395.551 3.351 20 0 GGADMP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)CC1 ZINC000141137656 1417527668 /nfs/dbraw/zinc/52/76/68/1417527668.db2.gz KJUMTHKMNDOHMU-UZKOGDIHSA-N 2 1 384.568 3.338 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000178847919 1429194387 /nfs/dbraw/zinc/19/43/87/1429194387.db2.gz HZWMXZSVUWJROW-HXUWFJFHSA-N 2 1 386.584 3.450 20 0 GGADMP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000178847900 1429194467 /nfs/dbraw/zinc/19/44/67/1429194467.db2.gz GFQCHJMQTWWARX-GMAHTHKFSA-N 2 1 396.579 3.441 20 0 GGADMP C[C@@H]([NH3+])C1CCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000178850939 1429195016 /nfs/dbraw/zinc/19/50/16/1429195016.db2.gz ALEDAURMKTVLSV-BEFAXECRSA-N 2 1 383.458 3.027 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCNC(=S)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000145495964 1417690336 /nfs/dbraw/zinc/69/03/36/1417690336.db2.gz NWCYAJDDWYRHRM-LJQANCHMSA-N 2 1 388.625 3.380 20 0 GGADMP C[C@@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCCC[C@@H]1C ZINC000145588894 1417693223 /nfs/dbraw/zinc/69/32/23/1417693223.db2.gz MOZNFDIAPMOSDD-OALUTQOASA-N 2 1 388.625 3.378 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=S)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000145703116 1417697324 /nfs/dbraw/zinc/69/73/24/1417697324.db2.gz IWALCJUMRMAURU-RTBURBONSA-N 2 1 388.625 3.236 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCC2)CC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000178882987 1429210307 /nfs/dbraw/zinc/21/03/07/1429210307.db2.gz KQCUQLBSQJIHPO-DENIHFKCSA-N 2 1 388.600 3.299 20 0 GGADMP O=C(NC1CC[NH+](CC2CCCC2)CC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000178882998 1429210509 /nfs/dbraw/zinc/21/05/09/1429210509.db2.gz KQCUQLBSQJIHPO-KNQAVFIVSA-N 2 1 388.600 3.299 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2F)C1 ZINC000150768580 1417803475 /nfs/dbraw/zinc/80/34/75/1417803475.db2.gz YIAWGPRFHFCMEZ-KRWDZBQOSA-N 2 1 396.526 3.016 20 0 GGADMP C[C@H]1CCc2c(sc3nc(CC[N@@H+]4CC[C@H](C[NH+]5CCCC5)C4)nc(N)c23)C1 ZINC000150778215 1417805326 /nfs/dbraw/zinc/80/53/26/1417805326.db2.gz GCYQOZXXWMJNEP-JKSUJKDBSA-N 2 1 399.608 3.359 20 0 GGADMP C[C@H]1CCc2c(sc3nc(CC[N@H+]4CC[C@H](C[NH+]5CCCC5)C4)nc(N)c23)C1 ZINC000150778215 1417805327 /nfs/dbraw/zinc/80/53/27/1417805327.db2.gz GCYQOZXXWMJNEP-JKSUJKDBSA-N 2 1 399.608 3.359 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[C@H]([NH+]4CCCC4)CC3)cc2)C[C@@H](C)O1 ZINC000150841562 1417818108 /nfs/dbraw/zinc/81/81/08/1417818108.db2.gz COXUXSOREQIGTG-VIZSFHNOSA-N 2 1 399.579 3.386 20 0 GGADMP CC[NH+]1CCC(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000151424296 1417962064 /nfs/dbraw/zinc/96/20/64/1417962064.db2.gz COOLWBDBEUXYPP-IRLDBZIGSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H]1C[NH+](CCC2CC[NH+](Cc3csc(N(C)C4CC4)n3)CC2)C[C@H](C)O1 ZINC000151527706 1418013830 /nfs/dbraw/zinc/01/38/30/1418013830.db2.gz GIPJAQWPHXGHSH-IRXDYDNUSA-N 2 1 392.613 3.453 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000151667106 1418055300 /nfs/dbraw/zinc/05/53/00/1418055300.db2.gz VLZGKGXVUUMCKF-DNVJHFABSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000151667106 1418055310 /nfs/dbraw/zinc/05/53/10/1418055310.db2.gz VLZGKGXVUUMCKF-DNVJHFABSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000151667106 1418055317 /nfs/dbraw/zinc/05/53/17/1418055317.db2.gz VLZGKGXVUUMCKF-DNVJHFABSA-N 2 1 398.595 3.414 20 0 GGADMP C[NH+]1CCC(CCNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000151687023 1418060832 /nfs/dbraw/zinc/06/08/32/1418060832.db2.gz SUKIFMQYJHYGLL-XZOQPEGZSA-N 2 1 398.595 3.414 20 0 GGADMP C[NH+]1CCC(CCNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000151686881 1418060901 /nfs/dbraw/zinc/06/09/01/1418060901.db2.gz SUKIFMQYJHYGLL-DHIUTWEWSA-N 2 1 398.595 3.414 20 0 GGADMP C[NH+]1CCC(CCNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CC1 ZINC000151687093 1418061330 /nfs/dbraw/zinc/06/13/30/1418061330.db2.gz SUKIFMQYJHYGLL-GOTSBHOMSA-N 2 1 398.595 3.414 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[NH+]1C1CCOCC1 ZINC000152097512 1418144710 /nfs/dbraw/zinc/14/47/10/1418144710.db2.gz ASBJPQRNFCQCEB-GMAHTHKFSA-N 2 1 399.579 3.000 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[N@@H+]1C1CCOCC1 ZINC000152097512 1418144715 /nfs/dbraw/zinc/14/47/15/1418144715.db2.gz ASBJPQRNFCQCEB-GMAHTHKFSA-N 2 1 399.579 3.000 20 0 GGADMP CCN(C[C@H]1CC[NH+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[N@H+]1C1CCOCC1 ZINC000152097512 1418144720 /nfs/dbraw/zinc/14/47/20/1418144720.db2.gz ASBJPQRNFCQCEB-GMAHTHKFSA-N 2 1 399.579 3.000 20 0 GGADMP CS[C@H]1CCCC[N@@H+](CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)C1 ZINC000179111121 1429265607 /nfs/dbraw/zinc/26/56/07/1429265607.db2.gz GAYRYKYPNIZQET-NRFANRHFSA-N 2 1 389.609 3.293 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H](O)COc1ccccc1F ZINC000179388345 1429354066 /nfs/dbraw/zinc/35/40/66/1429354066.db2.gz RAOVRWLLLSQORC-FQEVSTJZSA-N 2 1 387.499 3.199 20 0 GGADMP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc2ccsc2c(=O)[nH]1 ZINC000179390436 1429355190 /nfs/dbraw/zinc/35/51/90/1429355190.db2.gz RICXGMYXZMSXEL-UHFFFAOYSA-N 2 1 383.521 3.118 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc2ccsc2c(=O)[nH]1 ZINC000179390436 1429355193 /nfs/dbraw/zinc/35/51/93/1429355193.db2.gz RICXGMYXZMSXEL-UHFFFAOYSA-N 2 1 383.521 3.118 20 0 GGADMP Cc1ccccc1OC[C@@H](O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179394197 1429357325 /nfs/dbraw/zinc/35/73/25/1429357325.db2.gz VYKLPHJABKIXOT-QFIPXVFZSA-N 2 1 383.536 3.368 20 0 GGADMP Cc1ccccc1OC[C@H](O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179394187 1429357424 /nfs/dbraw/zinc/35/74/24/1429357424.db2.gz VYKLPHJABKIXOT-JOCHJYFZSA-N 2 1 383.536 3.368 20 0 GGADMP CC(=O)c1ccccc1NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179396365 1429358257 /nfs/dbraw/zinc/35/82/57/1429358257.db2.gz ACRLMMIVJNMSII-UHFFFAOYSA-N 2 1 394.519 3.461 20 0 GGADMP CC(=O)c1ccccc1NC(=O)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179396365 1429358264 /nfs/dbraw/zinc/35/82/64/1429358264.db2.gz ACRLMMIVJNMSII-UHFFFAOYSA-N 2 1 394.519 3.461 20 0 GGADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H](O)COc1ccc(F)cc1 ZINC000179396756 1429358384 /nfs/dbraw/zinc/35/83/84/1429358384.db2.gz YYISDOOTRLZLGD-OAQYLSRUSA-N 2 1 387.499 3.199 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1nc2c(s1)CCCC2 ZINC000179421791 1429368849 /nfs/dbraw/zinc/36/88/49/1429368849.db2.gz IJQBDRFBSRHIHD-HNNXBMFYSA-N 2 1 386.565 3.164 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]2CCC[C@@H]2c2ccncc2)CC1 ZINC000179569249 1429440267 /nfs/dbraw/zinc/44/02/67/1429440267.db2.gz BNEIZVHRUZVHOI-HSZRJFAPSA-N 2 1 392.547 3.308 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@@H]2c2ccncc2)CC1 ZINC000179569249 1429440272 /nfs/dbraw/zinc/44/02/72/1429440272.db2.gz BNEIZVHRUZVHOI-HSZRJFAPSA-N 2 1 392.547 3.308 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](C[C@H]2CN(c3ccccc3)C(=O)O2)CC1 ZINC000179679397 1429503684 /nfs/dbraw/zinc/50/36/84/1429503684.db2.gz LJKJEOZWXGNFNP-NRFANRHFSA-N 2 1 389.540 3.082 20 0 GGADMP COCC[N@@H+](C)CCCC1CCN(C(=O)Nc2cccc(C[NH+](C)C)c2)CC1 ZINC000179683850 1429505913 /nfs/dbraw/zinc/50/59/13/1429505913.db2.gz DDXDUJLWDZFUAT-UHFFFAOYSA-N 2 1 390.572 3.351 20 0 GGADMP COC(=O)[C@@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)c1cccnc1 ZINC000152329713 1422074522 /nfs/dbraw/zinc/07/45/22/1422074522.db2.gz DCJMNPWGHISKTF-NRFANRHFSA-N 2 1 382.508 3.186 20 0 GGADMP C[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C[C@@H]1n1ccnc1 ZINC000152552346 1422140327 /nfs/dbraw/zinc/14/03/27/1422140327.db2.gz RUNHMXXMPZFJTO-UTKZUKDTSA-N 2 1 399.514 3.279 20 0 GGADMP Cc1[nH+]ccn1CCCN(C)C(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000152771014 1422242978 /nfs/dbraw/zinc/24/29/78/1422242978.db2.gz VICNWMPKSVZOOW-UHFFFAOYSA-N 2 1 375.561 3.266 20 0 GGADMP Cc1cccc(OC[C@H](O)C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)c1 ZINC000152890330 1422284819 /nfs/dbraw/zinc/28/48/19/1422284819.db2.gz QZBJSQQHDOFYFA-JOCHJYFZSA-N 2 1 386.511 3.171 20 0 GGADMP Cc1cc(-c2nnc(C[NH+]3CCC(C[NH+]4C[C@@H](C)O[C@H](C)C4)CC3)o2)c(C)o1 ZINC000153461393 1422549804 /nfs/dbraw/zinc/54/98/04/1422549804.db2.gz ULIKHPLKLUDNAN-HZPDHXFCSA-N 2 1 388.512 3.268 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1)c1ccc([S@](C)=O)cc1 ZINC000153487156 1422565627 /nfs/dbraw/zinc/56/56/27/1422565627.db2.gz QESQADOWLYQQCG-SORZYCEUSA-N 2 1 386.561 3.496 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1)c1ccc([S@](C)=O)cc1 ZINC000153487156 1422565639 /nfs/dbraw/zinc/56/56/39/1422565639.db2.gz QESQADOWLYQQCG-SORZYCEUSA-N 2 1 386.561 3.496 20 0 GGADMP Cc1c(C(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)cnn1-c1cc[nH+]cc1 ZINC000153527200 1422587081 /nfs/dbraw/zinc/58/70/81/1422587081.db2.gz DMYBCGZNZCIWRT-NRFANRHFSA-N 2 1 389.503 3.312 20 0 GGADMP Cc1c(C(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cnn1-c1cc[nH+]cc1 ZINC000153527200 1422587088 /nfs/dbraw/zinc/58/70/88/1422587088.db2.gz DMYBCGZNZCIWRT-NRFANRHFSA-N 2 1 389.503 3.312 20 0 GGADMP CC[N@H+]1CCCN(C(=O)NC[C@H]2CC[NH+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000153565338 1422620742 /nfs/dbraw/zinc/62/07/42/1422620742.db2.gz VRZLCGLRWGOGQA-VQIMIIECSA-N 2 1 396.938 3.209 20 0 GGADMP CC[NH+]1CCCN(C(=O)NC[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000153565338 1422620758 /nfs/dbraw/zinc/62/07/58/1422620758.db2.gz VRZLCGLRWGOGQA-VQIMIIECSA-N 2 1 396.938 3.209 20 0 GGADMP CC[NH+]1CCCN(C(=O)NC[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000153565338 1422620766 /nfs/dbraw/zinc/62/07/66/1422620766.db2.gz VRZLCGLRWGOGQA-VQIMIIECSA-N 2 1 396.938 3.209 20 0 GGADMP CC1CC[NH+](CC(=O)Nc2ccnn2[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000153642276 1422670153 /nfs/dbraw/zinc/67/01/53/1422670153.db2.gz YPXOFSIRCJASAM-FQEVSTJZSA-N 2 1 381.524 3.001 20 0 GGADMP CC1CC[NH+](CC(=O)Nc2ccnn2[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000153642276 1422670181 /nfs/dbraw/zinc/67/01/81/1422670181.db2.gz YPXOFSIRCJASAM-FQEVSTJZSA-N 2 1 381.524 3.001 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](CCC(=O)Nc2ccccc2Cl)CC1 ZINC000153926555 1422812107 /nfs/dbraw/zinc/81/21/07/1422812107.db2.gz SINJZUPKHMUTQX-HDICACEKSA-N 2 1 392.975 3.159 20 0 GGADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](CCC(=O)Nc2ccccc2Cl)CC1 ZINC000153926555 1422812108 /nfs/dbraw/zinc/81/21/08/1422812108.db2.gz SINJZUPKHMUTQX-HDICACEKSA-N 2 1 392.975 3.159 20 0 GGADMP CC(C)[NH+]1CCC(C(=O)N[C@H]2CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)CC1 ZINC000153961143 1422817730 /nfs/dbraw/zinc/81/77/30/1422817730.db2.gz DKWBKFLVUBSTEB-IBGZPJMESA-N 2 1 393.959 3.247 20 0 GGADMP CCCOc1ccc(OCC[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)cc1 ZINC000154036042 1422829683 /nfs/dbraw/zinc/82/96/83/1422829683.db2.gz JXHWEZVMJVAZPA-SFTDATJTSA-N 2 1 389.584 3.345 20 0 GGADMP CCCOc1ccc(OCC[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000154035970 1422829719 /nfs/dbraw/zinc/82/97/19/1422829719.db2.gz JXHWEZVMJVAZPA-OYRHEFFESA-N 2 1 389.584 3.345 20 0 GGADMP CCCOc1ccc(OCC[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000154035970 1422829721 /nfs/dbraw/zinc/82/97/21/1422829721.db2.gz JXHWEZVMJVAZPA-OYRHEFFESA-N 2 1 389.584 3.345 20 0 GGADMP CCCOc1ccc(OCC[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)cc1 ZINC000154036150 1422829802 /nfs/dbraw/zinc/82/98/02/1422829802.db2.gz JXHWEZVMJVAZPA-NHCUHLMSSA-N 2 1 389.584 3.345 20 0 GGADMP CC[C@H]1CCCC[N@H+]1CCNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000154089752 1422839014 /nfs/dbraw/zinc/83/90/14/1422839014.db2.gz BPAPXLZQKJFJCQ-SFHVURJKSA-N 2 1 376.545 3.150 20 0 GGADMP O=C(NC[C@@H]1CCCO1)c1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000154201329 1422854136 /nfs/dbraw/zinc/85/41/36/1422854136.db2.gz NNPXVUXBFFWNDM-QHCPKHFHSA-N 2 1 399.579 3.482 20 0 GGADMP Cc1ccc(NC(=O)N2CC[NH+](Cc3ccccc3)CC2)c(OCC[NH+](C)C)c1 ZINC000154661203 1422989406 /nfs/dbraw/zinc/98/94/06/1422989406.db2.gz PSCHQTUJTLFSMV-UHFFFAOYSA-N 2 1 396.535 3.285 20 0 GGADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCC(=O)Nc3ccc4c(c3)OCO4)C2)CC1 ZINC000154709853 1423008926 /nfs/dbraw/zinc/00/89/26/1423008926.db2.gz PXQFBEAKFYKPLA-SFHVURJKSA-N 2 1 387.524 3.188 20 0 GGADMP COCC[NH+]1CCC([NH2+]C2CCN(Cc3c(F)cccc3Cl)CC2)CC1 ZINC000154889166 1423069456 /nfs/dbraw/zinc/06/94/56/1423069456.db2.gz YLHQMGIGZUFRGQ-UHFFFAOYSA-N 2 1 383.939 3.144 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)[C@@H]1C[NH+](C)CCO1 ZINC000155013403 1423115618 /nfs/dbraw/zinc/11/56/18/1423115618.db2.gz UBLFWBYXCUYAID-UTKZUKDTSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[N@@H+](C)C1CCCCC1)[C@@H]1C[NH+](C)CCO1 ZINC000155013403 1423115630 /nfs/dbraw/zinc/11/56/30/1423115630.db2.gz UBLFWBYXCUYAID-UTKZUKDTSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@@H]1C[N@H+](C)CCO1 ZINC000155013403 1423115643 /nfs/dbraw/zinc/11/56/43/1423115643.db2.gz UBLFWBYXCUYAID-UTKZUKDTSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@@H](NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@@H]1C[N@@H+](C)CCO1 ZINC000155013403 1423115651 /nfs/dbraw/zinc/11/56/51/1423115651.db2.gz UBLFWBYXCUYAID-UTKZUKDTSA-N 2 1 388.556 3.292 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cn(C)nc3-c3cccs3)CC2)C[C@H](C)O1 ZINC000179884271 1429624512 /nfs/dbraw/zinc/62/45/12/1429624512.db2.gz YFUHJZKMZGYSOE-CALCHBBNSA-N 2 1 388.581 3.470 20 0 GGADMP CCN(CC)[C@@H](CNC(=O)C[C@H]1CN(Cc2ccccc2)CCO1)c1ccco1 ZINC000155411580 1423352972 /nfs/dbraw/zinc/35/29/72/1423352972.db2.gz RHDWLSVVHNWJPP-SFTDATJTSA-N 2 1 399.535 3.070 20 0 GGADMP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC000155619093 1423449616 /nfs/dbraw/zinc/44/96/16/1423449616.db2.gz CGVUYZOKSYEPQE-UYAOXDASSA-N 2 1 384.568 3.378 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCCN1CCN(c2cccc(Cl)c2)CC1 ZINC000155700194 1423493662 /nfs/dbraw/zinc/49/36/62/1423493662.db2.gz FWZWWJUSJFZVJW-DBXWQHBBSA-N 2 1 378.992 3.170 20 0 GGADMP C[C@H]1C[C@H](N(C)C(=O)NC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000155793218 1423536923 /nfs/dbraw/zinc/53/69/23/1423536923.db2.gz FTDUKCZZFLUKPU-PGRDOPGGSA-N 2 1 384.568 3.308 20 0 GGADMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cc1 ZINC000156228173 1423735678 /nfs/dbraw/zinc/73/56/78/1423735678.db2.gz ZEWYQHKGELXWDL-MSOLQXFVSA-N 2 1 389.565 3.156 20 0 GGADMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)cc1 ZINC000156228173 1423735688 /nfs/dbraw/zinc/73/56/88/1423735688.db2.gz ZEWYQHKGELXWDL-MSOLQXFVSA-N 2 1 389.565 3.156 20 0 GGADMP CC[C@@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2ccccc2C1 ZINC000156311489 1423771671 /nfs/dbraw/zinc/77/16/71/1423771671.db2.gz NZJIEYDJJOQPFB-GOTSBHOMSA-N 2 1 398.595 3.483 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nc(C)[nH+]1 ZINC000156595601 1423833869 /nfs/dbraw/zinc/83/38/69/1423833869.db2.gz WUCRWGMATYOJQP-GOSISDBHSA-N 2 1 389.544 3.051 20 0 GGADMP O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000156791653 1423865779 /nfs/dbraw/zinc/86/57/79/1423865779.db2.gz WOWMRZDZTQQHJO-VXKWHMMOSA-N 2 1 384.568 3.311 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000156815109 1423869421 /nfs/dbraw/zinc/86/94/21/1423869421.db2.gz TZYMBBITQKCWLI-YADHBBJMSA-N 2 1 380.536 3.485 20 0 GGADMP Cc1[nH+]ccn1CCCC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000156815109 1423869423 /nfs/dbraw/zinc/86/94/23/1423869423.db2.gz TZYMBBITQKCWLI-YADHBBJMSA-N 2 1 380.536 3.485 20 0 GGADMP COc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c1)CC2 ZINC000156906765 1423883613 /nfs/dbraw/zinc/88/36/13/1423883613.db2.gz LEXPZHGVMGDJJZ-NZQKXSOJSA-N 2 1 393.531 3.170 20 0 GGADMP COc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156912397 1423884806 /nfs/dbraw/zinc/88/48/06/1423884806.db2.gz QYARVZZTFRQYJO-PXNSSMCTSA-N 2 1 381.520 3.243 20 0 GGADMP Cc1ccccc1C[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156929822 1423888306 /nfs/dbraw/zinc/88/83/06/1423888306.db2.gz FQOJYTPZADVCOU-CVDCTZTESA-N 2 1 379.548 3.413 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCCOc4ccccc43)c2)C1 ZINC000156932194 1423888892 /nfs/dbraw/zinc/88/88/92/1423888892.db2.gz ZFZWHEXJTSKSBC-UNMCSNQZSA-N 2 1 393.531 3.387 20 0 GGADMP CC[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000156936104 1423889708 /nfs/dbraw/zinc/88/97/08/1423889708.db2.gz NQPSGAFHRKGXFV-GOTSBHOMSA-N 2 1 379.548 3.495 20 0 GGADMP CC[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@@H](COc3ccccc3Cl)C2)CC1 ZINC000157068896 1423917261 /nfs/dbraw/zinc/91/72/61/1423917261.db2.gz KGUVXRBTUVCOAH-QGZVFWFLSA-N 2 1 393.959 3.031 20 0 GGADMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)NCCC[N@H+]2CCCC[C@H]2C)CC1 ZINC000157289124 1423976295 /nfs/dbraw/zinc/97/62/95/1423976295.db2.gz VFJZHXKYTFVWFX-MOPGFXCFSA-N 2 1 387.572 3.171 20 0 GGADMP O=C(CC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)Nc1ccc(N2CCCC2=O)cc1 ZINC000157403815 1424003977 /nfs/dbraw/zinc/00/39/77/1424003977.db2.gz IHFWJDFLPPKUAE-HXUWFJFHSA-N 2 1 398.551 3.092 20 0 GGADMP O=C(CC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)Nc1ccc(N2CCCC2=O)cc1 ZINC000157403656 1424004077 /nfs/dbraw/zinc/00/40/77/1424004077.db2.gz IHFWJDFLPPKUAE-FQEVSTJZSA-N 2 1 398.551 3.092 20 0 GGADMP CC[NH+]1CCC([N@H+](C)CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)CC1 ZINC000157476302 1424019232 /nfs/dbraw/zinc/01/92/32/1424019232.db2.gz RSJBEXNXZDRHBH-UHFFFAOYSA-N 2 1 383.540 3.234 20 0 GGADMP CC[NH+]1CCC([N@@H+](C)CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)CC1 ZINC000157476302 1424019235 /nfs/dbraw/zinc/01/92/35/1424019235.db2.gz RSJBEXNXZDRHBH-UHFFFAOYSA-N 2 1 383.540 3.234 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]CCCOCC3CCOCC3)CC2)cc1 ZINC000157486807 1424021868 /nfs/dbraw/zinc/02/18/68/1424021868.db2.gz FPHKJQSIJWFUSD-UHFFFAOYSA-N 2 1 378.532 3.256 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000157706198 1424069554 /nfs/dbraw/zinc/06/95/54/1424069554.db2.gz HTQVOWVWYPXBRJ-MRXNPFEDSA-N 2 1 382.936 3.228 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1N1CCCC1 ZINC000157754761 1424080853 /nfs/dbraw/zinc/08/08/53/1424080853.db2.gz RRIUAIQGWKIQPH-IBGZPJMESA-N 2 1 387.572 3.167 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(OC(F)F)c1 ZINC000157896154 1424115248 /nfs/dbraw/zinc/11/52/48/1424115248.db2.gz SPSZRIIVSVOGAK-INIZCTEOSA-N 2 1 384.471 3.168 20 0 GGADMP CCC(CC)[C@@H](CNC(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)[NH+](C)C ZINC000158038436 1424145026 /nfs/dbraw/zinc/14/50/26/1424145026.db2.gz FFPGATMURORXNC-OAQYLSRUSA-N 2 1 390.572 3.049 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2c(c1)OC(C)(C)O2 ZINC000158070153 1424156714 /nfs/dbraw/zinc/15/67/14/1424156714.db2.gz OQCGSGGKVLPVJX-KRWDZBQOSA-N 2 1 390.528 3.074 20 0 GGADMP C[N@H+](Cc1ccccc1)CC1CC[NH+]([C@@H]2CCCN(CC(F)(F)F)C2=O)CC1 ZINC000158142623 1424177750 /nfs/dbraw/zinc/17/77/50/1424177750.db2.gz ICRHJDZWXULDRI-LJQANCHMSA-N 2 1 397.485 3.384 20 0 GGADMP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000158143353 1424177914 /nfs/dbraw/zinc/17/79/14/1424177914.db2.gz NKNTVYUTAUOOGC-YZGWKJHDSA-N 2 1 386.540 3.075 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1c(C)cccc1OC(F)F ZINC000158177794 1424187643 /nfs/dbraw/zinc/18/76/43/1424187643.db2.gz LLZXJPAJDYWKCD-MRXNPFEDSA-N 2 1 398.498 3.476 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(N(C)C(C)C)c1 ZINC000158194089 1424191800 /nfs/dbraw/zinc/19/18/00/1424191800.db2.gz CQZJTGAUTHKEME-OAQYLSRUSA-N 2 1 389.588 3.411 20 0 GGADMP COc1ccccc1[C@H]1CCC[N@@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000158245920 1424206702 /nfs/dbraw/zinc/20/67/02/1424206702.db2.gz HPDUNJFCNPXWHT-RTWAWAEBSA-N 2 1 381.520 3.251 20 0 GGADMP COc1ccccc1[C@H]1CCC[N@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000158245920 1424206713 /nfs/dbraw/zinc/20/67/13/1424206713.db2.gz HPDUNJFCNPXWHT-RTWAWAEBSA-N 2 1 381.520 3.251 20 0 GGADMP Oc1ccccc1N1CC[NH+](Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000158559255 1424288692 /nfs/dbraw/zinc/28/86/92/1424288692.db2.gz XIPFVJHERSGFCI-UHFFFAOYSA-N 2 1 381.520 3.189 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)cc1F ZINC000158640637 1424308185 /nfs/dbraw/zinc/30/81/85/1424308185.db2.gz OMCNIZKXSDHRGJ-GOSISDBHSA-N 2 1 387.503 3.097 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)cc1F ZINC000158640637 1424308188 /nfs/dbraw/zinc/30/81/88/1424308188.db2.gz OMCNIZKXSDHRGJ-GOSISDBHSA-N 2 1 387.503 3.097 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)ccc1S(C)(=O)=O ZINC000158658915 1424312080 /nfs/dbraw/zinc/31/20/80/1424312080.db2.gz REAJYQRJCOLVIW-BBWFWOEESA-N 2 1 382.570 3.117 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1S(C)(=O)=O ZINC000158658915 1424312090 /nfs/dbraw/zinc/31/20/90/1424312090.db2.gz REAJYQRJCOLVIW-BBWFWOEESA-N 2 1 382.570 3.117 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)ccc1S(C)(=O)=O ZINC000158659045 1424312287 /nfs/dbraw/zinc/31/22/87/1424312287.db2.gz REAJYQRJCOLVIW-ULQDDVLXSA-N 2 1 382.570 3.117 20 0 GGADMP C[N@@H+]1CCC[C@@H]2C[NH+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@@H]21 ZINC000158747410 1424332912 /nfs/dbraw/zinc/33/29/12/1424332912.db2.gz MNRQHQKEMLIPTP-QUCCMNQESA-N 2 1 375.532 3.369 20 0 GGADMP C[N@H+]1CCC[C@@H]2C[NH+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@@H]21 ZINC000158747410 1424332922 /nfs/dbraw/zinc/33/29/22/1424332922.db2.gz MNRQHQKEMLIPTP-QUCCMNQESA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@H+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@@H]21 ZINC000158747410 1424332932 /nfs/dbraw/zinc/33/29/32/1424332932.db2.gz MNRQHQKEMLIPTP-QUCCMNQESA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+]1CCC[C@@H]2C[N@@H+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@@H]21 ZINC000158747410 1424332937 /nfs/dbraw/zinc/33/29/37/1424332937.db2.gz MNRQHQKEMLIPTP-QUCCMNQESA-N 2 1 375.532 3.369 20 0 GGADMP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C[C@@H](O)C[NH+]2CCC(C)CC2)cc1 ZINC000158863416 1424359471 /nfs/dbraw/zinc/35/94/71/1424359471.db2.gz GYRQIQPKIXXDQM-GHTZIAJQSA-N 2 1 390.572 3.304 20 0 GGADMP Cc1cccc2nc(C[NH+]3CCC(CC[N@@H+]4CCCC[C@@H]4C)CC3)cc(=O)n12 ZINC000158912756 1424370962 /nfs/dbraw/zinc/37/09/62/1424370962.db2.gz JXVCTWWTEVDNLP-SFHVURJKSA-N 2 1 382.552 3.479 20 0 GGADMP COc1ccc2cc(CN(C)C(=O)CN3CC[C@H]4[C@@H](CCC[N@H+]4C)C3)ccc2c1 ZINC000158943403 1424378602 /nfs/dbraw/zinc/37/86/02/1424378602.db2.gz NBHVFJYWTBXLMW-GMAHTHKFSA-N 2 1 395.547 3.223 20 0 GGADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+]([C@@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000159017490 1424397387 /nfs/dbraw/zinc/39/73/87/1424397387.db2.gz XNNRBIPBRIVHQE-DOTOQJQBSA-N 2 1 375.479 3.126 20 0 GGADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+]([C@@H]2CCN(CC(F)(F)F)C2=O)CC1 ZINC000159017490 1424397396 /nfs/dbraw/zinc/39/73/96/1424397396.db2.gz XNNRBIPBRIVHQE-DOTOQJQBSA-N 2 1 375.479 3.126 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](C[C@H](C)c3ccc(OC)cc3)CC2)CC1 ZINC000180073430 1429724918 /nfs/dbraw/zinc/72/49/18/1429724918.db2.gz CPVGLFPDVVAGPC-IBGZPJMESA-N 2 1 387.568 3.065 20 0 GGADMP O[C@H](COCc1ccco1)C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000159207561 1424443070 /nfs/dbraw/zinc/44/30/70/1424443070.db2.gz UHMDJGDCJXDRFC-GIWBLDEGSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000159207561 1424443076 /nfs/dbraw/zinc/44/30/76/1424443076.db2.gz UHMDJGDCJXDRFC-GIWBLDEGSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000159207561 1424443083 /nfs/dbraw/zinc/44/30/83/1424443083.db2.gz UHMDJGDCJXDRFC-GIWBLDEGSA-N 2 1 384.520 3.144 20 0 GGADMP O[C@H](COCc1ccco1)C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000159207561 1424443093 /nfs/dbraw/zinc/44/30/93/1424443093.db2.gz UHMDJGDCJXDRFC-GIWBLDEGSA-N 2 1 384.520 3.144 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+](CN2C[C@H](c3ccccc3)CC2=O)CC1 ZINC000159871143 1424546793 /nfs/dbraw/zinc/54/67/93/1424546793.db2.gz LCXNCAXFNKNZPU-JOCHJYFZSA-N 2 1 387.568 3.030 20 0 GGADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000160264648 1424591290 /nfs/dbraw/zinc/59/12/90/1424591290.db2.gz FDYFWNYQFWHDKC-ROUUACIJSA-N 2 1 379.570 3.142 20 0 GGADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000160264648 1424591297 /nfs/dbraw/zinc/59/12/97/1424591297.db2.gz FDYFWNYQFWHDKC-ROUUACIJSA-N 2 1 379.570 3.142 20 0 GGADMP C[C@H](C[C@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000160477416 1424606499 /nfs/dbraw/zinc/60/64/99/1424606499.db2.gz UIKZPJJKXFVSMI-RTBURBONSA-N 2 1 397.604 3.381 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(N2CCOCC2)cc1Cl ZINC000160683625 1424626421 /nfs/dbraw/zinc/62/64/21/1424626421.db2.gz SSYCNOKMBRZQQB-PKOBYXMFSA-N 2 1 395.975 3.064 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)C1CC[NH+](C(C)C)CC1 ZINC000161597086 1424720561 /nfs/dbraw/zinc/72/05/61/1424720561.db2.gz IDQGXVODNRJPFU-NRFANRHFSA-N 2 1 387.568 3.326 20 0 GGADMP Cc1ccc(NC(=O)COc2ccc(CC[NH2+][C@H]3CC[N@H+](C)C[C@@H]3C)cc2)cc1 ZINC000161733229 1424754474 /nfs/dbraw/zinc/75/44/74/1424754474.db2.gz YEOQYEKYOCEASD-CVDCTZTESA-N 2 1 395.547 3.485 20 0 GGADMP Cc1cc[nH+]c(N2CCN(C(=O)c3oc4ccccc4c3C[NH+](C)C)CC2)c1 ZINC000162103127 1424816565 /nfs/dbraw/zinc/81/65/65/1424816565.db2.gz CZMSWOYWWLBRLJ-UHFFFAOYSA-N 2 1 378.476 3.160 20 0 GGADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)c2ccc(-n3cnnn3)cc2)CC1 ZINC000162162576 1424821240 /nfs/dbraw/zinc/82/12/40/1424821240.db2.gz OHDKAFJNSAKHKF-GOSISDBHSA-N 2 1 376.508 3.286 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]C3CCN(Cc4ccccn4)CC3)CC2)cc1 ZINC000162239728 1424829686 /nfs/dbraw/zinc/82/96/86/1424829686.db2.gz YLLYNOXXZMNXMW-UHFFFAOYSA-N 2 1 396.554 3.482 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@H](C)c3ccc(N4CCOC4=O)cc3)CC2)nc(C)[nH+]1 ZINC000162235436 1424829708 /nfs/dbraw/zinc/82/97/08/1424829708.db2.gz TXKLBKQLAWZVAQ-MRXNPFEDSA-N 2 1 395.507 3.370 20 0 GGADMP C[NH+]1CCC(C(=O)N2CC[NH+](C3c4ccccc4-c4ccccc43)CC2)CC1 ZINC000162252950 1424831531 /nfs/dbraw/zinc/83/15/31/1424831531.db2.gz QBWVHHFZGANPNZ-UHFFFAOYSA-N 2 1 375.516 3.242 20 0 GGADMP C[C@@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(OC(C)(C)C)CC1 ZINC000162508509 1424859874 /nfs/dbraw/zinc/85/98/74/1424859874.db2.gz XMBPFWYHQAHQMW-AZUAARDMSA-N 2 1 387.568 3.045 20 0 GGADMP C[C@@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(OC(C)(C)C)CC1 ZINC000162508509 1424859876 /nfs/dbraw/zinc/85/98/76/1424859876.db2.gz XMBPFWYHQAHQMW-AZUAARDMSA-N 2 1 387.568 3.045 20 0 GGADMP Cc1nc(C[NH+]2CCC(C[NH2+]C3CCN(CC(F)(F)F)CC3)CC2)oc1C ZINC000162731208 1424886495 /nfs/dbraw/zinc/88/64/95/1424886495.db2.gz DZPHHMIBXFYPBW-UHFFFAOYSA-N 2 1 388.478 3.120 20 0 GGADMP C[C@@H]([NH2+]CCCN(C)Cc1ccccc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000162747118 1424887295 /nfs/dbraw/zinc/88/72/95/1424887295.db2.gz KMVPYJGJOCIWNH-MRXNPFEDSA-N 2 1 378.513 3.402 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)ccc1S(C)(=O)=O ZINC000162745732 1424887338 /nfs/dbraw/zinc/88/73/38/1424887338.db2.gz WRHAMNGCHJABAW-KRWDZBQOSA-N 2 1 390.549 3.271 20 0 GGADMP COc1cc([C@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)ccc1S(C)(=O)=O ZINC000162745732 1424887340 /nfs/dbraw/zinc/88/73/40/1424887340.db2.gz WRHAMNGCHJABAW-KRWDZBQOSA-N 2 1 390.549 3.271 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC[N@@H+]1C ZINC000163038827 1424928715 /nfs/dbraw/zinc/92/87/15/1424928715.db2.gz PFEGTEZZRZOAJY-NQIIRXRSSA-N 2 1 397.542 3.120 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)CC[N@H+]1C ZINC000163038827 1424928722 /nfs/dbraw/zinc/92/87/22/1424928722.db2.gz PFEGTEZZRZOAJY-NQIIRXRSSA-N 2 1 397.542 3.120 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccc(-n2cnnn2)c1 ZINC000163219625 1424961341 /nfs/dbraw/zinc/96/13/41/1424961341.db2.gz WZAZGMSGCCAKAI-LQWHRVPQSA-N 2 1 376.508 3.366 20 0 GGADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccc(-n2cnnn2)c1 ZINC000163219625 1424961345 /nfs/dbraw/zinc/96/13/45/1424961345.db2.gz WZAZGMSGCCAKAI-LQWHRVPQSA-N 2 1 376.508 3.366 20 0 GGADMP CCC[NH+]1CCC(NCc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)CC1 ZINC000163933245 1425059571 /nfs/dbraw/zinc/05/95/71/1425059571.db2.gz ONBXHCNLLSPANY-UHFFFAOYSA-N 2 1 389.584 3.140 20 0 GGADMP CCC[NH+]1CCC([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)CC1 ZINC000163933245 1425059581 /nfs/dbraw/zinc/05/95/81/1425059581.db2.gz ONBXHCNLLSPANY-UHFFFAOYSA-N 3 1 389.584 3.140 20 0 GGADMP CCC[NH+]1CCC([NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)CC1 ZINC000163933245 1425059593 /nfs/dbraw/zinc/05/95/93/1425059593.db2.gz ONBXHCNLLSPANY-UHFFFAOYSA-N 3 1 389.584 3.140 20 0 GGADMP CC[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)c1cnn(C)c1 ZINC000163934566 1425059626 /nfs/dbraw/zinc/05/96/26/1425059626.db2.gz ORFJMWZVVXQRSC-JOCHJYFZSA-N 2 1 386.540 3.151 20 0 GGADMP Cc1ncc([C@@H](C)[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)c(C)n1 ZINC000163954728 1425061198 /nfs/dbraw/zinc/06/11/98/1425061198.db2.gz HWCPRFYQFXOQCF-QGZVFWFLSA-N 2 1 398.551 3.434 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000163957256 1425062116 /nfs/dbraw/zinc/06/21/16/1425062116.db2.gz XZXMNKVCDZTIAM-GCJKJVERSA-N 2 1 380.536 3.068 20 0 GGADMP Cn1ncc2c1CCC[C@@H]2[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000163974945 1425064447 /nfs/dbraw/zinc/06/44/47/1425064447.db2.gz DIVHNYAYQGYVFC-QFIPXVFZSA-N 2 1 398.551 3.077 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1)C1CCOCC1 ZINC000163975904 1425064541 /nfs/dbraw/zinc/06/45/41/1425064541.db2.gz FCRPTHDUSAYJEA-GOSISDBHSA-N 2 1 376.541 3.081 20 0 GGADMP COc1cccc2c1OC[C@@H]([NH2+]C1CC[NH+](CCc3ccc(F)cc3)CC1)C2 ZINC000164535408 1425120980 /nfs/dbraw/zinc/12/09/80/1425120980.db2.gz VESODNFXOITYEC-NRFANRHFSA-N 2 1 384.495 3.435 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000164590787 1425126066 /nfs/dbraw/zinc/12/60/66/1425126066.db2.gz OZRASJCDHWHEHH-HTAPYJJXSA-N 2 1 381.520 3.386 20 0 GGADMP COc1ccccc1[C@@H]([NH3+])C(=O)NCc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000164590787 1425126077 /nfs/dbraw/zinc/12/60/77/1425126077.db2.gz OZRASJCDHWHEHH-HTAPYJJXSA-N 2 1 381.520 3.386 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCC2)ccc1S(=O)(=O)C(F)F ZINC000165310225 1425174991 /nfs/dbraw/zinc/17/49/91/1425174991.db2.gz JNWSJZSQGYJWFD-UONOGXRCSA-N 2 1 390.496 3.074 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1NCc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000165587371 1425186424 /nfs/dbraw/zinc/18/64/24/1425186424.db2.gz FYHOVVDUMSIGBQ-JTDSTZFVSA-N 2 1 398.517 3.276 20 0 GGADMP C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)C1CC[NH+](C)CC1 ZINC000165600323 1425187605 /nfs/dbraw/zinc/18/76/05/1425187605.db2.gz LJTDPJVNXJYMOG-INIZCTEOSA-N 2 1 398.517 3.277 20 0 GGADMP Cc1ccc(NC(=O)c2ccc(C[NH3+])cc2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000166189111 1425208506 /nfs/dbraw/zinc/20/85/06/1425208506.db2.gz ONDJNCVFISCCBE-UHFFFAOYSA-N 2 1 380.492 3.130 20 0 GGADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1OCC(=O)N1CCCC1 ZINC000166225319 1425208608 /nfs/dbraw/zinc/20/86/08/1425208608.db2.gz BKKLAVOLGIUKLP-SBHAEUEKSA-N 2 1 385.552 3.355 20 0 GGADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1OCC(=O)N1CCCC1 ZINC000166225319 1425208617 /nfs/dbraw/zinc/20/86/17/1425208617.db2.gz BKKLAVOLGIUKLP-SBHAEUEKSA-N 2 1 385.552 3.355 20 0 GGADMP Clc1ccccc1N1CCN(CCC[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000166317636 1425210980 /nfs/dbraw/zinc/21/09/80/1425210980.db2.gz NYFLIZYQNZQXTQ-RTBURBONSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CCN(CCC[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)c1 ZINC000166535881 1425214155 /nfs/dbraw/zinc/21/41/55/1425214155.db2.gz FUHUPEWWFPNSMZ-TZIWHRDSSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCN[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)c1 ZINC000166535881 1425214166 /nfs/dbraw/zinc/21/41/66/1425214166.db2.gz FUHUPEWWFPNSMZ-TZIWHRDSSA-N 2 1 376.976 3.069 20 0 GGADMP Clc1cccc(N2CC[NH+](CCCN[C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)c1 ZINC000166535881 1425214178 /nfs/dbraw/zinc/21/41/78/1425214178.db2.gz FUHUPEWWFPNSMZ-TZIWHRDSSA-N 2 1 376.976 3.069 20 0 GGADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000167361398 1425225147 /nfs/dbraw/zinc/22/51/47/1425225147.db2.gz SOULHRBMGXRUBT-WWMYMODYSA-N 2 1 381.524 3.222 20 0 GGADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000167361398 1425225156 /nfs/dbraw/zinc/22/51/56/1425225156.db2.gz SOULHRBMGXRUBT-WWMYMODYSA-N 2 1 381.524 3.222 20 0 GGADMP CC(C)[NH+]1CCC([NH2+]Cc2cccc(NC(=O)NCc3ccncc3)c2)CC1 ZINC000167435667 1425226619 /nfs/dbraw/zinc/22/66/19/1425226619.db2.gz ZPQUAXWIIBTHLU-UHFFFAOYSA-N 2 1 381.524 3.366 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)C2(c3ccccc3)CC[NH2+]CC2)CC[N@H+]1Cc1ccccc1 ZINC000167544318 1425227101 /nfs/dbraw/zinc/22/71/01/1425227101.db2.gz BYJBROYEWCWUPE-NFBKMPQASA-N 2 1 391.559 3.477 20 0 GGADMP C[C@H](CC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)C1CC[NH2+]CC1 ZINC000168953719 1425241111 /nfs/dbraw/zinc/24/11/11/1425241111.db2.gz NGAUQFHOXTYNCW-DNVCBOLYSA-N 2 1 397.485 3.422 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[N@H+]3CCCC[C@H]3C)CC2)cs1 ZINC000170693402 1425303301 /nfs/dbraw/zinc/30/33/01/1425303301.db2.gz VQRXDVUCVBILIU-MRXNPFEDSA-N 2 1 378.586 3.044 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)NCCC[N@@H+]3CCCC[C@H]3C)CC2)cs1 ZINC000170693402 1425303305 /nfs/dbraw/zinc/30/33/05/1425303305.db2.gz VQRXDVUCVBILIU-MRXNPFEDSA-N 2 1 378.586 3.044 20 0 GGADMP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)CCCC[NH+]3CCOCC3)cc2)C1 ZINC000170694310 1425303626 /nfs/dbraw/zinc/30/36/26/1425303626.db2.gz QDBOAJMIUHBFDG-FQEVSTJZSA-N 2 1 387.568 3.037 20 0 GGADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)CCCC[NH+]3CCOCC3)cc2)C1 ZINC000170694310 1425303630 /nfs/dbraw/zinc/30/36/30/1425303630.db2.gz QDBOAJMIUHBFDG-FQEVSTJZSA-N 2 1 387.568 3.037 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)CCCC[NH+]1CCOCC1 ZINC000170694406 1425303718 /nfs/dbraw/zinc/30/37/18/1425303718.db2.gz ARSFCCSNIIEYQI-HXUWFJFHSA-N 2 1 387.568 3.180 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)CCCC[NH+]1CCOCC1 ZINC000170694406 1425303724 /nfs/dbraw/zinc/30/37/24/1425303724.db2.gz ARSFCCSNIIEYQI-HXUWFJFHSA-N 2 1 387.568 3.180 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)CC1 ZINC000170756532 1425329234 /nfs/dbraw/zinc/32/92/34/1425329234.db2.gz RYWCBUFOGFNMOT-IBGZPJMESA-N 2 1 380.964 3.459 20 0 GGADMP Cc1ccc(NCCCNC(=O)N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)[nH+]c1 ZINC000170894344 1425383133 /nfs/dbraw/zinc/38/31/33/1425383133.db2.gz HHBPLARWPCZNOS-FQEVSTJZSA-N 2 1 387.572 3.346 20 0 GGADMP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000171153341 1425511963 /nfs/dbraw/zinc/51/19/63/1425511963.db2.gz BLWXULCOQPVEEC-UHFFFAOYSA-N 2 1 394.563 3.338 20 0 GGADMP Cc1cccc(NC(=O)[C@H](C)[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000171304669 1425605765 /nfs/dbraw/zinc/60/57/65/1425605765.db2.gz PGSYYZILSXQECF-NSHGMRRFSA-N 2 1 387.568 3.452 20 0 GGADMP Cc1cccc(NC(=O)[C@H](C)[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000171304669 1425605766 /nfs/dbraw/zinc/60/57/66/1425605766.db2.gz PGSYYZILSXQECF-NSHGMRRFSA-N 2 1 387.568 3.452 20 0 GGADMP C[C@H](C[NH+]1CCCCC1)NC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000171305541 1425605800 /nfs/dbraw/zinc/60/58/00/1425605800.db2.gz UTMGXPQMCLCOIX-HXUWFJFHSA-N 2 1 386.584 3.414 20 0 GGADMP CCc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000171305679 1425606022 /nfs/dbraw/zinc/60/60/22/1425606022.db2.gz LORJHKODUVCHGQ-OTWHNJEPSA-N 2 1 387.568 3.397 20 0 GGADMP CCc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000171305679 1425606029 /nfs/dbraw/zinc/60/60/29/1425606029.db2.gz LORJHKODUVCHGQ-OTWHNJEPSA-N 2 1 387.568 3.397 20 0 GGADMP C[C@@H](CNC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1)C[NH+]1CCCC1 ZINC000171313694 1425612801 /nfs/dbraw/zinc/61/28/01/1425612801.db2.gz XQQAIYNAZFOSEQ-FQEVSTJZSA-N 2 1 386.584 3.272 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)Nc1ccc(N2CCC[NH+](C)CC2)cc1)c1ccccc1 ZINC000171478612 1425699606 /nfs/dbraw/zinc/69/96/06/1425699606.db2.gz VWRREGRRBLYUIW-QFIPXVFZSA-N 2 1 380.536 3.460 20 0 GGADMP CC[NH+](C)[C@H](C(=O)Nc1ccc(N2CCC[N@H+](C)CC2)cc1)c1ccccc1 ZINC000171478612 1425699613 /nfs/dbraw/zinc/69/96/13/1425699613.db2.gz VWRREGRRBLYUIW-QFIPXVFZSA-N 2 1 380.536 3.460 20 0 GGADMP CC[NH+](C)[C@H](C(=O)Nc1ccc(N2CCC[N@@H+](C)CC2)cc1)c1ccccc1 ZINC000171478612 1425699618 /nfs/dbraw/zinc/69/96/18/1425699618.db2.gz VWRREGRRBLYUIW-QFIPXVFZSA-N 2 1 380.536 3.460 20 0 GGADMP CC(C)(C)[NH+]1CCC(NC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000171564821 1425738631 /nfs/dbraw/zinc/73/86/31/1425738631.db2.gz IFEJTKUODVUTPN-HXUWFJFHSA-N 2 1 386.584 3.113 20 0 GGADMP CC(C)[N@@H+]1CCC[C@H](CNC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000171587932 1425748924 /nfs/dbraw/zinc/74/89/24/1425748924.db2.gz RSPNMEVMCNBXIL-APWZRJJASA-N 2 1 380.964 3.362 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000171587932 1425748928 /nfs/dbraw/zinc/74/89/28/1425748928.db2.gz RSPNMEVMCNBXIL-APWZRJJASA-N 2 1 380.964 3.362 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CCC[C@@H]2C[NH+]2CCCC2)cc1F ZINC000171661745 1425780375 /nfs/dbraw/zinc/78/03/75/1425780375.db2.gz DZGAENOCBJPDRM-GOSISDBHSA-N 2 1 385.487 3.090 20 0 GGADMP Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000171689710 1425790204 /nfs/dbraw/zinc/79/02/04/1425790204.db2.gz XEOHJTBVMJKRGG-UHFFFAOYSA-N 2 1 383.540 3.280 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[N@@H+]1CCc2ccccc2C1 ZINC000171761192 1425813502 /nfs/dbraw/zinc/81/35/02/1425813502.db2.gz RTVLWODMYRPATP-LJQANCHMSA-N 2 1 377.532 3.345 20 0 GGADMP C[C@H](C(=O)NCc1ccccc1C[NH+]1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000171761192 1425813503 /nfs/dbraw/zinc/81/35/03/1425813503.db2.gz RTVLWODMYRPATP-LJQANCHMSA-N 2 1 377.532 3.345 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(N2CCC[NH+](C)CC2)cc1)[N@@H+]1CCc2ccccc2C1 ZINC000171864314 1425838118 /nfs/dbraw/zinc/83/81/18/1425838118.db2.gz ZXOCQQDWGZVMIT-IBGZPJMESA-N 2 1 392.547 3.214 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(N2CCC[NH+](C)CC2)cc1)[N@H+]1CCc2ccccc2C1 ZINC000171864314 1425838121 /nfs/dbraw/zinc/83/81/21/1425838121.db2.gz ZXOCQQDWGZVMIT-IBGZPJMESA-N 2 1 392.547 3.214 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(N2CCC[N@H+](C)CC2)cc1)[NH+]1CCc2ccccc2C1 ZINC000171864314 1425838122 /nfs/dbraw/zinc/83/81/22/1425838122.db2.gz ZXOCQQDWGZVMIT-IBGZPJMESA-N 2 1 392.547 3.214 20 0 GGADMP C[C@@H](C(=O)Nc1ccc(N2CCC[N@@H+](C)CC2)cc1)[NH+]1CCc2ccccc2C1 ZINC000171864314 1425838125 /nfs/dbraw/zinc/83/81/25/1425838125.db2.gz ZXOCQQDWGZVMIT-IBGZPJMESA-N 2 1 392.547 3.214 20 0 GGADMP C[C@H](c1ccc(NC(=O)NC2CC[NH+](CC3CC3)CC2)cc1)[NH+]1CCOCC1 ZINC000172250293 1425966571 /nfs/dbraw/zinc/96/65/71/1425966571.db2.gz YBURYBSOBLZMOJ-QGZVFWFLSA-N 2 1 386.540 3.076 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@@H+](C4CCCC4)CC3)cc2)C[C@@H](C)O1 ZINC000172416054 1426033727 /nfs/dbraw/zinc/03/37/27/1426033727.db2.gz NDQDZRVVXJOPFM-WOJBJXKFSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[N@H+](C4CCCC4)CC3)cc2)C[C@@H](C)O1 ZINC000172416054 1426033736 /nfs/dbraw/zinc/03/37/36/1426033736.db2.gz NDQDZRVVXJOPFM-WOJBJXKFSA-N 2 1 399.579 3.386 20 0 GGADMP O=C(CCC[NH+]1CCN(c2ccccc2)CC1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172417688 1426034820 /nfs/dbraw/zinc/03/48/20/1426034820.db2.gz WXUBYHTWDAUKKS-UHFFFAOYSA-N 2 1 398.595 3.066 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CCC[N@H+](C2CCCC2)CC1)c1cccc(F)c1 ZINC000172517813 1426068174 /nfs/dbraw/zinc/06/81/74/1426068174.db2.gz MUFZQUHCYOUWOA-HXUWFJFHSA-N 2 1 376.520 3.088 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@@H+]1CCc2sccc2C1 ZINC000172550477 1426082806 /nfs/dbraw/zinc/08/28/06/1426082806.db2.gz MDUUWDPIZRSPNN-IEBWSBKVSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+]1CCc2sccc2C1 ZINC000172550477 1426082813 /nfs/dbraw/zinc/08/28/13/1426082813.db2.gz MDUUWDPIZRSPNN-IEBWSBKVSA-N 2 1 390.597 3.155 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CC[C@H](C[NH+]4CCCCC4)C3)cc2)C[C@H](C)O1 ZINC000172706878 1426152855 /nfs/dbraw/zinc/15/28/55/1426152855.db2.gz HASPWAMVIYRJLH-RZUBCFFCSA-N 2 1 399.579 3.244 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CC[C@H](C[NH+]4CCCCC4)C3)cc2)C[C@H](C)O1 ZINC000172706878 1426152861 /nfs/dbraw/zinc/15/28/61/1426152861.db2.gz HASPWAMVIYRJLH-RZUBCFFCSA-N 2 1 399.579 3.244 20 0 GGADMP CCCC[NH+]1CCC(NC(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)CC1 ZINC000173137661 1426359586 /nfs/dbraw/zinc/35/95/86/1426359586.db2.gz XRIKTYLPBHEVCC-SFHVURJKSA-N 2 1 388.556 3.466 20 0 GGADMP CCc1nc2cc(NC(=O)N(CC[NH+](C)C)C[C@H]3CCC[N@@H+]3CC)ccc2o1 ZINC000173238575 1426423603 /nfs/dbraw/zinc/42/36/03/1426423603.db2.gz LHCCFKONRGGWTM-QGZVFWFLSA-N 2 1 387.528 3.270 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](C)c1ccc(F)cc1F ZINC000173247801 1426428426 /nfs/dbraw/zinc/42/84/26/1426428426.db2.gz KAWFHBNQZQASNK-RDJZCZTQSA-N 2 1 382.499 3.083 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](C)c1ccc(F)cc1F ZINC000173247783 1426428482 /nfs/dbraw/zinc/42/84/82/1426428482.db2.gz KAWFHBNQZQASNK-DOTOQJQBSA-N 2 1 382.499 3.083 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](C)c1ccc(F)c(F)c1 ZINC000173251712 1426431989 /nfs/dbraw/zinc/43/19/89/1426431989.db2.gz QKVOKFWEVMTRNI-DOTOQJQBSA-N 2 1 382.499 3.083 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](C)c1ccc(F)c(F)c1 ZINC000173251727 1426432041 /nfs/dbraw/zinc/43/20/41/1426432041.db2.gz QKVOKFWEVMTRNI-RDJZCZTQSA-N 2 1 382.499 3.083 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173324960 1426506528 /nfs/dbraw/zinc/50/65/28/1426506528.db2.gz HTKIWSCKUMGWLX-ROUUACIJSA-N 2 1 381.586 3.242 20 0 GGADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173325103 1426507405 /nfs/dbraw/zinc/50/74/05/1426507405.db2.gz IBSBIEDMYHNRCT-MSOLQXFVSA-N 2 1 381.586 3.100 20 0 GGADMP O=C(C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)NCCCCC[NH+]1CCCCC1 ZINC000173327139 1426508814 /nfs/dbraw/zinc/50/88/14/1426508814.db2.gz NUYHMEOYCDQDOV-JOCHJYFZSA-N 2 1 387.568 3.050 20 0 GGADMP O=C(C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)NCCCCC[NH+]1CCCCC1 ZINC000173327139 1426508820 /nfs/dbraw/zinc/50/88/20/1426508820.db2.gz NUYHMEOYCDQDOV-JOCHJYFZSA-N 2 1 387.568 3.050 20 0 GGADMP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1OC ZINC000173335291 1426515917 /nfs/dbraw/zinc/51/59/17/1426515917.db2.gz QGLKAVQHKPHRCU-SFHVURJKSA-N 2 1 383.536 3.302 20 0 GGADMP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000173351272 1426528431 /nfs/dbraw/zinc/52/84/31/1426528431.db2.gz SQODDHSHGQZLKP-PMACEKPBSA-N 2 1 384.524 3.046 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000173351272 1426528444 /nfs/dbraw/zinc/52/84/44/1426528444.db2.gz SQODDHSHGQZLKP-PMACEKPBSA-N 2 1 384.524 3.046 20 0 GGADMP CC1CC[NH+]([C@@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccs2)CC1 ZINC000173402380 1426586162 /nfs/dbraw/zinc/58/61/62/1426586162.db2.gz FLJQJWAVCJWNCY-QYZOEREBSA-N 2 1 390.597 3.399 20 0 GGADMP COc1ccccc1[C@H](CNC(=O)NCCCCn1cc[nH+]c1C)[NH+]1CCCC1 ZINC000173401772 1426586208 /nfs/dbraw/zinc/58/62/08/1426586208.db2.gz RAJPYCBYQVISAO-FQEVSTJZSA-N 2 1 399.539 3.117 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000173415910 1426598624 /nfs/dbraw/zinc/59/86/24/1426598624.db2.gz APEALCAWCLEXEH-MSOLQXFVSA-N 2 1 378.586 3.258 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000173416753 1426599987 /nfs/dbraw/zinc/59/99/87/1426599987.db2.gz JLMMMDIDAMSHSJ-ROUUACIJSA-N 2 1 378.586 3.401 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000173429049 1426610896 /nfs/dbraw/zinc/61/08/96/1426610896.db2.gz NVENRJGOMLTFCS-APWZRJJASA-N 2 1 380.964 3.316 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)C1 ZINC000173429049 1426610902 /nfs/dbraw/zinc/61/09/02/1426610902.db2.gz NVENRJGOMLTFCS-APWZRJJASA-N 2 1 380.964 3.316 20 0 GGADMP Cc1ccc(NC(=O)C[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c(C[NH+](C)C)c1 ZINC000173574854 1426741906 /nfs/dbraw/zinc/74/19/06/1426741906.db2.gz VNGSMRPXQBBRJM-OAQYLSRUSA-N 2 1 381.520 3.286 20 0 GGADMP Cc1ccc(NC(=O)C[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c(C[NH+](C)C)c1 ZINC000173574854 1426741915 /nfs/dbraw/zinc/74/19/15/1426741915.db2.gz VNGSMRPXQBBRJM-OAQYLSRUSA-N 2 1 381.520 3.286 20 0 GGADMP Cc1ccc(NC(=O)C[C@H]2C[N@H+](Cc3ccccc3)CCO2)c(C[NH+](C)C)c1 ZINC000173574864 1426742373 /nfs/dbraw/zinc/74/23/73/1426742373.db2.gz VNGSMRPXQBBRJM-NRFANRHFSA-N 2 1 381.520 3.286 20 0 GGADMP Cc1ccc(NC(=O)C[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c(C[NH+](C)C)c1 ZINC000173574864 1426742377 /nfs/dbraw/zinc/74/23/77/1426742377.db2.gz VNGSMRPXQBBRJM-NRFANRHFSA-N 2 1 381.520 3.286 20 0 GGADMP C(CC[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1)C[NH+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173605267 1426778775 /nfs/dbraw/zinc/77/87/75/1426778775.db2.gz LIUXMIMPQUAWFP-DNQXCXABSA-N 4 1 390.660 3.382 20 0 GGADMP C[C@H](C(=O)N(C)Cc1nc2ccccc2s1)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000173643326 1426807906 /nfs/dbraw/zinc/80/79/06/1426807906.db2.gz BLWQDOYZYAEDTB-SJORKVTESA-N 2 1 388.581 3.449 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC1CCN(c2ccc(C)c[nH+]2)CC1)CC(C)C ZINC000173687641 1426821213 /nfs/dbraw/zinc/82/12/13/1426821213.db2.gz BQNPGDFTHOLSFM-HXUWFJFHSA-N 2 1 389.588 3.415 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)NC1CCN(c2ccc(C)c[nH+]2)CC1)CC(C)C ZINC000173687626 1426821244 /nfs/dbraw/zinc/82/12/44/1426821244.db2.gz BQNPGDFTHOLSFM-FQEVSTJZSA-N 2 1 389.588 3.415 20 0 GGADMP COC(=O)c1ccc(OCC[NH+]2CCC(Cc3[nH+]ccn3C)CC2)c(Cl)c1 ZINC000173692103 1426822468 /nfs/dbraw/zinc/82/24/68/1426822468.db2.gz XYKBRQUHWHMMHS-UHFFFAOYSA-N 2 1 391.899 3.194 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173819233 1426859445 /nfs/dbraw/zinc/85/94/45/1426859445.db2.gz LCYKQLKZFOCKAW-SVFBPWRDSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173819233 1426859446 /nfs/dbraw/zinc/85/94/46/1426859446.db2.gz LCYKQLKZFOCKAW-SVFBPWRDSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173819233 1426859448 /nfs/dbraw/zinc/85/94/48/1426859448.db2.gz LCYKQLKZFOCKAW-SVFBPWRDSA-N 2 1 387.568 3.100 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000173819233 1426859452 /nfs/dbraw/zinc/85/94/52/1426859452.db2.gz LCYKQLKZFOCKAW-SVFBPWRDSA-N 2 1 387.568 3.100 20 0 GGADMP C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000173868203 1426876166 /nfs/dbraw/zinc/87/61/66/1426876166.db2.gz BKZXWMDXQMDSAK-HNNXBMFYSA-N 2 1 390.915 3.495 20 0 GGADMP O[C@@H](COc1cccc(C(F)(F)F)c1)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173872128 1426877713 /nfs/dbraw/zinc/87/77/13/1426877713.db2.gz SXLCWGUWOSLIPC-SJLPKXTDSA-N 2 1 386.458 3.253 20 0 GGADMP O[C@@H](COc1cccc(C(F)(F)F)c1)C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173872128 1426877715 /nfs/dbraw/zinc/87/77/15/1426877715.db2.gz SXLCWGUWOSLIPC-SJLPKXTDSA-N 2 1 386.458 3.253 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NCC[NH+]1CCCCC1 ZINC000173899656 1426885010 /nfs/dbraw/zinc/88/50/10/1426885010.db2.gz OXJONEYNKRYWGM-UHFFFAOYSA-N 2 1 384.524 3.197 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)NCC[NH+]1CCCCC1 ZINC000173899656 1426885011 /nfs/dbraw/zinc/88/50/11/1426885011.db2.gz OXJONEYNKRYWGM-UHFFFAOYSA-N 2 1 384.524 3.197 20 0 GGADMP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000173906187 1426887251 /nfs/dbraw/zinc/88/72/51/1426887251.db2.gz VMVGMAQIALBXEH-PMACEKPBSA-N 2 1 384.520 3.492 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000173906187 1426887253 /nfs/dbraw/zinc/88/72/53/1426887253.db2.gz VMVGMAQIALBXEH-PMACEKPBSA-N 2 1 384.520 3.492 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000173906187 1426887254 /nfs/dbraw/zinc/88/72/54/1426887254.db2.gz VMVGMAQIALBXEH-PMACEKPBSA-N 2 1 384.520 3.492 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1 ZINC000173906187 1426887258 /nfs/dbraw/zinc/88/72/58/1426887258.db2.gz VMVGMAQIALBXEH-PMACEKPBSA-N 2 1 384.520 3.492 20 0 GGADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)Nc1ccn(CC[NH+](C)C)n1 ZINC000173912974 1426889967 /nfs/dbraw/zinc/88/99/67/1426889967.db2.gz SSUFHFFIUKSDSD-SFHVURJKSA-N 2 1 398.555 3.141 20 0 GGADMP CCc1ccc(-c2noc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)n2)cc1 ZINC000173947620 1426905189 /nfs/dbraw/zinc/90/51/89/1426905189.db2.gz FCACILXXFOAKFS-UHFFFAOYSA-N 2 1 384.524 3.376 20 0 GGADMP CCC[C@@H](NC(=O)C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000173948886 1426905547 /nfs/dbraw/zinc/90/55/47/1426905547.db2.gz ANFJBBYFTDQVCH-JOCHJYFZSA-N 2 1 387.568 3.221 20 0 GGADMP C[C@@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173955112 1426908098 /nfs/dbraw/zinc/90/80/98/1426908098.db2.gz CXZQUWDZXTYMLI-INIZCTEOSA-N 2 1 379.932 3.244 20 0 GGADMP O=C(C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)Nc1ccccc1C(F)(F)F ZINC000173955024 1426908240 /nfs/dbraw/zinc/90/82/40/1426908240.db2.gz LDAURZIUQVCYHC-UHFFFAOYSA-N 2 1 399.457 3.221 20 0 GGADMP O=C1[C@H]([NH+]2CCC(OCC[NH+]3CCCC3)CC2)CCN1c1ccc(Cl)cc1 ZINC000173958600 1426910096 /nfs/dbraw/zinc/91/00/96/1426910096.db2.gz FRZISGCTNYTQJL-HXUWFJFHSA-N 2 1 391.943 3.022 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccccn2)CC1)[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000174017784 1426945876 /nfs/dbraw/zinc/94/58/76/1426945876.db2.gz FPCLDPUAZNTOII-HSZRJFAPSA-N 2 1 392.547 3.217 20 0 GGADMP C[NH+](C)CC(=O)Nc1ccc(NC(=O)c2oc3ccccc3c2C[NH+](C)C)cc1 ZINC000174103313 1427003341 /nfs/dbraw/zinc/00/33/41/1427003341.db2.gz MJMKKHWWGFEELF-UHFFFAOYSA-N 2 1 394.475 3.247 20 0 GGADMP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000174119202 1427009776 /nfs/dbraw/zinc/00/97/76/1427009776.db2.gz PYEOEXYQJXCAOF-NRFANRHFSA-N 2 1 390.547 3.306 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)c1ccccc1Cl ZINC000174119542 1427010368 /nfs/dbraw/zinc/01/03/68/1427010368.db2.gz BPGAXQTUATXXNG-LPHOPBHVSA-N 2 1 378.948 3.070 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](C)CCc2cccs2)CC1 ZINC000174152683 1427023366 /nfs/dbraw/zinc/02/33/66/1427023366.db2.gz PTHLFGAQPOHNLS-UHFFFAOYSA-N 2 1 385.577 3.312 20 0 GGADMP CCCC[C@H](C(=O)Nc1cc(C)on1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174240955 1427065776 /nfs/dbraw/zinc/06/57/76/1427065776.db2.gz DMMYHXPQDNDDSP-LJQANCHMSA-N 2 1 392.544 3.057 20 0 GGADMP CSc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174241335 1427065852 /nfs/dbraw/zinc/06/58/52/1427065852.db2.gz FJJDRJSCAQMNRD-KRWDZBQOSA-N 2 1 391.581 3.312 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]2CCS[C@@H](C(C)C)C2)CC1 ZINC000174330168 1427104921 /nfs/dbraw/zinc/10/49/21/1427104921.db2.gz TVHOGQRULBBXJV-OAQYLSRUSA-N 2 1 389.609 3.149 20 0 GGADMP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2CCS[C@@H](C(C)C)C2)CC1 ZINC000174330168 1427104928 /nfs/dbraw/zinc/10/49/28/1427104928.db2.gz TVHOGQRULBBXJV-OAQYLSRUSA-N 2 1 389.609 3.149 20 0 GGADMP CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000174335599 1427107640 /nfs/dbraw/zinc/10/76/40/1427107640.db2.gz PWJICHCDRKNZFZ-ZWKOTPCHSA-N 2 1 385.487 3.088 20 0 GGADMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000174335599 1427107648 /nfs/dbraw/zinc/10/76/48/1427107648.db2.gz PWJICHCDRKNZFZ-ZWKOTPCHSA-N 2 1 385.487 3.088 20 0 GGADMP C[N@H+](CCOc1cccc(C[NH2+]Cc2cn3ccccc3n2)c1)C1CCOCC1 ZINC000174344273 1427112149 /nfs/dbraw/zinc/11/21/49/1427112149.db2.gz ASGYYMDMOQQLDK-UHFFFAOYSA-N 2 1 394.519 3.114 20 0 GGADMP C[N@@H+](CCOc1cccc(C[NH2+]Cc2cn3ccccc3n2)c1)C1CCOCC1 ZINC000174344273 1427112156 /nfs/dbraw/zinc/11/21/56/1427112156.db2.gz ASGYYMDMOQQLDK-UHFFFAOYSA-N 2 1 394.519 3.114 20 0 GGADMP CC(C)[NH+](CCCNC(=O)N1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000174350436 1427115306 /nfs/dbraw/zinc/11/53/06/1427115306.db2.gz CMXJMRBZPYTNSD-BGYRXZFFSA-N 2 1 396.620 3.026 20 0 GGADMP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000174395756 1427136522 /nfs/dbraw/zinc/13/65/22/1427136522.db2.gz KMHRTVHXSNUHER-IFMALSPDSA-N 2 1 379.504 3.466 20 0 GGADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000174395756 1427136530 /nfs/dbraw/zinc/13/65/30/1427136530.db2.gz KMHRTVHXSNUHER-IFMALSPDSA-N 2 1 379.504 3.466 20 0 GGADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000174395756 1427136539 /nfs/dbraw/zinc/13/65/39/1427136539.db2.gz KMHRTVHXSNUHER-IFMALSPDSA-N 2 1 379.504 3.466 20 0 GGADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC000174395756 1427136546 /nfs/dbraw/zinc/13/65/46/1427136546.db2.gz KMHRTVHXSNUHER-IFMALSPDSA-N 2 1 379.504 3.466 20 0 GGADMP C[N@@H+](C[C@H](O)COCc1ccccc1F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174403580 1427142003 /nfs/dbraw/zinc/14/20/03/1427142003.db2.gz QZJURPLUMUGOTI-IRLDBZIGSA-N 2 1 386.511 3.157 20 0 GGADMP C[NH+](C[C@H](O)COCc1ccccc1F)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174403580 1427142006 /nfs/dbraw/zinc/14/20/06/1427142006.db2.gz QZJURPLUMUGOTI-IRLDBZIGSA-N 2 1 386.511 3.157 20 0 GGADMP C[NH+](C[C@H](O)COCc1ccccc1F)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174403580 1427142007 /nfs/dbraw/zinc/14/20/07/1427142007.db2.gz QZJURPLUMUGOTI-IRLDBZIGSA-N 2 1 386.511 3.157 20 0 GGADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000174453189 1427162645 /nfs/dbraw/zinc/16/26/45/1427162645.db2.gz UBDUROSDKYCSHD-UHFFFAOYSA-N 2 1 395.507 3.323 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000174455371 1427164062 /nfs/dbraw/zinc/16/40/62/1427164062.db2.gz SYIAUBJSGROVKA-LJQANCHMSA-N 2 1 392.613 3.333 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000174496733 1427182795 /nfs/dbraw/zinc/18/27/95/1427182795.db2.gz LPCHPXIAXZDMBC-RBUKOAKNSA-N 2 1 383.540 3.134 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CC[C@@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC000174496733 1427182802 /nfs/dbraw/zinc/18/28/02/1427182802.db2.gz LPCHPXIAXZDMBC-RBUKOAKNSA-N 2 1 383.540 3.134 20 0 GGADMP O=C([C@H](c1ccccc1)[NH+]1CCSCC1)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000174568935 1427229554 /nfs/dbraw/zinc/22/95/54/1427229554.db2.gz RFBKZXHEXSBNAC-CTNGQTDRSA-N 2 1 387.593 3.111 20 0 GGADMP CC[NH+]1CCN(c2ccccc2NC(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000174635717 1427279192 /nfs/dbraw/zinc/27/91/92/1427279192.db2.gz WNRBLLFUMOENHE-HXUWFJFHSA-N 2 1 399.583 3.215 20 0 GGADMP O=C(NCC1([NH+]2CCCCC2)CCOCC1)[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000174713784 1427325955 /nfs/dbraw/zinc/32/59/55/1427325955.db2.gz RIIPNRBQOHFFTP-JOCHJYFZSA-N 2 1 399.579 3.192 20 0 GGADMP O=C(NCC1([NH+]2CCCCC2)CCOCC1)[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000174713784 1427325963 /nfs/dbraw/zinc/32/59/63/1427325963.db2.gz RIIPNRBQOHFFTP-JOCHJYFZSA-N 2 1 399.579 3.192 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1)[NH+](C)C1CC1 ZINC000174734129 1427338069 /nfs/dbraw/zinc/33/80/69/1427338069.db2.gz HLKFZTNBHGKBKL-KRWDZBQOSA-N 2 1 384.524 3.194 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1)[NH+](C)C1CC1 ZINC000174734129 1427338072 /nfs/dbraw/zinc/33/80/72/1427338072.db2.gz HLKFZTNBHGKBKL-KRWDZBQOSA-N 2 1 384.524 3.194 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1)[N@H+](C)C1CC1 ZINC000174734129 1427338075 /nfs/dbraw/zinc/33/80/75/1427338075.db2.gz HLKFZTNBHGKBKL-KRWDZBQOSA-N 2 1 384.524 3.194 20 0 GGADMP C[C@@H](CNC(=O)NCc1ccccc1C[NH+](C)Cc1ccco1)[N@@H+](C)C1CC1 ZINC000174734129 1427338076 /nfs/dbraw/zinc/33/80/76/1427338076.db2.gz HLKFZTNBHGKBKL-KRWDZBQOSA-N 2 1 384.524 3.194 20 0 GGADMP CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](C2CC2)CC1 ZINC000174792179 1427370152 /nfs/dbraw/zinc/37/01/52/1427370152.db2.gz PURONWFOMLCKRM-FQEVSTJZSA-N 2 1 384.568 3.167 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](C2CC2)CC1 ZINC000174792170 1427370294 /nfs/dbraw/zinc/37/02/94/1427370294.db2.gz PURONWFOMLCKRM-HXUWFJFHSA-N 2 1 384.568 3.167 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCCC[N@@H+](C)C3CCCCC3)CC2)[nH+]c1 ZINC000174792882 1427370873 /nfs/dbraw/zinc/37/08/73/1427370873.db2.gz SHFKWFJRKMJUMD-UHFFFAOYSA-N 2 1 387.572 3.313 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)NCCC[N@H+](C)C3CCCCC3)CC2)[nH+]c1 ZINC000174792882 1427370880 /nfs/dbraw/zinc/37/08/80/1427370880.db2.gz SHFKWFJRKMJUMD-UHFFFAOYSA-N 2 1 387.572 3.313 20 0 GGADMP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2nc3ccccc3s2)CC1 ZINC000174800035 1427376177 /nfs/dbraw/zinc/37/61/77/1427376177.db2.gz LPRUVNATTYKBLK-UHFFFAOYSA-N 2 1 388.581 3.212 20 0 GGADMP CC(C)c1[nH+]ccn1CCC(=O)NCC1([NH2+][C@H](C)c2ccccc2)CCOCC1 ZINC000174850413 1427405832 /nfs/dbraw/zinc/40/58/32/1427405832.db2.gz PHOQIASSKZRNAE-LJQANCHMSA-N 2 1 398.551 3.413 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCC2([NH+]3CCSCC3)CCCCC2)C1 ZINC000174862490 1427414782 /nfs/dbraw/zinc/41/47/82/1427414782.db2.gz STZCOZPLEAUHOK-LJQANCHMSA-N 2 1 396.645 3.111 20 0 GGADMP C[C@@H](C(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000174971626 1427473209 /nfs/dbraw/zinc/47/32/09/1427473209.db2.gz OLFHBNBCILOFGL-RBBKRZOGSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@@H](C(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000174971626 1427473218 /nfs/dbraw/zinc/47/32/18/1427473218.db2.gz OLFHBNBCILOFGL-RBBKRZOGSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@@H](C(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000174971626 1427473223 /nfs/dbraw/zinc/47/32/23/1427473223.db2.gz OLFHBNBCILOFGL-RBBKRZOGSA-N 2 1 391.559 3.414 20 0 GGADMP C[C@@H](C(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000174971626 1427473229 /nfs/dbraw/zinc/47/32/29/1427473229.db2.gz OLFHBNBCILOFGL-RBBKRZOGSA-N 2 1 391.559 3.414 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000175011280 1427496007 /nfs/dbraw/zinc/49/60/07/1427496007.db2.gz OXUISJNFOVMLCH-QHCPKHFHSA-N 2 1 394.563 3.412 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](CC2CC2)CC1 ZINC000175233316 1427615691 /nfs/dbraw/zinc/61/56/91/1427615691.db2.gz CRUWQGRKFBBUSK-NRFANRHFSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@@H]1CCN(C(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000175237016 1427618860 /nfs/dbraw/zinc/61/88/60/1427618860.db2.gz MKQNTSVVLDMHNQ-LJQANCHMSA-N 2 1 384.568 3.167 20 0 GGADMP CC[NH+](CC)[C@@H]1CCN(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)C1 ZINC000175252520 1427626315 /nfs/dbraw/zinc/62/63/15/1427626315.db2.gz LLVHCIGSZJSEMK-GOSISDBHSA-N 2 1 394.510 3.055 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000175351807 1427698891 /nfs/dbraw/zinc/69/88/91/1427698891.db2.gz YURHHTQBZPFUPK-NRFANRHFSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H]1C[C@@H](NC(=O)NC2CC[NH+](CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000175418414 1427744304 /nfs/dbraw/zinc/74/43/04/1427744304.db2.gz MJBJQHXUSFQLCI-AVRDEDQJSA-N 2 1 384.568 3.213 20 0 GGADMP CN(C[C@@H]1CCC[N@H+](C)C1)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175454050 1427763473 /nfs/dbraw/zinc/76/34/73/1427763473.db2.gz DNVXDPHEUWNRRL-LJQANCHMSA-N 2 1 398.551 3.395 20 0 GGADMP CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)NCc1ccccc1C[NH+](C)Cc1ccco1 ZINC000175454050 1427763477 /nfs/dbraw/zinc/76/34/77/1427763477.db2.gz DNVXDPHEUWNRRL-LJQANCHMSA-N 2 1 398.551 3.395 20 0 GGADMP CN(C[C@@H]1CCC[NH+](C)C1)C(=O)NCc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000175454050 1427763482 /nfs/dbraw/zinc/76/34/82/1427763482.db2.gz DNVXDPHEUWNRRL-LJQANCHMSA-N 2 1 398.551 3.395 20 0 GGADMP CN(C[C@@H]1CCC[NH+](C)C1)C(=O)NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000175454050 1427763489 /nfs/dbraw/zinc/76/34/89/1427763489.db2.gz DNVXDPHEUWNRRL-LJQANCHMSA-N 2 1 398.551 3.395 20 0 GGADMP C[N@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[C@H](C1)[NH+]2C ZINC000175455670 1427763873 /nfs/dbraw/zinc/76/38/73/1427763873.db2.gz MKOZLIXUJYOXSY-LEWJYISDSA-N 2 1 396.535 3.290 20 0 GGADMP C[N@@H+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[C@H](C1)[NH+]2C ZINC000175455670 1427763879 /nfs/dbraw/zinc/76/38/79/1427763879.db2.gz MKOZLIXUJYOXSY-LEWJYISDSA-N 2 1 396.535 3.290 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[C@H](C1)[N@@H+]2C ZINC000175455670 1427763888 /nfs/dbraw/zinc/76/38/88/1427763888.db2.gz MKOZLIXUJYOXSY-LEWJYISDSA-N 2 1 396.535 3.290 20 0 GGADMP C[NH+](Cc1ccco1)Cc1ccccc1CNC(=O)N1CC[C@@H]2CC[C@H](C1)[N@H+]2C ZINC000175455670 1427763894 /nfs/dbraw/zinc/76/38/94/1427763894.db2.gz MKOZLIXUJYOXSY-LEWJYISDSA-N 2 1 396.535 3.290 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+]1CCC(C)CC1 ZINC000175477270 1427776570 /nfs/dbraw/zinc/77/65/70/1427776570.db2.gz MSVQDOODICELCK-JOCHJYFZSA-N 2 1 386.584 3.272 20 0 GGADMP C[C@H]1CCC[N@H+](CCNC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000175479333 1427778292 /nfs/dbraw/zinc/77/82/92/1427778292.db2.gz ZZNCGVJDZDQTSC-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP C[C@H]1CCC[N@@H+](CCNC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000175479333 1427778304 /nfs/dbraw/zinc/77/83/04/1427778304.db2.gz ZZNCGVJDZDQTSC-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP C[C@H]1CCC[NH+](CCNC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000175479333 1427778311 /nfs/dbraw/zinc/77/83/11/1427778311.db2.gz ZZNCGVJDZDQTSC-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP C[C@H]1CCC[NH+](CCNC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000175479333 1427778321 /nfs/dbraw/zinc/77/83/21/1427778321.db2.gz ZZNCGVJDZDQTSC-IBGZPJMESA-N 2 1 398.551 3.443 20 0 GGADMP CCC[N@@H+]1CC[C@H](CNC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000175552197 1427812603 /nfs/dbraw/zinc/81/26/03/1427812603.db2.gz HUCMQZXJEZXQPZ-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccccc2C[NH+](C)Cc2ccco2)C1 ZINC000175552197 1427812605 /nfs/dbraw/zinc/81/26/05/1427812605.db2.gz HUCMQZXJEZXQPZ-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccccc2C[N@H+](C)Cc2ccco2)C1 ZINC000175552197 1427812607 /nfs/dbraw/zinc/81/26/07/1427812607.db2.gz HUCMQZXJEZXQPZ-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000175552197 1427812608 /nfs/dbraw/zinc/81/26/08/1427812608.db2.gz HUCMQZXJEZXQPZ-LJQANCHMSA-N 2 1 398.551 3.443 20 0 GGADMP O=C(NCCC[N@H+]1CCc2ccccc2C1)NC1CC[NH+](C2CCCC2)CC1 ZINC000175607531 1427830080 /nfs/dbraw/zinc/83/00/80/1427830080.db2.gz HSBLHPUNCMDSTF-UHFFFAOYSA-N 2 1 384.568 3.141 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](C2CCCC2)CC1)[N@@H+]1CCc2sccc2C1 ZINC000175637920 1427840572 /nfs/dbraw/zinc/84/05/72/1427840572.db2.gz PXIABRNJMZNJQT-MRXNPFEDSA-N 2 1 390.597 3.201 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](C2CCCC2)CC1)[N@H+]1CCc2sccc2C1 ZINC000175637920 1427840573 /nfs/dbraw/zinc/84/05/73/1427840573.db2.gz PXIABRNJMZNJQT-MRXNPFEDSA-N 2 1 390.597 3.201 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000175755626 1427880135 /nfs/dbraw/zinc/88/01/35/1427880135.db2.gz NFMNTMNUSFQNRK-FQEVSTJZSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[N@@H+](CC)CCNC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000175791789 1427894261 /nfs/dbraw/zinc/89/42/61/1427894261.db2.gz VPKWCVPPHLFESO-UHFFFAOYSA-N 2 1 378.586 3.131 20 0 GGADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)NCC[NH+](C)Cc1ccccc1 ZINC000175816043 1427907063 /nfs/dbraw/zinc/90/70/63/1427907063.db2.gz PYPHHLDCFJGSHQ-QHCPKHFHSA-N 2 1 394.563 3.282 20 0 GGADMP CN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@H+](C)Cc1ccccc1 ZINC000175816043 1427907065 /nfs/dbraw/zinc/90/70/65/1427907065.db2.gz PYPHHLDCFJGSHQ-QHCPKHFHSA-N 2 1 394.563 3.282 20 0 GGADMP CN(C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000175816043 1427907067 /nfs/dbraw/zinc/90/70/67/1427907067.db2.gz PYPHHLDCFJGSHQ-QHCPKHFHSA-N 2 1 394.563 3.282 20 0 GGADMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000175963861 1428001530 /nfs/dbraw/zinc/00/15/30/1428001530.db2.gz RMTARQQEYDTYPQ-LNLFQRSKSA-N 2 1 375.561 3.122 20 0 GGADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000175971663 1428006057 /nfs/dbraw/zinc/00/60/57/1428006057.db2.gz VFVZZULCFAQKLI-VQTJNVASSA-N 2 1 386.584 3.413 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)cc1 ZINC000176054206 1428052824 /nfs/dbraw/zinc/05/28/24/1428052824.db2.gz ZFGRPWRFRCJCFQ-NRFANRHFSA-N 2 1 385.483 3.369 20 0 GGADMP C[NH+](C)CCOc1ccc(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)cc1 ZINC000176054206 1428052833 /nfs/dbraw/zinc/05/28/33/1428052833.db2.gz ZFGRPWRFRCJCFQ-NRFANRHFSA-N 2 1 385.483 3.369 20 0 GGADMP CC[NH+](CC)[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000176129072 1428101705 /nfs/dbraw/zinc/10/17/05/1428101705.db2.gz UZJMZEBCIXYLID-ZWKOTPCHSA-N 2 1 378.586 3.086 20 0 GGADMP Cc1cccc(C)c1C[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000180209584 1429802526 /nfs/dbraw/zinc/80/25/26/1429802526.db2.gz KUSLDPZFUQAEHY-UHFFFAOYSA-N 2 1 381.520 3.254 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCNC(=O)N(C)CCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180289508 1429825927 /nfs/dbraw/zinc/82/59/27/1429825927.db2.gz KXXQGCXEIJDGJL-LJQANCHMSA-N 2 1 387.572 3.061 20 0 GGADMP C[N@@H+](CCCNC(=O)NCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccccc1 ZINC000180291392 1429826563 /nfs/dbraw/zinc/82/65/63/1429826563.db2.gz FHPHHSRJMOBISO-UHFFFAOYSA-N 2 1 395.551 3.119 20 0 GGADMP C[C@@H](NC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000180301033 1429829933 /nfs/dbraw/zinc/82/99/33/1429829933.db2.gz PBOFXCAOTYIFIU-RYRKJORJSA-N 2 1 378.586 3.303 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000180301016 1429830062 /nfs/dbraw/zinc/83/00/62/1429830062.db2.gz PBOFXCAOTYIFIU-BQFCYCMXSA-N 2 1 378.586 3.303 20 0 GGADMP C[C@H]1CCC[N@@H+](CCCCNC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180308480 1429832270 /nfs/dbraw/zinc/83/22/70/1429832270.db2.gz ZJMDPBYOQMQMKE-IBGZPJMESA-N 2 1 387.572 3.109 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180308464 1429832275 /nfs/dbraw/zinc/83/22/75/1429832275.db2.gz ZJMDPBYOQMQMKE-LJQANCHMSA-N 2 1 387.572 3.109 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2C)C[C@H](C)O1 ZINC000180312368 1429833636 /nfs/dbraw/zinc/83/36/36/1429833636.db2.gz ONSWQLHDMRDKHH-AKHDSKFASA-N 2 1 383.577 3.111 20 0 GGADMP O=C(Nc1cccc(CC[NH+]2CCCC2)c1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000180315835 1429834456 /nfs/dbraw/zinc/83/44/56/1429834456.db2.gz KWOGBMURBJPTGA-HSZRJFAPSA-N 2 1 393.531 3.164 20 0 GGADMP O=C(Nc1cccc(CC[NH+]2CCCC2)c1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000180315835 1429834457 /nfs/dbraw/zinc/83/44/57/1429834457.db2.gz KWOGBMURBJPTGA-HSZRJFAPSA-N 2 1 393.531 3.164 20 0 GGADMP CCC[C@@H]1CN(C(=O)NC2CC[NH+](C3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000180340271 1429839951 /nfs/dbraw/zinc/83/99/51/1429839951.db2.gz HGFYGKUORCKLLN-JOCHJYFZSA-N 2 1 384.568 3.309 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1CNC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000180356781 1429845013 /nfs/dbraw/zinc/84/50/13/1429845013.db2.gz HOOUHCMJQNPHBC-OAQYLSRUSA-N 2 1 387.572 3.204 20 0 GGADMP CC[N@H+]1CCCC[C@H]1CNC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000180356799 1429845093 /nfs/dbraw/zinc/84/50/93/1429845093.db2.gz HOOUHCMJQNPHBC-NRFANRHFSA-N 2 1 387.572 3.204 20 0 GGADMP C[NH+](C)C1CCN(c2ccc(NC(=O)C[N@@H+](C)Cc3ccccc3)cc2)CC1 ZINC000180417080 1429863195 /nfs/dbraw/zinc/86/31/95/1429863195.db2.gz HUEALLOXOLHUQM-UHFFFAOYSA-N 2 1 380.536 3.288 20 0 GGADMP C[NH+](C)C1CCN(c2ccc(NC(=O)C[N@H+](C)Cc3ccccc3)cc2)CC1 ZINC000180417080 1429863196 /nfs/dbraw/zinc/86/31/96/1429863196.db2.gz HUEALLOXOLHUQM-UHFFFAOYSA-N 2 1 380.536 3.288 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C[N@@H+](C)Cc1ccccc1N1CCCC1)c1ccccc1 ZINC000180421119 1429864688 /nfs/dbraw/zinc/86/46/88/1429864688.db2.gz OIVVUBFGKZSNGG-HSZRJFAPSA-N 2 1 394.563 3.138 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)C[N@H+](C)Cc1ccccc1N1CCCC1)c1ccccc1 ZINC000180421119 1429864690 /nfs/dbraw/zinc/86/46/90/1429864690.db2.gz OIVVUBFGKZSNGG-HSZRJFAPSA-N 2 1 394.563 3.138 20 0 GGADMP CCOc1cccc([C@H](C)NCC(=O)Nc2ccc(CN3CCOCC3)cc2)c1 ZINC000180693757 1429981551 /nfs/dbraw/zinc/98/15/51/1429981551.db2.gz FAQXOCTZYOFOCG-SFHVURJKSA-N 2 1 397.519 3.207 20 0 GGADMP CC(C)OCC[NH+]1CCC([NH2+]C2CCC(NC(=O)OC(C)(C)C)CC2)CC1 ZINC000180700793 1429985808 /nfs/dbraw/zinc/98/58/08/1429985808.db2.gz PBWNRDCLORLYDM-UHFFFAOYSA-N 2 1 383.577 3.301 20 0 GGADMP C[NH+](C)Cc1cccc(NC(=O)NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)c1 ZINC000180708403 1429990865 /nfs/dbraw/zinc/99/08/65/1429990865.db2.gz NFSYDHHQQQYBLI-JOCHJYFZSA-N 2 1 396.535 3.027 20 0 GGADMP O=C(NCCC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)C(F)(F)F ZINC000180723143 1430000753 /nfs/dbraw/zinc/00/07/53/1430000753.db2.gz YSSZNDGMILAXEO-MSOLQXFVSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(NCCC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1)C(F)(F)F ZINC000180723143 1430000759 /nfs/dbraw/zinc/00/07/59/1430000759.db2.gz YSSZNDGMILAXEO-MSOLQXFVSA-N 2 1 383.458 3.042 20 0 GGADMP O=C(NCCC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1)C(F)(F)F ZINC000180723143 1430000768 /nfs/dbraw/zinc/00/07/68/1430000768.db2.gz YSSZNDGMILAXEO-MSOLQXFVSA-N 2 1 383.458 3.042 20 0 GGADMP Cc1nc(COc2ccc(C[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)no1 ZINC000180785556 1430038480 /nfs/dbraw/zinc/03/84/80/1430038480.db2.gz DSWFKCMDFNSBFD-NQIIRXRSSA-N 2 1 382.508 3.406 20 0 GGADMP Cc1nc(COc2ccc(C[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2)no1 ZINC000180785556 1430038483 /nfs/dbraw/zinc/03/84/83/1430038483.db2.gz DSWFKCMDFNSBFD-NQIIRXRSSA-N 2 1 382.508 3.406 20 0 GGADMP Cc1nc(COc2ccc(C[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2)no1 ZINC000180785556 1430038493 /nfs/dbraw/zinc/03/84/93/1430038493.db2.gz DSWFKCMDFNSBFD-NQIIRXRSSA-N 2 1 382.508 3.406 20 0 GGADMP C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180879508 1430084511 /nfs/dbraw/zinc/08/45/11/1430084511.db2.gz RQUHNENUWIOMLN-OALUTQOASA-N 2 1 395.588 3.257 20 0 GGADMP CC(C)(C)OC(=O)NC[C@H]1CCC[C@H]1[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000180879863 1430085353 /nfs/dbraw/zinc/08/53/53/1430085353.db2.gz WENFADWJYNZQJL-RTBURBONSA-N 2 1 395.588 3.305 20 0 GGADMP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)cc1 ZINC000180907122 1430102181 /nfs/dbraw/zinc/10/21/81/1430102181.db2.gz LISPEYCDDBOFLO-HSZRJFAPSA-N 2 1 388.515 3.252 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cccnc1Cl ZINC000180975618 1430146798 /nfs/dbraw/zinc/14/67/98/1430146798.db2.gz PKNCQBKCARIPBX-MRXNPFEDSA-N 2 1 386.927 3.411 20 0 GGADMP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)o1 ZINC000180984529 1430152617 /nfs/dbraw/zinc/15/26/17/1430152617.db2.gz NFKUYWGRPKXDHL-FQEVSTJZSA-N 2 1 380.492 3.225 20 0 GGADMP COc1ccc(C[N@H+](CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C2CC2)cc1 ZINC000181276512 1430261160 /nfs/dbraw/zinc/26/11/60/1430261160.db2.gz JEBULHCJEVTILZ-QFIPXVFZSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccc(C[N@@H+](CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C2CC2)cc1 ZINC000181276512 1430261164 /nfs/dbraw/zinc/26/11/64/1430261164.db2.gz JEBULHCJEVTILZ-QFIPXVFZSA-N 2 1 381.520 3.079 20 0 GGADMP COc1ccc([C@@H](CNC(=O)C[NH2+][C@H](C)c2cccnc2)[NH+]2CCCCC2)cc1 ZINC000181346007 1430278668 /nfs/dbraw/zinc/27/86/68/1430278668.db2.gz LWIMXGZOOAPDHM-XMSQKQJNSA-N 2 1 396.535 3.084 20 0 GGADMP C[C@H](NC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000181414437 1430292179 /nfs/dbraw/zinc/29/21/79/1430292179.db2.gz VIXWHEDKERUVPB-TZYHBYERSA-N 2 1 389.584 3.046 20 0 GGADMP C[C@H](NC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000181414402 1430292228 /nfs/dbraw/zinc/29/22/28/1430292228.db2.gz VIXWHEDKERUVPB-NMNUPHIUSA-N 2 1 389.584 3.046 20 0 GGADMP COc1cc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc(OC)c1OC ZINC000181418044 1430293318 /nfs/dbraw/zinc/29/33/18/1430293318.db2.gz SGDUUIYRVZSBCZ-SNRMKQJTSA-N 2 1 392.540 3.131 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc(OC)c1OC ZINC000181418021 1430293431 /nfs/dbraw/zinc/29/34/31/1430293431.db2.gz SGDUUIYRVZSBCZ-LZQZEXGQSA-N 2 1 392.540 3.131 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+](CN2C(=O)NC3(CCCCC3)C2=O)CC1 ZINC000181458348 1430304118 /nfs/dbraw/zinc/30/41/18/1430304118.db2.gz AMEDWCUOOCTMIE-UHFFFAOYSA-N 2 1 378.561 3.033 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000181525737 1430315337 /nfs/dbraw/zinc/31/53/37/1430315337.db2.gz MJBSHSNZKIATHC-GUYCJALGSA-N 2 1 380.414 3.385 20 0 GGADMP C[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000181624722 1430329787 /nfs/dbraw/zinc/32/97/87/1430329787.db2.gz VHHAPXRECZNTPW-TXPKVOOTSA-N 2 1 387.474 3.395 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N[C@@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)CC2)[nH+]c1 ZINC000181644293 1430333606 /nfs/dbraw/zinc/33/36/06/1430333606.db2.gz GFRRRFJBSQXYEG-AZUAARDMSA-N 2 1 384.568 3.376 20 0 GGADMP Cc1ccc(N2CCC(C(=O)N[C@@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)CC2)[nH+]c1 ZINC000181644293 1430333610 /nfs/dbraw/zinc/33/36/10/1430333610.db2.gz GFRRRFJBSQXYEG-AZUAARDMSA-N 2 1 384.568 3.376 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CC3CCN(C(=O)C(C)(C)C)CC3)CC2)C[C@H](C)O1 ZINC000181675766 1430339745 /nfs/dbraw/zinc/33/97/45/1430339745.db2.gz PYTWQHZOZVWVBQ-KDURUIRLSA-N 2 1 393.616 3.092 20 0 GGADMP C[C@H](CCNC(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[NH+]1CCCCC1 ZINC000181703403 1430344099 /nfs/dbraw/zinc/34/40/99/1430344099.db2.gz ZKSNUTLYUIDPKM-IFMALSPDSA-N 2 1 386.584 3.115 20 0 GGADMP CCO[C@@H]1C[C@H]([N@@H+](C)CC2(C[NH+](C)[C@@H]3C[C@H](OCC)C3(C)C)COC2)C1(C)C ZINC000182186643 1430426333 /nfs/dbraw/zinc/42/63/33/1430426333.db2.gz YCWJVJTZZDJGQY-JVSBHGNQSA-N 2 1 396.616 3.274 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21)c1ccccc1Cl ZINC000182219576 1430431964 /nfs/dbraw/zinc/43/19/64/1430431964.db2.gz RAEZAJZBXSPNAY-LZQZEXGQSA-N 2 1 378.948 3.068 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)c1ccccc1Cl ZINC000182219576 1430431968 /nfs/dbraw/zinc/43/19/68/1430431968.db2.gz RAEZAJZBXSPNAY-LZQZEXGQSA-N 2 1 378.948 3.068 20 0 GGADMP C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000182255460 1430437931 /nfs/dbraw/zinc/43/79/31/1430437931.db2.gz ZFMKMLBDZIHRQH-YADHBBJMSA-N 2 1 384.568 3.298 20 0 GGADMP COCc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)ccc1OC ZINC000182261561 1430439088 /nfs/dbraw/zinc/43/90/88/1430439088.db2.gz SNPOHQJPDSFWNE-VGSWGCGISA-N 2 1 384.520 3.259 20 0 GGADMP COCCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1 ZINC000182263211 1430439352 /nfs/dbraw/zinc/43/93/52/1430439352.db2.gz SEVAGGNIWKBGGE-GCJKJVERSA-N 2 1 384.520 3.129 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(N2CCCC2=O)cc1 ZINC000182272552 1430440855 /nfs/dbraw/zinc/44/08/55/1430440855.db2.gz AUYNSLLSKHZKKK-JPYJTQIMSA-N 2 1 393.531 3.231 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cccc(N2CCCC2=O)c1 ZINC000182272616 1430441032 /nfs/dbraw/zinc/44/10/32/1430441032.db2.gz UFVXPSDFHMNDCV-JPYJTQIMSA-N 2 1 393.531 3.231 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21)c1ccsc1 ZINC000182329636 1430449367 /nfs/dbraw/zinc/44/93/67/1430449367.db2.gz RNKXBYHXUOCHRZ-NZSAHSFTSA-N 2 1 378.586 3.257 20 0 GGADMP CC[C@@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1c(C)noc1C ZINC000182392901 1430458811 /nfs/dbraw/zinc/45/88/11/1430458811.db2.gz ZHOSYBAMBIBDFJ-HXUWFJFHSA-N 2 1 384.524 3.244 20 0 GGADMP C[NH+](C)[C@@H](C(=O)NCCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1 ZINC000182400371 1430460340 /nfs/dbraw/zinc/46/03/40/1430460340.db2.gz XMSPLXVHXIARJN-HSZRJFAPSA-N 2 1 395.547 3.123 20 0 GGADMP C[C@H](NC(=O)NCCCC[NH+]1CCC(C)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182407119 1430462052 /nfs/dbraw/zinc/46/20/52/1430462052.db2.gz IRVZCTBEJWLUBK-VQTJNVASSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@H](NC(=O)NCCCC[NH+]1CCC(C)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182407159 1430462163 /nfs/dbraw/zinc/46/21/63/1430462163.db2.gz IRVZCTBEJWLUBK-PMACEKPBSA-N 2 1 378.605 3.451 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000182531272 1430484543 /nfs/dbraw/zinc/48/45/43/1430484543.db2.gz KEVIEGDNYSIAGQ-UYAOXDASSA-N 2 1 390.597 3.086 20 0 GGADMP O=C(NC1CC[NH+](Cc2cccnc2)CC1)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000182630774 1430505870 /nfs/dbraw/zinc/50/58/70/1430505870.db2.gz CJJIAWSQBKJLNQ-QHCPKHFHSA-N 2 1 392.547 3.217 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)[NH+](C)Cc1ccccc1 ZINC000182634955 1430506566 /nfs/dbraw/zinc/50/65/66/1430506566.db2.gz ZTWGYCJPLGLTCT-IRFCIJBXSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1)[N@H+](C)Cc1ccccc1 ZINC000182634955 1430506568 /nfs/dbraw/zinc/50/65/68/1430506568.db2.gz ZTWGYCJPLGLTCT-IRFCIJBXSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000182634955 1430506569 /nfs/dbraw/zinc/50/65/69/1430506569.db2.gz ZTWGYCJPLGLTCT-IRFCIJBXSA-N 2 1 386.584 3.459 20 0 GGADMP C[C@H](CCNC(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCCCC1 ZINC000182712811 1430524408 /nfs/dbraw/zinc/52/44/08/1430524408.db2.gz YSCGEGDFXBWAHU-IRLDBZIGSA-N 2 1 386.584 3.414 20 0 GGADMP CC[NH+](CC)CCCC1CC[NH+]([C@H](C)C(=O)Nc2sccc2C(N)=O)CC1 ZINC000182758487 1430535085 /nfs/dbraw/zinc/53/50/85/1430535085.db2.gz SOKVOFCSFBLOIY-OAHLLOKOSA-N 2 1 394.585 3.008 20 0 GGADMP C[C@@H](NC(=O)N1CCC[N@H+](C2CCCC2)CC1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000182835859 1430550056 /nfs/dbraw/zinc/55/00/56/1430550056.db2.gz TXOQEVWJNNZXGP-RTBURBONSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H](NC(=O)N1CCC[NH+](C2CCCC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182835859 1430550058 /nfs/dbraw/zinc/55/00/58/1430550058.db2.gz TXOQEVWJNNZXGP-RTBURBONSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H](NC(=O)N1CCC[NH+](C2CCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182835859 1430550060 /nfs/dbraw/zinc/55/00/60/1430550060.db2.gz TXOQEVWJNNZXGP-RTBURBONSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@H](NC(=O)N1CC[N@H+](C)C[C@@H]1c1ccccc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182834956 1430550357 /nfs/dbraw/zinc/55/03/57/1430550357.db2.gz PIQCLKUTBRCNFC-RCZSKKKRSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[N@@H+](C)C[C@@H]1c1ccccc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000182834956 1430550361 /nfs/dbraw/zinc/55/03/61/1430550361.db2.gz PIQCLKUTBRCNFC-RCZSKKKRSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C)C[C@@H]1c1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182834956 1430550364 /nfs/dbraw/zinc/55/03/64/1430550364.db2.gz PIQCLKUTBRCNFC-RCZSKKKRSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@H](NC(=O)N1CC[NH+](C)C[C@@H]1c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182834956 1430550366 /nfs/dbraw/zinc/55/03/66/1430550366.db2.gz PIQCLKUTBRCNFC-RCZSKKKRSA-N 2 1 384.568 3.338 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182869670 1430557826 /nfs/dbraw/zinc/55/78/26/1430557826.db2.gz GBHLWHCWLAZWHG-TZIWHRDSSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H](NC(=O)N1CCN(CCc2ccccc2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182885675 1430561653 /nfs/dbraw/zinc/56/16/53/1430561653.db2.gz UIEITMHVEBIDLU-IRLDBZIGSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](CCc2ccccc2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182885675 1430561659 /nfs/dbraw/zinc/56/16/59/1430561659.db2.gz UIEITMHVEBIDLU-IRLDBZIGSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](CCc2ccccc2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182885675 1430561663 /nfs/dbraw/zinc/56/16/63/1430561663.db2.gz UIEITMHVEBIDLU-IRLDBZIGSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@@H](NC(=O)N1CCN(CCc2ccccc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182885634 1430561740 /nfs/dbraw/zinc/56/17/40/1430561740.db2.gz UIEITMHVEBIDLU-IFMALSPDSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182885634 1430561748 /nfs/dbraw/zinc/56/17/48/1430561748.db2.gz UIEITMHVEBIDLU-IFMALSPDSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182885634 1430561756 /nfs/dbraw/zinc/56/17/56/1430561756.db2.gz UIEITMHVEBIDLU-IFMALSPDSA-N 2 1 398.595 3.209 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182924630 1430573125 /nfs/dbraw/zinc/57/31/25/1430573125.db2.gz WRPRBIOWIXRIKC-CTNGQTDRSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182924630 1430573128 /nfs/dbraw/zinc/57/31/28/1430573128.db2.gz WRPRBIOWIXRIKC-CTNGQTDRSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1ccco1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182930873 1430574221 /nfs/dbraw/zinc/57/42/21/1430574221.db2.gz HDRURKBZHWHPGZ-MSOLQXFVSA-N 2 1 376.545 3.006 20 0 GGADMP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1ccco1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182930830 1430574446 /nfs/dbraw/zinc/57/44/46/1430574446.db2.gz HDRURKBZHWHPGZ-QZTJIDSGSA-N 2 1 376.545 3.006 20 0 GGADMP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1cccc(NC(=O)OC(C)(C)C)c1 ZINC000182958140 1430580730 /nfs/dbraw/zinc/58/07/30/1430580730.db2.gz LQJGSDXWWLTOHP-UHFFFAOYSA-N 2 1 376.545 3.103 20 0 GGADMP Cc1cc(C[N@@H+](C)CCCN2CC[NH+](C)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000182958071 1430580839 /nfs/dbraw/zinc/58/08/39/1430580839.db2.gz BMTCLZMWEJACNC-UHFFFAOYSA-N 2 1 387.959 3.175 20 0 GGADMP COC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(F)c(F)c1 ZINC000183078774 1430607250 /nfs/dbraw/zinc/60/72/50/1430607250.db2.gz AKQKKKKLOOZOSP-QFIPXVFZSA-N 2 1 390.474 3.399 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)N1CC[NH+](C)CC1 ZINC000183127864 1430622256 /nfs/dbraw/zinc/62/22/56/1430622256.db2.gz NEWKLNRIMJIGQE-JBXUNAHCSA-N 3 1 398.639 3.149 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)N1CCN(C)CC1 ZINC000183127864 1430622264 /nfs/dbraw/zinc/62/22/64/1430622264.db2.gz NEWKLNRIMJIGQE-JBXUNAHCSA-N 2 1 398.639 3.149 20 0 GGADMP CC(C)[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)N1CCN(C)CC1 ZINC000183127864 1430622274 /nfs/dbraw/zinc/62/22/74/1430622274.db2.gz NEWKLNRIMJIGQE-JBXUNAHCSA-N 2 1 398.639 3.149 20 0 GGADMP CN(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183138665 1430626292 /nfs/dbraw/zinc/62/62/92/1430626292.db2.gz FYRTVKQEWXDYRP-CCDWMCETSA-N 3 1 398.639 3.150 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183138665 1430626302 /nfs/dbraw/zinc/62/63/02/1430626302.db2.gz FYRTVKQEWXDYRP-CCDWMCETSA-N 3 1 398.639 3.150 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183138665 1430626306 /nfs/dbraw/zinc/62/63/06/1430626306.db2.gz FYRTVKQEWXDYRP-CCDWMCETSA-N 3 1 398.639 3.150 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cccc(S(=O)(=O)N(C)C)c2)cc1 ZINC000183154807 1430631302 /nfs/dbraw/zinc/63/13/02/1430631302.db2.gz MHGULTKVOGRNIU-MRXNPFEDSA-N 2 1 398.532 3.282 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000183191305 1430643610 /nfs/dbraw/zinc/64/36/10/1430643610.db2.gz NTQOREFCAJXEKV-XYJFISCASA-N 2 1 379.570 3.362 20 0 GGADMP C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000183496309 1430727799 /nfs/dbraw/zinc/72/77/99/1430727799.db2.gz XIBOPCWQLNCVRN-QUCCMNQESA-N 2 1 384.524 3.236 20 0 GGADMP CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000183504510 1430730314 /nfs/dbraw/zinc/73/03/14/1430730314.db2.gz VYQXIZNJCCTOCM-CZUORRHYSA-N 2 1 395.569 3.190 20 0 GGADMP COC(=O)c1cccc(NC(=O)C[C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000183623392 1430756899 /nfs/dbraw/zinc/75/68/99/1430756899.db2.gz VQOWABWEHKAOTM-ROUUACIJSA-N 2 1 389.540 3.148 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCC[C@H](C)[NH+]2CCCCC2)cc1)[NH+]1CCOCC1 ZINC000183677809 1430770209 /nfs/dbraw/zinc/77/02/09/1430770209.db2.gz WGZATYWKVRREQX-RBUKOAKNSA-N 2 1 388.556 3.466 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC(=O)Nc2ccc3c(c2)OCCO3)cc1 ZINC000183681421 1430771073 /nfs/dbraw/zinc/77/10/73/1430771073.db2.gz LTFSMGLZLWJMJD-HNNXBMFYSA-N 2 1 392.459 3.241 20 0 GGADMP CC(C)c1cnc(C[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)s1 ZINC000183789391 1430794349 /nfs/dbraw/zinc/79/43/49/1430794349.db2.gz BXIGXDZQFUUPDO-UHFFFAOYSA-N 2 1 386.565 3.382 20 0 GGADMP CCc1noc(C2CCC([NH2+]CC3([NH+]4CCCCC4)CCOCC3)CC2)n1 ZINC000183900289 1430810578 /nfs/dbraw/zinc/81/05/78/1430810578.db2.gz TYJIPFINRXQTRA-UHFFFAOYSA-N 2 1 376.545 3.283 20 0 GGADMP C[C@@H](C[N@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1nccs1 ZINC000183978067 1430821936 /nfs/dbraw/zinc/82/19/36/1430821936.db2.gz PBKOCPNDWQJOCR-KRWDZBQOSA-N 2 1 386.565 3.091 20 0 GGADMP C[C@@H](C[N@@H+](C)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1nccs1 ZINC000183978067 1430821937 /nfs/dbraw/zinc/82/19/37/1430821937.db2.gz PBKOCPNDWQJOCR-KRWDZBQOSA-N 2 1 386.565 3.091 20 0 GGADMP CC[C@@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1nc(C)cs1 ZINC000184341531 1430875259 /nfs/dbraw/zinc/87/52/59/1430875259.db2.gz YNGMKZMJHDKEFY-LJQANCHMSA-N 2 1 386.565 3.404 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1-n1nccc1C ZINC000184586773 1430910479 /nfs/dbraw/zinc/91/04/79/1430910479.db2.gz KQYQZZMREVLCBO-IBGZPJMESA-N 2 1 398.555 3.061 20 0 GGADMP CCN(C(=O)NC1CC[NH+](CC(C)C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000184599748 1430914703 /nfs/dbraw/zinc/91/47/03/1430914703.db2.gz BJQIMWHODSDLGJ-QFIPXVFZSA-N 2 1 386.584 3.413 20 0 GGADMP CCN(C(=O)NC1CC[NH+](CC2CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000184605827 1430917409 /nfs/dbraw/zinc/91/74/09/1430917409.db2.gz OELCMKDFIQPGFA-QFIPXVFZSA-N 2 1 384.568 3.167 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000184742480 1430961323 /nfs/dbraw/zinc/96/13/23/1430961323.db2.gz WAJBUVMERHRDNB-ROUUACIJSA-N 2 1 397.588 3.379 20 0 GGADMP Cc1ccccc1CNC(=O)C[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000184744851 1430963031 /nfs/dbraw/zinc/96/30/31/1430963031.db2.gz PCPBLRIXEDFCGW-WOJBJXKFSA-N 2 1 379.548 3.357 20 0 GGADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)N1CCc2ccccc2C1 ZINC000184745854 1430963225 /nfs/dbraw/zinc/96/32/25/1430963225.db2.gz OFMGWLICYLINIZ-PMACEKPBSA-N 2 1 391.559 3.318 20 0 GGADMP COc1ccccc1CNC(=O)C[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000184749492 1430964992 /nfs/dbraw/zinc/96/49/92/1430964992.db2.gz SXJYUNPGOQCBMI-RTBURBONSA-N 2 1 395.547 3.058 20 0 GGADMP Cc1cccn2c(=O)cc(C[NH2+]C3[C@@H](C)C[NH+](Cc4ccccc4)C[C@@H]3C)nc12 ZINC000184748437 1430965059 /nfs/dbraw/zinc/96/50/59/1430965059.db2.gz SIOHSLDVISNJFE-OALUTQOASA-N 2 1 390.531 3.249 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCC(=O)Nc1cc(N)ccc1F ZINC000184752272 1430965864 /nfs/dbraw/zinc/96/58/64/1430965864.db2.gz IRPXVRFCCNUCJJ-NWMVZANLSA-N 2 1 398.526 3.483 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)NCc1ccc(F)cc1 ZINC000184754545 1430967323 /nfs/dbraw/zinc/96/73/23/1430967323.db2.gz WCIYKPCDMCNKGL-QZTJIDSGSA-N 2 1 383.511 3.188 20 0 GGADMP CCOc1cc2[nH+]ccc(N[C@H](C)CCN3CC[NH+](C)CC3)c2cc1OCC ZINC000184826379 1430992089 /nfs/dbraw/zinc/99/20/89/1430992089.db2.gz JBXWHMBUOPCGQP-QGZVFWFLSA-N 2 1 386.540 3.470 20 0 GGADMP C[C@H](CCNC(=O)NC[C@H](C)[N@@H+]1CCc2sccc2C1)[NH+]1CCCCC1 ZINC000184869442 1431008010 /nfs/dbraw/zinc/00/80/10/1431008010.db2.gz SPKGBJACIWKWAS-SJORKVTESA-N 2 1 378.586 3.058 20 0 GGADMP C[C@H](CCNC(=O)NC[C@H](C)[N@H+]1CCc2sccc2C1)[NH+]1CCCCC1 ZINC000184869442 1431008014 /nfs/dbraw/zinc/00/80/14/1431008014.db2.gz SPKGBJACIWKWAS-SJORKVTESA-N 2 1 378.586 3.058 20 0 GGADMP C[C@H](CNC(=O)NCC[C@H](C)[NH+]1CCCCC1)[N@@H+]1CCc2sccc2C1 ZINC000184869383 1431008331 /nfs/dbraw/zinc/00/83/31/1431008331.db2.gz SPKGBJACIWKWAS-DLBZAZTESA-N 2 1 378.586 3.058 20 0 GGADMP C[C@H](CNC(=O)NCC[C@H](C)[NH+]1CCCCC1)[N@H+]1CCc2sccc2C1 ZINC000184869383 1431008335 /nfs/dbraw/zinc/00/83/35/1431008335.db2.gz SPKGBJACIWKWAS-DLBZAZTESA-N 2 1 378.586 3.058 20 0 GGADMP COc1cccc([C@H]2CCC[N@@H+]2CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000184929856 1431023888 /nfs/dbraw/zinc/02/38/88/1431023888.db2.gz BHMPWTGJJBDBMF-FGZHOGPDSA-N 2 1 381.520 3.251 20 0 GGADMP COc1cccc([C@H]2CCC[N@H+]2CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000184929856 1431023893 /nfs/dbraw/zinc/02/38/93/1431023893.db2.gz BHMPWTGJJBDBMF-FGZHOGPDSA-N 2 1 381.520 3.251 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)C[NH+]1CCC(OCc2ccccc2)CC1)c1ccccc1 ZINC000184930178 1431024337 /nfs/dbraw/zinc/02/43/37/1431024337.db2.gz UDTJGDATAHEJKV-QHCPKHFHSA-N 2 1 395.547 3.087 20 0 GGADMP CCC[C@H]([NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1)c1cccnc1 ZINC000185080539 1431055767 /nfs/dbraw/zinc/05/57/67/1431055767.db2.gz NHVINBUVUWDXEP-QFIPXVFZSA-N 2 1 396.535 3.373 20 0 GGADMP CC(C)[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1 ZINC000185082640 1431056614 /nfs/dbraw/zinc/05/66/14/1431056614.db2.gz SNHDWPPRSVHHIX-IRLDBZIGSA-N 2 1 379.552 3.278 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000185091063 1431058469 /nfs/dbraw/zinc/05/84/69/1431058469.db2.gz KMJKVWRADPNEOY-UHFFFAOYSA-N 2 1 378.948 3.040 20 0 GGADMP CN(CC[N@@H+](C)C1CC1)C(=O)N[C@@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000185395269 1431135570 /nfs/dbraw/zinc/13/55/70/1431135570.db2.gz BDVFQYMEFWIQDV-QGZVFWFLSA-N 2 1 398.473 3.015 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)N[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000185395269 1431135574 /nfs/dbraw/zinc/13/55/74/1431135574.db2.gz BDVFQYMEFWIQDV-QGZVFWFLSA-N 2 1 398.473 3.015 20 0 GGADMP CN(CC[NH+](C)C1CC1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000185395269 1431135579 /nfs/dbraw/zinc/13/55/79/1431135579.db2.gz BDVFQYMEFWIQDV-QGZVFWFLSA-N 2 1 398.473 3.015 20 0 GGADMP Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000185400466 1431136709 /nfs/dbraw/zinc/13/67/09/1431136709.db2.gz WDXOMUGOLJWYKR-PXNSSMCTSA-N 2 1 381.520 3.249 20 0 GGADMP CCOC(=O)c1ccc(NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185669615 1431201145 /nfs/dbraw/zinc/20/11/45/1431201145.db2.gz UFJRBYGGHAXBJE-WMZOPIPTSA-N 2 1 387.524 3.044 20 0 GGADMP CCOC(=O)c1ccc(NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185669615 1431201151 /nfs/dbraw/zinc/20/11/51/1431201151.db2.gz UFJRBYGGHAXBJE-WMZOPIPTSA-N 2 1 387.524 3.044 20 0 GGADMP Cc1cccc(C)c1OCCNC(=O)C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185668898 1431201247 /nfs/dbraw/zinc/20/12/47/1431201247.db2.gz NGAZKXHUNKFLPW-UXHICEINSA-N 2 1 387.568 3.041 20 0 GGADMP Cc1cccc(C)c1OCCNC(=O)C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185668898 1431201251 /nfs/dbraw/zinc/20/12/51/1431201251.db2.gz NGAZKXHUNKFLPW-UXHICEINSA-N 2 1 387.568 3.041 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185677433 1431203373 /nfs/dbraw/zinc/20/33/73/1431203373.db2.gz YCZJAZLPVJNQJP-IKGGRYGDSA-N 2 1 387.524 3.027 20 0 GGADMP C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185677433 1431203379 /nfs/dbraw/zinc/20/33/79/1431203379.db2.gz YCZJAZLPVJNQJP-IKGGRYGDSA-N 2 1 387.524 3.027 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCOc1cccc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185682439 1431204738 /nfs/dbraw/zinc/20/47/38/1431204738.db2.gz GTXVUOJOOBDEIG-IRXDYDNUSA-N 2 1 393.959 3.078 20 0 GGADMP C[C@H]([NH2+]CC(=O)NCCOc1cccc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185682439 1431204744 /nfs/dbraw/zinc/20/47/44/1431204744.db2.gz GTXVUOJOOBDEIG-IRXDYDNUSA-N 2 1 393.959 3.078 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185685961 1431205871 /nfs/dbraw/zinc/20/58/71/1431205871.db2.gz ZVWKEIDVTDQFRP-OALUTQOASA-N 2 1 384.568 3.468 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc(N2CCCC2)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185685961 1431205877 /nfs/dbraw/zinc/20/58/77/1431205877.db2.gz ZVWKEIDVTDQFRP-OALUTQOASA-N 2 1 384.568 3.468 20 0 GGADMP CCN(Cc1cccc(F)c1)C(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185688816 1431206561 /nfs/dbraw/zinc/20/65/61/1431206561.db2.gz PQHZZCFKMMWDFG-IEBWSBKVSA-N 2 1 375.532 3.417 20 0 GGADMP CCN(Cc1cccc(F)c1)C(=O)C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185688816 1431206565 /nfs/dbraw/zinc/20/65/65/1431206565.db2.gz PQHZZCFKMMWDFG-IEBWSBKVSA-N 2 1 375.532 3.417 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185696049 1431209041 /nfs/dbraw/zinc/20/90/41/1431209041.db2.gz MXMZSVXMFFCYGU-GDBMZVCRSA-N 2 1 386.508 3.426 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185696049 1431209046 /nfs/dbraw/zinc/20/90/46/1431209046.db2.gz MXMZSVXMFFCYGU-GDBMZVCRSA-N 2 1 386.508 3.426 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000185698012 1431209173 /nfs/dbraw/zinc/20/91/73/1431209173.db2.gz XIVPWUFMATXLRU-MSOLQXFVSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC000185698012 1431209181 /nfs/dbraw/zinc/20/91/81/1431209181.db2.gz XIVPWUFMATXLRU-MSOLQXFVSA-N 2 1 386.540 3.194 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185707900 1431211493 /nfs/dbraw/zinc/21/14/93/1431211493.db2.gz HQOMYDICJQFICE-KBPBESRZSA-N 2 1 395.450 3.189 20 0 GGADMP C[C@H]([NH2+]CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185707900 1431211500 /nfs/dbraw/zinc/21/15/00/1431211500.db2.gz HQOMYDICJQFICE-KBPBESRZSA-N 2 1 395.450 3.189 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185707885 1431211544 /nfs/dbraw/zinc/21/15/44/1431211544.db2.gz HQOMYDICJQFICE-ZIAGYGMSSA-N 2 1 395.450 3.189 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185707885 1431211546 /nfs/dbraw/zinc/21/15/46/1431211546.db2.gz HQOMYDICJQFICE-ZIAGYGMSSA-N 2 1 395.450 3.189 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(OC)c1 ZINC000185706751 1431211696 /nfs/dbraw/zinc/21/16/96/1431211696.db2.gz CKGVPOGCQACFQM-IXDOHACOSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(OC)c1 ZINC000185706751 1431211702 /nfs/dbraw/zinc/21/17/02/1431211702.db2.gz CKGVPOGCQACFQM-IXDOHACOSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(OC)c1 ZINC000185706769 1431211736 /nfs/dbraw/zinc/21/17/36/1431211736.db2.gz CKGVPOGCQACFQM-ULQDDVLXSA-N 2 1 389.540 3.273 20 0 GGADMP COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(OC)c1 ZINC000185706769 1431211738 /nfs/dbraw/zinc/21/17/38/1431211738.db2.gz CKGVPOGCQACFQM-ULQDDVLXSA-N 2 1 389.540 3.273 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)C(=O)N1CCc2sccc2C1 ZINC000185723758 1431216090 /nfs/dbraw/zinc/21/60/90/1431216090.db2.gz WYRMHYTZINPXLZ-ULQDDVLXSA-N 2 1 375.582 3.264 20 0 GGADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C(=O)N1CCc2sccc2C1 ZINC000185723758 1431216092 /nfs/dbraw/zinc/21/60/92/1431216092.db2.gz WYRMHYTZINPXLZ-ULQDDVLXSA-N 2 1 375.582 3.264 20 0 GGADMP CCOCc1ccc(CNC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185726733 1431217138 /nfs/dbraw/zinc/21/71/38/1431217138.db2.gz UFYIONRVORKWJU-RXVVDRJESA-N 2 1 387.568 3.082 20 0 GGADMP CCOCc1ccc(CNC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185726733 1431217140 /nfs/dbraw/zinc/21/71/40/1431217140.db2.gz UFYIONRVORKWJU-RXVVDRJESA-N 2 1 387.568 3.082 20 0 GGADMP C[C@H]([NH2+]C[C@H](O)COCc1ccccc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185733378 1431218599 /nfs/dbraw/zinc/21/85/99/1431218599.db2.gz NUMPTASHWXBNDB-ZWOKBUDYSA-N 2 1 380.960 3.460 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC000185742082 1431220858 /nfs/dbraw/zinc/22/08/58/1431220858.db2.gz UAUPUEWCEGAJFU-ROUUACIJSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC000185742082 1431220862 /nfs/dbraw/zinc/22/08/62/1431220862.db2.gz UAUPUEWCEGAJFU-ROUUACIJSA-N 2 1 386.540 3.194 20 0 GGADMP Cc1cccc(OCCCNC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185750481 1431223705 /nfs/dbraw/zinc/22/37/05/1431223705.db2.gz RHUWLWCFOPFLQY-WOJBJXKFSA-N 2 1 387.568 3.123 20 0 GGADMP Cc1cccc(OCCCNC(=O)C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185750481 1431223709 /nfs/dbraw/zinc/22/37/09/1431223709.db2.gz RHUWLWCFOPFLQY-WOJBJXKFSA-N 2 1 387.568 3.123 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185752379 1431224650 /nfs/dbraw/zinc/22/46/50/1431224650.db2.gz CMQHFWFOCKSKKC-KGLIPLIRSA-N 2 1 394.903 3.429 20 0 GGADMP C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185752379 1431224656 /nfs/dbraw/zinc/22/46/56/1431224656.db2.gz CMQHFWFOCKSKKC-KGLIPLIRSA-N 2 1 394.903 3.429 20 0 GGADMP CCCOc1cccc(CNC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000185764734 1431228635 /nfs/dbraw/zinc/22/86/35/1431228635.db2.gz VDZPCBYUKSIHCT-AZUAARDMSA-N 2 1 387.568 3.334 20 0 GGADMP CCCOc1cccc(CNC(=O)C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185764734 1431228641 /nfs/dbraw/zinc/22/86/41/1431228641.db2.gz VDZPCBYUKSIHCT-AZUAARDMSA-N 2 1 387.568 3.334 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)CC1 ZINC000186272176 1431367708 /nfs/dbraw/zinc/36/77/08/1431367708.db2.gz FFWHTCAHOSRKFA-JOCHJYFZSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)CC1 ZINC000186272161 1431367903 /nfs/dbraw/zinc/36/79/03/1431367903.db2.gz FFWHTCAHOSRKFA-QFIPXVFZSA-N 2 1 386.584 3.413 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)N1CCC([NH+]2CCCC2)CC1)C1CC1 ZINC000186280058 1431370519 /nfs/dbraw/zinc/37/05/19/1431370519.db2.gz XGGOYKBYAJOULO-QFIPXVFZSA-N 2 1 384.568 3.167 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C)C1)C1CC1 ZINC000186280621 1431370749 /nfs/dbraw/zinc/37/07/49/1431370749.db2.gz OBSVCSBBOGINEA-FSSWDIPSSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1)C1CC1 ZINC000186280621 1431370752 /nfs/dbraw/zinc/37/07/52/1431370752.db2.gz OBSVCSBBOGINEA-FSSWDIPSSA-N 2 1 384.568 3.023 20 0 GGADMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1)C1CC1 ZINC000186280621 1431370756 /nfs/dbraw/zinc/37/07/56/1431370756.db2.gz OBSVCSBBOGINEA-FSSWDIPSSA-N 2 1 384.568 3.023 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@@H](C)C[NH+]3CCCCCC3)CC2)cs1 ZINC000186316819 1431380499 /nfs/dbraw/zinc/38/04/99/1431380499.db2.gz NFXRFJFGAYETCB-INIZCTEOSA-N 2 1 378.586 3.044 20 0 GGADMP CCO[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C12CCOCC2 ZINC000186316293 1431380512 /nfs/dbraw/zinc/38/05/12/1431380512.db2.gz IASQMALAVNTNNE-FGZHOGPDSA-N 2 1 390.543 3.396 20 0 GGADMP CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)Nc2ccn(CC[NH+](C)C)n2)c1 ZINC000186560520 1431454583 /nfs/dbraw/zinc/45/45/83/1431454583.db2.gz PQBLIQDFAGGNIK-UHFFFAOYSA-N 2 1 395.511 3.457 20 0 GGADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)C1CCS(=O)(=O)CC1 ZINC000187004155 1431587150 /nfs/dbraw/zinc/58/71/50/1431587150.db2.gz DIIQLTRNTISGQI-ROUUACIJSA-N 2 1 378.582 3.221 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](N[C@@H](C)C(=O)Nc2cc(F)ccc2F)[C@H](C)C1 ZINC000187012709 1431589228 /nfs/dbraw/zinc/58/92/28/1431589228.db2.gz HJLQXRHYLLTTDH-RVKKMQEKSA-N 2 1 383.483 3.018 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)NCc2ccccc2Cl)[C@H](C)C1 ZINC000187018985 1431591787 /nfs/dbraw/zinc/59/17/87/1431591787.db2.gz GOWQWCDNCJZXRE-UWVAXJGDSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C(=O)NCc2ccccc2Cl)[C@H](C)C1 ZINC000187018985 1431591789 /nfs/dbraw/zinc/59/17/89/1431591789.db2.gz GOWQWCDNCJZXRE-UWVAXJGDSA-N 2 1 395.975 3.071 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000187134402 1431627459 /nfs/dbraw/zinc/62/74/59/1431627459.db2.gz JVJCNJWVLYDXCI-KBXCAEBGSA-N 2 1 398.473 3.092 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)[C@H](c1ccccc1)[NH+](C)C ZINC000187176773 1431638337 /nfs/dbraw/zinc/63/83/37/1431638337.db2.gz BEKPNZMCXGPNMS-BPUDTRNYSA-N 2 1 395.547 3.085 20 0 GGADMP C[C@H](NC(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)[C@H](c1ccccc1)[NH+](C)C ZINC000187176773 1431638344 /nfs/dbraw/zinc/63/83/44/1431638344.db2.gz BEKPNZMCXGPNMS-BPUDTRNYSA-N 2 1 395.547 3.085 20 0 GGADMP CN1c2ccc(C[NH2+]C[C@H]3CC[N@@H+](CCc4ccccc4)C3)cc2CCC1=O ZINC000187198112 1431644448 /nfs/dbraw/zinc/64/44/48/1431644448.db2.gz LZWIFGDBLUODHX-OAQYLSRUSA-N 2 1 377.532 3.250 20 0 GGADMP CC[NH+]1CCN(c2cccc(NC(=O)[C@@H]3CC[N@H+](C4CCCCC4)C3)c2)CC1 ZINC000187405681 1431721039 /nfs/dbraw/zinc/72/10/39/1431721039.db2.gz FJSUOGKKXKYRDH-LJQANCHMSA-N 2 1 384.568 3.422 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)NC1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000187445759 1431732286 /nfs/dbraw/zinc/73/22/86/1431732286.db2.gz XXFDVAPTJJWHSF-JOCHJYFZSA-N 2 1 384.568 3.071 20 0 GGADMP CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000187473676 1431742491 /nfs/dbraw/zinc/74/24/91/1431742491.db2.gz YSQWFMBCQAKSNH-JOCHJYFZSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000187476841 1431743346 /nfs/dbraw/zinc/74/33/46/1431743346.db2.gz PCLYHVPACWTUNX-BHIFYINESA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000187476841 1431743350 /nfs/dbraw/zinc/74/33/50/1431743350.db2.gz PCLYHVPACWTUNX-BHIFYINESA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000187476841 1431743352 /nfs/dbraw/zinc/74/33/52/1431743352.db2.gz PCLYHVPACWTUNX-BHIFYINESA-N 2 1 386.584 3.269 20 0 GGADMP C[C@H]([NH2+]Cc1cnc(N2CC[NH+](C)CC2)nc1)C1(c2ccccc2)CCCC1 ZINC000187575680 1431771217 /nfs/dbraw/zinc/77/12/17/1431771217.db2.gz KDCRCADVZGCFCH-IBGZPJMESA-N 2 1 379.552 3.219 20 0 GGADMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)C1CC1 ZINC000187584651 1431773123 /nfs/dbraw/zinc/77/31/23/1431773123.db2.gz YVJFJCVXGVTIRQ-OAQYLSRUSA-N 2 1 386.584 3.459 20 0 GGADMP C[NH+]1CCN(c2ncc(C[NH+]3CCC(c4ccc(Cl)cc4)CC3)cn2)CC1 ZINC000187609705 1431778129 /nfs/dbraw/zinc/77/81/29/1431778129.db2.gz NFSHZIOUCFZUSF-UHFFFAOYSA-N 2 1 385.943 3.261 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000187707153 1431802243 /nfs/dbraw/zinc/80/22/43/1431802243.db2.gz JODUXYCRWQLJRQ-GOSISDBHSA-N 2 1 396.597 3.222 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000187707153 1431802244 /nfs/dbraw/zinc/80/22/44/1431802244.db2.gz JODUXYCRWQLJRQ-GOSISDBHSA-N 2 1 396.597 3.222 20 0 GGADMP C[C@@H](Cc1ccccc1F)[NH2+]Cc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000187801899 1431814229 /nfs/dbraw/zinc/81/42/29/1431814229.db2.gz UCLROAOWBOGSLF-SFHVURJKSA-N 2 1 399.510 3.207 20 0 GGADMP Cc1nccnc1[C@@H](C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000187943747 1431829859 /nfs/dbraw/zinc/82/98/59/1431829859.db2.gz VAZGUBYZGRCHGA-GOSISDBHSA-N 2 1 384.524 3.125 20 0 GGADMP Cc1nccnc1[C@@H](C)[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000187943747 1431829860 /nfs/dbraw/zinc/82/98/60/1431829860.db2.gz VAZGUBYZGRCHGA-GOSISDBHSA-N 2 1 384.524 3.125 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000189004288 1432025494 /nfs/dbraw/zinc/02/54/94/1432025494.db2.gz OPIFPHSJTMQZTJ-LMDPOFIKSA-N 2 1 383.536 3.448 20 0 GGADMP C[C@@H]1C[N@H+](CC2CC[NH+](CCOCC(F)(F)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000189057535 1432036328 /nfs/dbraw/zinc/03/63/28/1432036328.db2.gz FNJGUKBOHPRPOB-OKILXGFUSA-N 2 1 388.421 3.022 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C2CCC(N3C(=O)c4ccccc4C3=O)CC2)C1 ZINC000189150674 1432052766 /nfs/dbraw/zinc/05/27/66/1432052766.db2.gz OENNIVARYYXGAS-VIQWUECVSA-N 2 1 383.536 3.304 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C2CCC(N3C(=O)c4ccccc4C3=O)CC2)C1 ZINC000189150654 1432053023 /nfs/dbraw/zinc/05/30/23/1432053023.db2.gz OENNIVARYYXGAS-LMDPOFIKSA-N 2 1 383.536 3.304 20 0 GGADMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)[C@H](C)C1 ZINC000189209086 1432063934 /nfs/dbraw/zinc/06/39/34/1432063934.db2.gz RHYIRWGVSJGZGW-XMSQKQJNSA-N 2 1 388.531 3.297 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)[C@H](C)C1 ZINC000189209086 1432063940 /nfs/dbraw/zinc/06/39/40/1432063940.db2.gz RHYIRWGVSJGZGW-XMSQKQJNSA-N 2 1 388.531 3.297 20 0 GGADMP CCN(CCC[NH+]1CCCC1)C(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000189581410 1432166006 /nfs/dbraw/zinc/16/60/06/1432166006.db2.gz VKLUTGCVEYRBQS-IBGZPJMESA-N 2 1 388.556 3.420 20 0 GGADMP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000189796529 1432237860 /nfs/dbraw/zinc/23/78/60/1432237860.db2.gz XTTMJQOFTQHOKV-SFHVURJKSA-N 2 1 392.592 3.310 20 0 GGADMP COCC[N@@H+](C)CCCC1CC[NH+]([C@@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000189796529 1432237868 /nfs/dbraw/zinc/23/78/68/1432237868.db2.gz XTTMJQOFTQHOKV-SFHVURJKSA-N 2 1 392.592 3.310 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc3oc(C(=O)OC)cc3c2)[C@H](C)C1 ZINC000189998200 1432301717 /nfs/dbraw/zinc/30/17/17/1432301717.db2.gz SKXVMCUTQCSJMB-APWZRJJASA-N 2 1 388.508 3.446 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccccc2CC)[C@@H](C)C1 ZINC000190007893 1432303644 /nfs/dbraw/zinc/30/36/44/1432303644.db2.gz FYCZMQRYCFHFGU-NSHGMRRFSA-N 2 1 375.557 3.303 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccccc2CC)[C@@H](C)C1 ZINC000190007893 1432303647 /nfs/dbraw/zinc/30/36/47/1432303647.db2.gz FYCZMQRYCFHFGU-NSHGMRRFSA-N 2 1 375.557 3.303 20 0 GGADMP CCN(CCC[NH+](C)C)C(=O)NC[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000190071898 1432314351 /nfs/dbraw/zinc/31/43/51/1432314351.db2.gz CKFHPULDSZDPJH-QFBILLFUSA-N 2 1 398.954 3.455 20 0 GGADMP CC[N@@H+](CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)Cc1c[nH]c2ccccc12 ZINC000190480106 1432389684 /nfs/dbraw/zinc/38/96/84/1432389684.db2.gz YXCBVXRYOFJQPR-QFIPXVFZSA-N 2 1 378.520 3.409 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000190558989 1432406127 /nfs/dbraw/zinc/40/61/27/1432406127.db2.gz XCUSUKQNTNKQAF-SFHVURJKSA-N 2 1 387.568 3.045 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000190559008 1432406190 /nfs/dbraw/zinc/40/61/90/1432406190.db2.gz XCUSUKQNTNKQAF-GOSISDBHSA-N 2 1 387.568 3.045 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(-n2cccn2)cc1C ZINC000190834519 1432500322 /nfs/dbraw/zinc/50/03/22/1432500322.db2.gz NXMLLQSRFPVIBV-FQEVSTJZSA-N 2 1 398.555 3.061 20 0 GGADMP CC(C)N(C)c1ccc(C[NH2+]Cc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)cn1 ZINC000190869146 1432514105 /nfs/dbraw/zinc/51/41/05/1432514105.db2.gz RIHFJVRRNUGCEJ-IBGZPJMESA-N 2 1 382.552 3.437 20 0 GGADMP CC(C)N(C)c1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)cn1 ZINC000190869146 1432514110 /nfs/dbraw/zinc/51/41/10/1432514110.db2.gz RIHFJVRRNUGCEJ-IBGZPJMESA-N 2 1 382.552 3.437 20 0 GGADMP CC[NH+]1CCN(C(=O)CC2CC[NH+](C[C@H]3CCC4(CCCCC4)O3)CC2)CC1 ZINC000190967127 1432539987 /nfs/dbraw/zinc/53/99/87/1432539987.db2.gz DTJVMJDFNAJOHJ-OAQYLSRUSA-N 2 1 391.600 3.135 20 0 GGADMP CCS(=O)(=O)CCCCC[NH2+]C1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000191100015 1432568069 /nfs/dbraw/zinc/56/80/69/1432568069.db2.gz SNXHJMNRRCIZHG-PMSBKCLSSA-N 2 1 380.598 3.338 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cn1 ZINC000191295000 1432623854 /nfs/dbraw/zinc/62/38/54/1432623854.db2.gz KTXBQVKYPGRWOQ-KNQAVFIVSA-N 2 1 382.552 3.307 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cn1 ZINC000191295000 1432623864 /nfs/dbraw/zinc/62/38/64/1432623864.db2.gz KTXBQVKYPGRWOQ-KNQAVFIVSA-N 2 1 382.552 3.307 20 0 GGADMP COc1ccc([C@H]2CCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)c(OC)c1 ZINC000191390680 1432649001 /nfs/dbraw/zinc/64/90/01/1432649001.db2.gz LAWVWWPSUSSFJG-OAQYLSRUSA-N 2 1 375.557 3.257 20 0 GGADMP CCCN(CCC[NH+](C)C)C(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000191412641 1432656527 /nfs/dbraw/zinc/65/65/27/1432656527.db2.gz KDRZWSLXSVVKHT-GOSISDBHSA-N 2 1 376.545 3.275 20 0 GGADMP COc1ccccc1C[N@@H+](CCCN1CC[NH+](C(C)C)CC1)C[C@@H]1CCCO1 ZINC000191436547 1432661607 /nfs/dbraw/zinc/66/16/07/1432661607.db2.gz GSHUWBLZENYFSU-QFIPXVFZSA-N 2 1 389.584 3.092 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000191481898 1432669339 /nfs/dbraw/zinc/66/93/39/1432669339.db2.gz WHBMBWYFTFHYTN-UHFFFAOYSA-N 2 1 398.555 3.182 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000191481898 1432669347 /nfs/dbraw/zinc/66/93/47/1432669347.db2.gz WHBMBWYFTFHYTN-UHFFFAOYSA-N 2 1 398.555 3.182 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000191484908 1432669795 /nfs/dbraw/zinc/66/97/95/1432669795.db2.gz TUBFSZJDEZTJFG-INIZCTEOSA-N 2 1 385.512 3.143 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000191484908 1432669801 /nfs/dbraw/zinc/66/98/01/1432669801.db2.gz TUBFSZJDEZTJFG-INIZCTEOSA-N 2 1 385.512 3.143 20 0 GGADMP CC(C)C[N@@H+](CCCN1CC[NH+](C(C)C)CC1)C[C@@H](O)c1ccc(F)cc1 ZINC000191510641 1432675805 /nfs/dbraw/zinc/67/58/05/1432675805.db2.gz MNVOHBKRXFIKAE-JOCHJYFZSA-N 2 1 379.564 3.233 20 0 GGADMP CC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)CC1CCN(c2ccccn2)CC1 ZINC000191519595 1432677694 /nfs/dbraw/zinc/67/76/94/1432677694.db2.gz JRBDVTNNQQTAKT-UHFFFAOYSA-N 2 1 387.616 3.036 20 0 GGADMP CCOC(=O)c1csc(CC[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000191561814 1432683120 /nfs/dbraw/zinc/68/31/20/1432683120.db2.gz FBYGYJXUZMREGB-GBESFXJTSA-N 2 1 399.560 3.363 20 0 GGADMP C[C@@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191601825 1432690159 /nfs/dbraw/zinc/69/01/59/1432690159.db2.gz KSYSQQXYCDYYPK-CVDCTZTESA-N 2 1 392.547 3.040 20 0 GGADMP C[C@@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191601825 1432690165 /nfs/dbraw/zinc/69/01/65/1432690165.db2.gz KSYSQQXYCDYYPK-CVDCTZTESA-N 2 1 392.547 3.040 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CCCO2)C[C@@H]1C ZINC000191834337 1432735940 /nfs/dbraw/zinc/73/59/40/1432735940.db2.gz LWFXKKXUBHKMEK-VXSCBNMQSA-N 2 1 388.552 3.235 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)C[C@@H]1C ZINC000191834337 1432735947 /nfs/dbraw/zinc/73/59/47/1432735947.db2.gz LWFXKKXUBHKMEK-VXSCBNMQSA-N 2 1 388.552 3.235 20 0 GGADMP O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)[C@@H]1CC[NH+](C2CCCCC2)C1 ZINC000192232422 1432820374 /nfs/dbraw/zinc/82/03/74/1432820374.db2.gz VWCHSXOCSAJOQX-GGAORHGYSA-N 2 1 399.579 3.048 20 0 GGADMP O=C(NC[C@H]1C[NH+](Cc2ccccc2)CCCO1)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000192232422 1432820376 /nfs/dbraw/zinc/82/03/76/1432820376.db2.gz VWCHSXOCSAJOQX-GGAORHGYSA-N 2 1 399.579 3.048 20 0 GGADMP O=C(NC[C@H]1C[NH+](Cc2ccccc2)CCCO1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000192232422 1432820377 /nfs/dbraw/zinc/82/03/77/1432820377.db2.gz VWCHSXOCSAJOQX-GGAORHGYSA-N 2 1 399.579 3.048 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(SC)cc1OC ZINC000192682467 1432874976 /nfs/dbraw/zinc/87/49/76/1432874976.db2.gz WMRGEZOUBVNLRB-MRXNPFEDSA-N 2 1 394.585 3.297 20 0 GGADMP CC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1cc(Br)ccc1O ZINC000192750337 1432884370 /nfs/dbraw/zinc/88/43/70/1432884370.db2.gz SMHMEAYWDZFYNH-UHFFFAOYSA-N 2 1 398.389 3.393 20 0 GGADMP CN(CC[N@@H+](C)Cc1cccc(C(=O)OC(C)(C)C)c1)C1CC[NH+](C)CC1 ZINC000192779942 1432889620 /nfs/dbraw/zinc/88/96/20/1432889620.db2.gz UUGYYEVASKHFKQ-UHFFFAOYSA-N 2 1 375.557 3.100 20 0 GGADMP Cc1c(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(=O)n(-c2ccccc2)n1C ZINC000192929563 1432909286 /nfs/dbraw/zinc/90/92/86/1432909286.db2.gz PAXIOKGJHWBVNI-OAQYLSRUSA-N 2 1 390.531 3.096 20 0 GGADMP Cc1c(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(=O)n(-c2ccccc2)n1C ZINC000192929563 1432909288 /nfs/dbraw/zinc/90/92/88/1432909288.db2.gz PAXIOKGJHWBVNI-OAQYLSRUSA-N 2 1 390.531 3.096 20 0 GGADMP COC(=O)COc1c(C)cc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000192934194 1432909955 /nfs/dbraw/zinc/90/99/55/1432909955.db2.gz XHYZKKGLHIFQPF-NRFANRHFSA-N 2 1 396.531 3.467 20 0 GGADMP c1coc(-c2ncc(C[NH2+]CCN3CC[NH+](Cc4ccccc4)CC3)s2)c1 ZINC000192982802 1432916892 /nfs/dbraw/zinc/91/68/92/1432916892.db2.gz DCANWERNXZDRRO-UHFFFAOYSA-N 2 1 382.533 3.311 20 0 GGADMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]CCCc1ccc2c(c1)CCO2 ZINC000193311762 1432977458 /nfs/dbraw/zinc/97/74/58/1432977458.db2.gz MSSZJVIEBKZSJS-QHCPKHFHSA-N 2 1 380.532 3.301 20 0 GGADMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]CCCc1ccc2c(c1)CCO2 ZINC000193311747 1432977488 /nfs/dbraw/zinc/97/74/88/1432977488.db2.gz MSSZJVIEBKZSJS-HSZRJFAPSA-N 2 1 380.532 3.301 20 0 GGADMP O=C1c2ccccc2CCN1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000193336622 1432981767 /nfs/dbraw/zinc/98/17/67/1432981767.db2.gz LQEYWDICFKEMTK-NOTZXAQLSA-N 2 1 389.543 3.470 20 0 GGADMP C[N@H+](CCOc1ccccc1F)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000193713879 1433045439 /nfs/dbraw/zinc/04/54/39/1433045439.db2.gz OSOHPLAHASYFOX-UHFFFAOYSA-N 2 1 399.510 3.049 20 0 GGADMP C[N@@H+](CCOc1ccccc1F)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000193713879 1433045441 /nfs/dbraw/zinc/04/54/41/1433045441.db2.gz OSOHPLAHASYFOX-UHFFFAOYSA-N 2 1 399.510 3.049 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCC[NH+]1Cc1ccccc1 ZINC000193803086 1433063005 /nfs/dbraw/zinc/06/30/05/1433063005.db2.gz KHCMSUMYDUWTHC-PKTZIBPZSA-N 2 1 377.532 3.289 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000193803086 1433063008 /nfs/dbraw/zinc/06/30/08/1433063008.db2.gz KHCMSUMYDUWTHC-PKTZIBPZSA-N 2 1 377.532 3.289 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000193803086 1433063012 /nfs/dbraw/zinc/06/30/12/1433063012.db2.gz KHCMSUMYDUWTHC-PKTZIBPZSA-N 2 1 377.532 3.289 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[N@@H+]1CCc2sccc2C1 ZINC000193835985 1433069611 /nfs/dbraw/zinc/06/96/11/1433069611.db2.gz XNPCEAMHFMJDRZ-OAHLLOKOSA-N 2 1 378.586 3.057 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[N@H+]1CCc2sccc2C1 ZINC000193835985 1433069615 /nfs/dbraw/zinc/06/96/15/1433069615.db2.gz XNPCEAMHFMJDRZ-OAHLLOKOSA-N 2 1 378.586 3.057 20 0 GGADMP Cc1ccc(NCCCNC(=O)N(Cc2ccco2)C2CC[NH+](C)CC2)[nH+]c1 ZINC000193848069 1433072323 /nfs/dbraw/zinc/07/23/23/1433072323.db2.gz VBVPHFBHCWKQOO-UHFFFAOYSA-N 2 1 385.512 3.091 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000193929673 1433086719 /nfs/dbraw/zinc/08/67/19/1433086719.db2.gz ZVJWHHCVGOHNSD-SIKLNZKXSA-N 2 1 398.526 3.250 20 0 GGADMP O=C(NC1CC[NH+](CCc2ccccc2)CC1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000194051273 1433107621 /nfs/dbraw/zinc/10/76/21/1433107621.db2.gz DHSPDFRJOVLUIP-XMMPIXPASA-N 2 1 391.559 3.474 20 0 GGADMP Cn1cc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000194062672 1433110147 /nfs/dbraw/zinc/11/01/47/1433110147.db2.gz KSXHKQVTOQYUNA-UHFFFAOYSA-N 2 1 396.535 3.212 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000194069735 1433111378 /nfs/dbraw/zinc/11/13/78/1433111378.db2.gz YFPLXTASMAJJRD-DENIHFKCSA-N 2 1 398.526 3.250 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NCCCC[N@H+]3C[C@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000194163300 1433129279 /nfs/dbraw/zinc/12/92/79/1433129279.db2.gz JWSTWCBDABJWPW-BGYRXZFFSA-N 2 1 386.584 3.481 20 0 GGADMP Cc1ccc(N2CCC(C(=O)NCCCC[N@@H+]3C[C@H](C)C[C@H](C)C3)CC2)[nH+]c1 ZINC000194163300 1433129284 /nfs/dbraw/zinc/12/92/84/1433129284.db2.gz JWSTWCBDABJWPW-BGYRXZFFSA-N 2 1 386.584 3.481 20 0 GGADMP O=C(NCCCCC[NH+]1CCCCC1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194188682 1433134737 /nfs/dbraw/zinc/13/47/37/1433134737.db2.gz YVFJDMBCBJUGBL-JOCHJYFZSA-N 2 1 386.584 3.464 20 0 GGADMP C[N@@H+](CCNC(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)Cc1ccc(F)cc1 ZINC000194225628 1433142872 /nfs/dbraw/zinc/14/28/72/1433142872.db2.gz CJSDJNZHQBVDAY-NRFANRHFSA-N 2 1 398.526 3.079 20 0 GGADMP C[NH+](CCNC(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)Cc1ccc(F)cc1 ZINC000194225628 1433142878 /nfs/dbraw/zinc/14/28/78/1433142878.db2.gz CJSDJNZHQBVDAY-NRFANRHFSA-N 2 1 398.526 3.079 20 0 GGADMP C[NH+](CCNC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)Cc1ccc(F)cc1 ZINC000194225628 1433142883 /nfs/dbraw/zinc/14/28/83/1433142883.db2.gz CJSDJNZHQBVDAY-NRFANRHFSA-N 2 1 398.526 3.079 20 0 GGADMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(Cl)c(OC)c1 ZINC000194402417 1433172627 /nfs/dbraw/zinc/17/26/27/1433172627.db2.gz FADAQOYFEVXQIJ-MRXNPFEDSA-N 2 1 382.936 3.228 20 0 GGADMP Cc1ccc(CN(CC[NH+](C)C)C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000194416013 1433174742 /nfs/dbraw/zinc/17/47/42/1433174742.db2.gz NREOVSOPTYOARR-OAQYLSRUSA-N 2 1 398.551 3.183 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](C2CCCCC2)CC1 ZINC000194420571 1433175182 /nfs/dbraw/zinc/17/51/82/1433175182.db2.gz KWAVBVKLFWNHGL-OAQYLSRUSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000194433603 1433177205 /nfs/dbraw/zinc/17/72/05/1433177205.db2.gz MZCZWXKRLWASHJ-QHCPKHFHSA-N 2 1 392.547 3.036 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000194433603 1433177206 /nfs/dbraw/zinc/17/72/06/1433177206.db2.gz MZCZWXKRLWASHJ-QHCPKHFHSA-N 2 1 392.547 3.036 20 0 GGADMP C[NH+](C)CCN(Cc1ccccc1)C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194439955 1433178418 /nfs/dbraw/zinc/17/84/18/1433178418.db2.gz GRKVQUGKBSMZJP-HSZRJFAPSA-N 2 1 394.563 3.282 20 0 GGADMP C[NH+](C)CCN(Cc1ccccc1)C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194439941 1433178424 /nfs/dbraw/zinc/17/84/24/1433178424.db2.gz GRKVQUGKBSMZJP-QHCPKHFHSA-N 2 1 394.563 3.282 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[NH+](C2CCCC2)CC1 ZINC000194445453 1433179257 /nfs/dbraw/zinc/17/92/57/1433179257.db2.gz DBDIABDUGJVEPT-OAQYLSRUSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000194445453 1433179258 /nfs/dbraw/zinc/17/92/58/1433179258.db2.gz DBDIABDUGJVEPT-OAQYLSRUSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000194445453 1433179260 /nfs/dbraw/zinc/17/92/60/1433179260.db2.gz DBDIABDUGJVEPT-OAQYLSRUSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000194449009 1433179870 /nfs/dbraw/zinc/17/98/70/1433179870.db2.gz IINXCDVZRAPBAX-FGZHOGPDSA-N 2 1 384.568 3.168 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000194447878 1433179882 /nfs/dbraw/zinc/17/98/82/1433179882.db2.gz HQCKYHKWGKADQV-QZNHQXDQSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000194447878 1433179883 /nfs/dbraw/zinc/17/98/83/1433179883.db2.gz HQCKYHKWGKADQV-QZNHQXDQSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000194447878 1433179884 /nfs/dbraw/zinc/17/98/84/1433179884.db2.gz HQCKYHKWGKADQV-QZNHQXDQSA-N 2 1 396.579 3.167 20 0 GGADMP C[N@@H+]1CCN(C(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC000194449416 1433179896 /nfs/dbraw/zinc/17/98/96/1433179896.db2.gz SLGLNMRGRRYTCQ-GMAHTHKFSA-N 2 1 392.547 3.207 20 0 GGADMP C[N@H+]1CCN(C(=O)NC[C@@H]2CC[NH+](Cc3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC000194449416 1433179897 /nfs/dbraw/zinc/17/98/97/1433179897.db2.gz SLGLNMRGRRYTCQ-GMAHTHKFSA-N 2 1 392.547 3.207 20 0 GGADMP C[NH+]1CCN(C(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC000194449416 1433179898 /nfs/dbraw/zinc/17/98/98/1433179898.db2.gz SLGLNMRGRRYTCQ-GMAHTHKFSA-N 2 1 392.547 3.207 20 0 GGADMP C[NH+]1CCN(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC000194449416 1433179899 /nfs/dbraw/zinc/17/98/99/1433179899.db2.gz SLGLNMRGRRYTCQ-GMAHTHKFSA-N 2 1 392.547 3.207 20 0 GGADMP O=C(C[N@H+]1CC[C@@H](c2ccccc2)C1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000194643328 1433210194 /nfs/dbraw/zinc/21/01/94/1433210194.db2.gz NNBQXYCIGOXOSM-HSZRJFAPSA-N 2 1 377.532 3.388 20 0 GGADMP C[C@@H](C(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCc2ccccc2C1 ZINC000194746815 1433223646 /nfs/dbraw/zinc/22/36/46/1433223646.db2.gz KHUKHDLSTZZERB-FPOVZHCZSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@@H](C(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCc2ccccc2C1 ZINC000194746815 1433223649 /nfs/dbraw/zinc/22/36/49/1433223649.db2.gz KHUKHDLSTZZERB-FPOVZHCZSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@@H](C(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000194746815 1433223652 /nfs/dbraw/zinc/22/36/52/1433223652.db2.gz KHUKHDLSTZZERB-FPOVZHCZSA-N 2 1 377.532 3.072 20 0 GGADMP C[C@@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCc2ccccc2C1 ZINC000194746815 1433223655 /nfs/dbraw/zinc/22/36/55/1433223655.db2.gz KHUKHDLSTZZERB-FPOVZHCZSA-N 2 1 377.532 3.072 20 0 GGADMP O=C(C1CC[NH+](C2CC2)CC1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000194767680 1433228063 /nfs/dbraw/zinc/22/80/63/1433228063.db2.gz ZSRNQGZUOCXWNJ-GGAORHGYSA-N 2 1 381.564 3.374 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)C1CC[NH+](C2CC2)CC1 ZINC000194809012 1433237264 /nfs/dbraw/zinc/23/72/64/1433237264.db2.gz YUCPKZJIVOCOOG-NRFANRHFSA-N 2 1 385.552 3.080 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000194879341 1433254779 /nfs/dbraw/zinc/25/47/79/1433254779.db2.gz CGSWYQZZXWTGDE-WBVHZDCISA-N 2 1 375.542 3.025 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000194879358 1433254808 /nfs/dbraw/zinc/25/48/08/1433254808.db2.gz CGSWYQZZXWTGDE-DOTOQJQBSA-N 2 1 375.542 3.025 20 0 GGADMP Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000194879322 1433254843 /nfs/dbraw/zinc/25/48/43/1433254843.db2.gz CGSWYQZZXWTGDE-RDJZCZTQSA-N 2 1 375.542 3.025 20 0 GGADMP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](C)Cn1cc[nH+]c1C)c1ccsc1 ZINC000194891647 1433258344 /nfs/dbraw/zinc/25/83/44/1433258344.db2.gz PMTXCPLGTIJNLK-YJBOKZPZSA-N 2 1 377.558 3.271 20 0 GGADMP CC(C)(C)[NH+]1CCC(NC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000194925816 1433265876 /nfs/dbraw/zinc/26/58/76/1433265876.db2.gz PZQAFBRNOATMAH-GOSISDBHSA-N 2 1 375.532 3.417 20 0 GGADMP COC(=O)COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000195132923 1433297055 /nfs/dbraw/zinc/29/70/55/1433297055.db2.gz MAJXMGLLTAWWSN-ICSRJNTNSA-N 2 1 382.504 3.411 20 0 GGADMP COC(=O)COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195132923 1433297059 /nfs/dbraw/zinc/29/70/59/1433297059.db2.gz MAJXMGLLTAWWSN-ICSRJNTNSA-N 2 1 382.504 3.411 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)NC[C@H]2C[NH+](CC(C)C)CCO2)cc1)C(C)C ZINC000195459363 1433332428 /nfs/dbraw/zinc/33/24/28/1433332428.db2.gz MMHQDQCWONYOEU-NRFANRHFSA-N 2 1 375.557 3.004 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)NC[C@H]2C[N@H+](CC(C)C)CCO2)cc1)C(C)C ZINC000195459363 1433332430 /nfs/dbraw/zinc/33/24/30/1433332430.db2.gz MMHQDQCWONYOEU-NRFANRHFSA-N 2 1 375.557 3.004 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)NC[C@H]2C[N@@H+](CC(C)C)CCO2)cc1)C(C)C ZINC000195459363 1433332432 /nfs/dbraw/zinc/33/24/32/1433332432.db2.gz MMHQDQCWONYOEU-NRFANRHFSA-N 2 1 375.557 3.004 20 0 GGADMP C[NH+](C)[C@@H](CNC(=O)NCCC[N@@H+](C)C1CCCCC1)c1cccc(F)c1 ZINC000195601121 1433341221 /nfs/dbraw/zinc/34/12/21/1433341221.db2.gz HQHPVCWDKQOLTK-FQEVSTJZSA-N 2 1 378.536 3.382 20 0 GGADMP O=C(NCC[N@H+]1CCc2ccccc2C1)N[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000195606503 1433341261 /nfs/dbraw/zinc/34/12/61/1433341261.db2.gz XTPDQFGAZYSQLL-HSZRJFAPSA-N 2 1 392.547 3.009 20 0 GGADMP O=C(NCC[NH+]1CCc2ccccc2C1)N[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000195606503 1433341262 /nfs/dbraw/zinc/34/12/62/1433341262.db2.gz XTPDQFGAZYSQLL-HSZRJFAPSA-N 2 1 392.547 3.009 20 0 GGADMP O=C(NCC[NH+]1CCc2ccccc2C1)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000195606503 1433341265 /nfs/dbraw/zinc/34/12/65/1433341265.db2.gz XTPDQFGAZYSQLL-HSZRJFAPSA-N 2 1 392.547 3.009 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000195631076 1433342393 /nfs/dbraw/zinc/34/23/93/1433342393.db2.gz LTMXCXSSCJOZLM-UHFFFAOYSA-N 2 1 392.975 3.433 20 0 GGADMP O=C(NCCC[NH+]1CCCCC1)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000195631076 1433342396 /nfs/dbraw/zinc/34/23/96/1433342396.db2.gz LTMXCXSSCJOZLM-UHFFFAOYSA-N 2 1 392.975 3.433 20 0 GGADMP CC(C)c1ccc([C@H]([NH3+])CNC(=O)C[C@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC000236821913 1433380042 /nfs/dbraw/zinc/38/00/42/1433380042.db2.gz ICFPXWBRHRXDAM-XZOQPEGZSA-N 2 1 395.547 3.217 20 0 GGADMP CC(C)c1ccc([C@H]([NH3+])CNC(=O)C[C@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC000236821913 1433380044 /nfs/dbraw/zinc/38/00/44/1433380044.db2.gz ICFPXWBRHRXDAM-XZOQPEGZSA-N 2 1 395.547 3.217 20 0 GGADMP CC[N@H+](C)[C@@H](C(=O)Nc1cccc(C(=O)OC[C@@H]2CCC[NH2+]2)c1)c1ccccc1 ZINC000236886928 1433382158 /nfs/dbraw/zinc/38/21/58/1433382158.db2.gz CANODWPEBAPXPM-LEWJYISDSA-N 2 1 395.503 3.227 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)Nc1cccc(C(=O)OC[C@@H]2CCC[NH2+]2)c1)c1ccccc1 ZINC000236886928 1433382160 /nfs/dbraw/zinc/38/21/60/1433382160.db2.gz CANODWPEBAPXPM-LEWJYISDSA-N 2 1 395.503 3.227 20 0 GGADMP CC[N@H+](C)[C@@H](C(=O)Nc1ccc(C(=O)OC2CC[NH2+]CC2)cc1)c1ccccc1 ZINC000236886730 1433382202 /nfs/dbraw/zinc/38/22/02/1433382202.db2.gz VFPLOSDJSAITMQ-OAQYLSRUSA-N 2 1 395.503 3.227 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)Nc1ccc(C(=O)OC2CC[NH2+]CC2)cc1)c1ccccc1 ZINC000236886730 1433382205 /nfs/dbraw/zinc/38/22/05/1433382205.db2.gz VFPLOSDJSAITMQ-OAQYLSRUSA-N 2 1 395.503 3.227 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C[C@@H](C)[C@H]3CCC[NH2+]C3)CC2)cs1 ZINC000237042701 1433387144 /nfs/dbraw/zinc/38/71/44/1433387144.db2.gz JSPCUTLKRIVRLN-AEFFLSMTSA-N 2 1 392.613 3.060 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)C[C@H](C)[C@@H]3CCC[NH2+]C3)CC2)cs1 ZINC000237042855 1433387177 /nfs/dbraw/zinc/38/71/77/1433387177.db2.gz JSPCUTLKRIVRLN-FUHWJXTLSA-N 2 1 392.613 3.060 20 0 GGADMP C[NH+](C)CCN1CCC(C[NH2+]Cc2cc(Cl)ccc2OC(F)F)CC1 ZINC000237157743 1433390910 /nfs/dbraw/zinc/39/09/10/1433390910.db2.gz KKCSKQIGSUZYIY-UHFFFAOYSA-N 2 1 375.891 3.305 20 0 GGADMP COCCC[NH+]1CCC([NH2+]Cc2c(C)nn(-c3ccc(F)cc3F)c2C)CC1 ZINC000237206003 1433392532 /nfs/dbraw/zinc/39/25/32/1433392532.db2.gz QLHMXXGTAJOBEG-UHFFFAOYSA-N 2 1 392.494 3.358 20 0 GGADMP COc1cccc([C@H](C)[NH+]2CCN(C(=O)CC[C@H]([NH3+])c3ccccc3)CC2)c1 ZINC000237310531 1433396583 /nfs/dbraw/zinc/39/65/83/1433396583.db2.gz RISITLALVAAVSR-AVRDEDQJSA-N 2 1 381.520 3.381 20 0 GGADMP C[C@@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)N1CCN(c2ccccc2)CC1 ZINC000237335551 1433397938 /nfs/dbraw/zinc/39/79/38/1433397938.db2.gz UNFJAIRZUNTKGQ-QFIPXVFZSA-N 2 1 392.591 3.451 20 0 GGADMP C[C@@H](CC(=O)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1)[C@@H]1CCC[NH2+]C1 ZINC000237352333 1433398831 /nfs/dbraw/zinc/39/88/31/1433398831.db2.gz QEHREKMDBLNTAB-PKOBYXMFSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@@H](CC(=O)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1)[C@@H]1CCC[NH2+]C1 ZINC000237352333 1433398833 /nfs/dbraw/zinc/39/88/33/1433398833.db2.gz QEHREKMDBLNTAB-PKOBYXMFSA-N 2 1 377.960 3.400 20 0 GGADMP C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2Cc3ccccc3C[NH2+]2)CC[N@H+]1Cc1ccccc1 ZINC000237479943 1433405523 /nfs/dbraw/zinc/40/55/23/1433405523.db2.gz FEWQFABQGXNARI-LEOXJPRUSA-N 2 1 377.532 3.212 20 0 GGADMP C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2[NH2+]CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000237490302 1433405844 /nfs/dbraw/zinc/40/58/44/1433405844.db2.gz MAQGMVSYUSUOGM-JMUQELJHSA-N 2 1 377.532 3.385 20 0 GGADMP C[C@@H](CCNC(=O)C1(c2ccccc2)CC[NH2+]CC1)[N@@H+](C)Cc1ccccc1 ZINC000237559155 1433409603 /nfs/dbraw/zinc/40/96/03/1433409603.db2.gz HOIJKOGXNUFWPD-FQEVSTJZSA-N 2 1 379.548 3.335 20 0 GGADMP C[C@@]1(C(=O)NC2CC[NH+](Cc3cccc(C(F)(F)F)c3)CC2)CCC[NH2+]C1 ZINC000237571701 1433410272 /nfs/dbraw/zinc/41/02/72/1433410272.db2.gz XVCWVQKOQKUBDV-LJQANCHMSA-N 2 1 383.458 3.176 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)[C@@H]3CCCCCC[C@@H]3[NH3+])cc2)C[C@H](C)O1 ZINC000237631145 1433413580 /nfs/dbraw/zinc/41/35/80/1433413580.db2.gz KJBAEGLJOQAVNY-OSZJIOELSA-N 2 1 387.568 3.210 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)CC[C@H]([NH3+])c3ccccc3)cc2)C[C@H](C)O1 ZINC000237630432 1433413782 /nfs/dbraw/zinc/41/37/82/1433413782.db2.gz IBELCPYIUSPFGF-YYDVJCTNSA-N 2 1 395.547 3.392 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(C[NH2+]Cc3cccc4c3OCCO4)cc2)C[C@H](C)O1 ZINC000237781161 1433423822 /nfs/dbraw/zinc/42/38/22/1433423822.db2.gz ZLFPLHVIZLVZBE-HDICACEKSA-N 2 1 382.504 3.357 20 0 GGADMP N[C@@H](C(=O)NC[C@@H](c1c(F)cccc1Cl)N1CCCC1)c1ccccc1 ZINC000237825701 1433426565 /nfs/dbraw/zinc/42/65/65/1433426565.db2.gz PPFBDFWNFUAWRN-PKOBYXMFSA-N 2 1 375.875 3.432 20 0 GGADMP Fc1ccc(N2CCN(CC[NH2+]C3CC[NH+](Cc4ccccc4)CC3)CC2)cc1 ZINC000237856860 1433429453 /nfs/dbraw/zinc/42/94/53/1433429453.db2.gz HXYWZFNNLOUODZ-UHFFFAOYSA-N 2 1 396.554 3.202 20 0 GGADMP [NH3+][C@H](CC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000237872733 1433430380 /nfs/dbraw/zinc/43/03/80/1433430380.db2.gz DCSJESLGTHGDPA-RBUKOAKNSA-N 2 1 391.437 3.486 20 0 GGADMP [NH3+]C1(C(=O)NC2CC[NH+](Cc3cccc(C(F)(F)F)c3)CC2)CCCCC1 ZINC000237907634 1433433661 /nfs/dbraw/zinc/43/36/61/1433433661.db2.gz PJIGTPZKPSICCY-UHFFFAOYSA-N 2 1 383.458 3.448 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cccc4[nH]ccc43)c2)C1 ZINC000237922509 1433434734 /nfs/dbraw/zinc/43/47/34/1433434734.db2.gz DLRJMEXXDQGKCG-HXUWFJFHSA-N 2 1 376.504 3.155 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cccc4cc[nH]c43)c2)C1 ZINC000237922552 1433434740 /nfs/dbraw/zinc/43/47/40/1433434740.db2.gz GKAMDYRAFNHIBU-OAQYLSRUSA-N 2 1 376.504 3.155 20 0 GGADMP O=C([C@@H]1CC12CC[NH2+]CC2)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000237934393 1433435628 /nfs/dbraw/zinc/43/56/28/1433435628.db2.gz SGMBRDCGYYWYSV-QFIPXVFZSA-N 2 1 389.543 3.310 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cccc4cc[nH]c43)c2)C1 ZINC000237939418 1433435916 /nfs/dbraw/zinc/43/59/16/1433435916.db2.gz GKAMDYRAFNHIBU-NRFANRHFSA-N 2 1 376.504 3.155 20 0 GGADMP [NH3+][C@@H](CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000238016176 1433439609 /nfs/dbraw/zinc/43/96/09/1433439609.db2.gz OEKQPZIVZZAXLI-ICSRJNTNSA-N 2 1 391.437 3.257 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+]C/C=C/c2ccccc2)c1 ZINC000238021255 1433439622 /nfs/dbraw/zinc/43/96/22/1433439622.db2.gz CBRXWLXITYLWLH-WEVVVXLNSA-N 2 1 379.504 3.150 20 0 GGADMP [NH3+]Cc1nc(C(=O)NC[C@@H](c2ccccc2)N2CCc3sccc3C2)cs1 ZINC000238079164 1433442210 /nfs/dbraw/zinc/44/22/10/1433442210.db2.gz QDLKDCRCCZSNNZ-KRWDZBQOSA-N 2 1 398.557 3.193 20 0 GGADMP COc1ccc(C[NH+]2CCC(CNC(=O)[C@@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC000245201415 1433454762 /nfs/dbraw/zinc/45/47/62/1433454762.db2.gz IWRQDYHMZQEHMP-CEXWTWQISA-N 2 1 387.568 3.285 20 0 GGADMP CCC[N@H+](C)C[C@H]1CCN(C(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245413133 1433463089 /nfs/dbraw/zinc/46/30/89/1433463089.db2.gz AXWGBXDOSSGVSX-TZIWHRDSSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245413133 1433463093 /nfs/dbraw/zinc/46/30/93/1433463093.db2.gz AXWGBXDOSSGVSX-TZIWHRDSSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000245413133 1433463096 /nfs/dbraw/zinc/46/30/96/1433463096.db2.gz AXWGBXDOSSGVSX-TZIWHRDSSA-N 2 1 375.532 3.371 20 0 GGADMP CCC[NH+](C)C[C@H]1CCN(C(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000245413133 1433463101 /nfs/dbraw/zinc/46/31/01/1433463101.db2.gz AXWGBXDOSSGVSX-TZIWHRDSSA-N 2 1 375.532 3.371 20 0 GGADMP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245427925 1433466128 /nfs/dbraw/zinc/46/61/28/1433466128.db2.gz WLQGCTSCMLOBJE-PZJWPPBQSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccc(F)cc2)C1 ZINC000245427925 1433466129 /nfs/dbraw/zinc/46/61/29/1433466129.db2.gz WLQGCTSCMLOBJE-PZJWPPBQSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC000245427925 1433466130 /nfs/dbraw/zinc/46/61/30/1433466130.db2.gz WLQGCTSCMLOBJE-PZJWPPBQSA-N 2 1 375.532 3.417 20 0 GGADMP CC(C)[NH+]1CCC[C@@H](CNC(=O)[C@H]2CCCC[N@H+]2Cc2ccc(F)cc2)C1 ZINC000245427925 1433466131 /nfs/dbraw/zinc/46/61/31/1433466131.db2.gz WLQGCTSCMLOBJE-PZJWPPBQSA-N 2 1 375.532 3.417 20 0 GGADMP CC[NH+](C)C[C@@H]1CC[NH+](Cc2ccccc2CN2CC[C@@H](C[N@H+](C)CC)C2)C1 ZINC000245450678 1433470056 /nfs/dbraw/zinc/47/00/56/1433470056.db2.gz OVYMLUOFWOXPCW-VXKWHMMOSA-N 2 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(Cc2ccccc2C[N@@H+]2CC[C@@H](C[NH+](C)CC)C2)C1 ZINC000245450678 1433470059 /nfs/dbraw/zinc/47/00/59/1433470059.db2.gz OVYMLUOFWOXPCW-VXKWHMMOSA-N 4 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(Cc2ccccc2C[N@H+]2CC[C@@H](C[NH+](C)CC)C2)C1 ZINC000245450678 1433470063 /nfs/dbraw/zinc/47/00/63/1433470063.db2.gz OVYMLUOFWOXPCW-VXKWHMMOSA-N 4 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(Cc2ccccc2CN2CC[C@@H](C[N@@H+](C)CC)C2)C1 ZINC000245450678 1433470069 /nfs/dbraw/zinc/47/00/69/1433470069.db2.gz OVYMLUOFWOXPCW-VXKWHMMOSA-N 4 1 386.628 3.234 20 0 GGADMP CC[NH+](C)C[C@@H]1CCN(Cc2ccccc2CN2CC[C@@H](C[N@H+](C)CC)C2)C1 ZINC000245450678 1433470072 /nfs/dbraw/zinc/47/00/72/1433470072.db2.gz OVYMLUOFWOXPCW-VXKWHMMOSA-N 4 1 386.628 3.234 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000245455439 1433471526 /nfs/dbraw/zinc/47/15/26/1433471526.db2.gz IBSBIEDMYHNRCT-QZTJIDSGSA-N 2 1 381.586 3.100 20 0 GGADMP COc1cccc(CNC(=O)[C@H](C)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000245457853 1433471928 /nfs/dbraw/zinc/47/19/28/1433471928.db2.gz UOINFBCMCXFHHF-SIKLNZKXSA-N 2 1 395.547 3.154 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000245461002 1433472403 /nfs/dbraw/zinc/47/24/03/1433472403.db2.gz MQZBDORQPDUTDS-CEXWTWQISA-N 2 1 395.613 3.346 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3F)C2=O)[C@@H](C)C1 ZINC000245572657 1433486881 /nfs/dbraw/zinc/48/68/81/1433486881.db2.gz COFVDUQPJGOAQC-YSIASYRMSA-N 2 1 391.531 3.048 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3F)C2=O)[C@@H](C)C1 ZINC000245572657 1433486882 /nfs/dbraw/zinc/48/68/82/1433486882.db2.gz COFVDUQPJGOAQC-YSIASYRMSA-N 2 1 391.531 3.048 20 0 GGADMP Cc1ccc(N2CCC(NC(=O)N[C@H](C)C[NH+]3C[C@H](C)C[C@@H](C)C3)CC2)[nH+]c1 ZINC000245587267 1433488282 /nfs/dbraw/zinc/48/82/82/1433488282.db2.gz AOFNKMAJGSYSOO-GUDVDZBRSA-N 2 1 387.572 3.024 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000245587914 1433488342 /nfs/dbraw/zinc/48/83/42/1433488342.db2.gz APEALCAWCLEXEH-QZTJIDSGSA-N 2 1 378.586 3.258 20 0 GGADMP C[C@@H]1CC[N@H+]([C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C[C@H]1n1ccnc1 ZINC000245600630 1433489758 /nfs/dbraw/zinc/48/97/58/1433489758.db2.gz MIETWTNQLDUGIK-FSPWUOQZSA-N 2 1 376.863 3.364 20 0 GGADMP C[C@@H]1CCN([C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C[C@H]1n1ccnc1 ZINC000245600630 1433489759 /nfs/dbraw/zinc/48/97/59/1433489759.db2.gz MIETWTNQLDUGIK-FSPWUOQZSA-N 2 1 376.863 3.364 20 0 GGADMP CC[N@H+]1CCCC[C@@H]1C(=O)NC[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245644869 1433494990 /nfs/dbraw/zinc/49/49/90/1433494990.db2.gz AZKLBUCFSAIZEZ-ATZDWAIDSA-N 2 1 381.923 3.463 20 0 GGADMP CC[NH+]1CCCC[C@@H]1C(=O)NC[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245644869 1433494991 /nfs/dbraw/zinc/49/49/91/1433494991.db2.gz AZKLBUCFSAIZEZ-ATZDWAIDSA-N 2 1 381.923 3.463 20 0 GGADMP CC[NH+]1CCCC[C@@H]1C(=O)NC[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245644869 1433494992 /nfs/dbraw/zinc/49/49/92/1433494992.db2.gz AZKLBUCFSAIZEZ-ATZDWAIDSA-N 2 1 381.923 3.463 20 0 GGADMP C[C@H](OCCCNC(=O)C[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1)c1ccccc1 ZINC000245721801 1433505854 /nfs/dbraw/zinc/50/58/54/1433505854.db2.gz UVBIXZFDCQENJX-SVFBPWRDSA-N 2 1 384.524 3.050 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)NC[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)C1 ZINC000245732678 1433507397 /nfs/dbraw/zinc/50/73/97/1433507397.db2.gz UDIITGUTTGWWAY-MDZRGWNJSA-N 2 1 396.938 3.208 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)NC[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)C1 ZINC000245732671 1433507433 /nfs/dbraw/zinc/50/74/33/1433507433.db2.gz UDIITGUTTGWWAY-FRQCXROJSA-N 2 1 396.938 3.208 20 0 GGADMP C[NH+](C)[C@@H]1CCCN(C(=O)NC[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)C1 ZINC000245732669 1433507601 /nfs/dbraw/zinc/50/76/01/1433507601.db2.gz UDIITGUTTGWWAY-FCEWJHQRSA-N 2 1 396.938 3.208 20 0 GGADMP COc1ccc([C@@H](CO)[N@@H+](C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000245731670 1433507630 /nfs/dbraw/zinc/50/76/30/1433507630.db2.gz JVVUHOVUJUQKNX-XMMPIXPASA-N 2 1 397.563 3.391 20 0 GGADMP C[C@H](C(=O)N1CCC[C@H]1c1cccs1)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245823193 1433521982 /nfs/dbraw/zinc/52/19/82/1433521982.db2.gz FCVUZCSVQYXOOB-SQNIBIBYSA-N 2 1 386.565 3.488 20 0 GGADMP C[C@H](C(=O)N1CCC[C@H]1c1cccs1)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245823193 1433521987 /nfs/dbraw/zinc/52/19/87/1433521987.db2.gz FCVUZCSVQYXOOB-SQNIBIBYSA-N 2 1 386.565 3.488 20 0 GGADMP CCC[C@@H]1CN(C(=O)NC[C@H]2CC[NH+](C3CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000245840046 1433525101 /nfs/dbraw/zinc/52/51/01/1433525101.db2.gz DGFCJBQHFRQQIW-IFMALSPDSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[C@@H]1CN(C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000245840046 1433525108 /nfs/dbraw/zinc/52/51/08/1433525108.db2.gz DGFCJBQHFRQQIW-IFMALSPDSA-N 2 1 384.568 3.167 20 0 GGADMP CCC[C@@H]1CN(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CC[NH+]1Cc1ccccc1 ZINC000245840046 1433525112 /nfs/dbraw/zinc/52/51/12/1433525112.db2.gz DGFCJBQHFRQQIW-IFMALSPDSA-N 2 1 384.568 3.167 20 0 GGADMP Cc1ccc([C@H](CNC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)[NH+]2CCCC2)cc1 ZINC000245883731 1433533925 /nfs/dbraw/zinc/53/39/25/1433533925.db2.gz BJRPSJNXXCDJBL-BDTNDASRSA-N 2 1 384.568 3.258 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)C[C@H](C)O1 ZINC000245896461 1433536557 /nfs/dbraw/zinc/53/65/57/1433536557.db2.gz DBMGERDWVRDHNH-ZSYWTGECSA-N 2 1 383.577 3.159 20 0 GGADMP C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000245934456 1433546795 /nfs/dbraw/zinc/54/67/95/1433546795.db2.gz IUVAVILXLFFPFL-QWFCFKBJSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000245934456 1433546799 /nfs/dbraw/zinc/54/67/99/1433546799.db2.gz IUVAVILXLFFPFL-QWFCFKBJSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000245934456 1433546803 /nfs/dbraw/zinc/54/68/03/1433546803.db2.gz IUVAVILXLFFPFL-QWFCFKBJSA-N 2 1 390.597 3.086 20 0 GGADMP C[C@H](CNC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000245945982 1433548823 /nfs/dbraw/zinc/54/88/23/1433548823.db2.gz NVEFXRXRTFUFDA-QRVBRYPASA-N 2 1 387.572 3.027 20 0 GGADMP COc1ccc(-c2noc([C@@H](C)[N@H+]3CCC[C@@H](Cc4nccn4C)C3)n2)cc1 ZINC000245984937 1433553368 /nfs/dbraw/zinc/55/33/68/1433553368.db2.gz WCMPYUVFRGTTGA-CVEARBPZSA-N 2 1 381.480 3.494 20 0 GGADMP Cn1ccnc1C[C@H]1CCC[N@H+]([C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1 ZINC000246091777 1433567292 /nfs/dbraw/zinc/56/72/92/1433567292.db2.gz JQXQLYHLGRAJQF-KDOFPFPSSA-N 2 1 390.890 3.273 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccccc1N(C)C ZINC000246093547 1433567662 /nfs/dbraw/zinc/56/76/62/1433567662.db2.gz IUSGZDIQJOFJTQ-WIYYLYMNSA-N 2 1 394.563 3.301 20 0 GGADMP Cn1cc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000246124873 1433572078 /nfs/dbraw/zinc/57/20/78/1433572078.db2.gz KNUNDOCINJKVCB-ICSRJNTNSA-N 2 1 396.535 3.165 20 0 GGADMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@H](C)c1ccc(F)cc1F ZINC000246148684 1433574919 /nfs/dbraw/zinc/57/49/19/1433574919.db2.gz KAWFHBNQZQASNK-WBVHZDCISA-N 2 1 382.499 3.083 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000246150512 1433575341 /nfs/dbraw/zinc/57/53/41/1433575341.db2.gz KEVGMETXLRVZNQ-QUCCMNQESA-N 2 1 375.561 3.268 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000246150512 1433575346 /nfs/dbraw/zinc/57/53/46/1433575346.db2.gz KEVGMETXLRVZNQ-QUCCMNQESA-N 2 1 375.561 3.268 20 0 GGADMP C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000246182680 1433579007 /nfs/dbraw/zinc/57/90/07/1433579007.db2.gz HJPSXTBIHDFVHK-OXJNMPFZSA-N 2 1 392.975 3.286 20 0 GGADMP C[C@H](CC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1)[C@H]1CCC[NH2+]C1 ZINC000246234590 1433584907 /nfs/dbraw/zinc/58/49/07/1433584907.db2.gz ICRQSLNIWHNTGA-AYBZRNKSSA-N 2 1 397.485 3.422 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)C1 ZINC000246290969 1433590506 /nfs/dbraw/zinc/59/05/06/1433590506.db2.gz DFLVCIRKEKWUEB-GUDVDZBRSA-N 2 1 376.545 3.178 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)C1 ZINC000246290969 1433590509 /nfs/dbraw/zinc/59/05/09/1433590509.db2.gz DFLVCIRKEKWUEB-GUDVDZBRSA-N 2 1 376.545 3.178 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000246316697 1433593920 /nfs/dbraw/zinc/59/39/20/1433593920.db2.gz NUZOLTJLQHXJII-RTBURBONSA-N 2 1 376.545 3.180 20 0 GGADMP CC(C)C[NH+]1CCC(NC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)CC1 ZINC000246320492 1433594506 /nfs/dbraw/zinc/59/45/06/1433594506.db2.gz GVJSKQOQIYWALT-VQTJNVASSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)C1 ZINC000246323792 1433594873 /nfs/dbraw/zinc/59/48/73/1433594873.db2.gz HFCYWTSWALHWAU-PWRODBHTSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)C1 ZINC000246323792 1433594876 /nfs/dbraw/zinc/59/48/76/1433594876.db2.gz HFCYWTSWALHWAU-PWRODBHTSA-N 2 1 378.605 3.403 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)C1 ZINC000246323792 1433594879 /nfs/dbraw/zinc/59/48/79/1433594879.db2.gz HFCYWTSWALHWAU-PWRODBHTSA-N 2 1 378.605 3.403 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)N(C)[C@@H]2CC[NH+](C)C[C@H]2C)C1 ZINC000246324771 1433595206 /nfs/dbraw/zinc/59/52/06/1433595206.db2.gz NFKOUIQCZAEYKK-WOIUINJBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)C1 ZINC000246324771 1433595209 /nfs/dbraw/zinc/59/52/09/1433595209.db2.gz NFKOUIQCZAEYKK-WOIUINJBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)C1 ZINC000246324771 1433595212 /nfs/dbraw/zinc/59/52/12/1433595212.db2.gz NFKOUIQCZAEYKK-WOIUINJBSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000246327230 1433595578 /nfs/dbraw/zinc/59/55/78/1433595578.db2.gz HPQYKVVMDPSWCF-MOPGFXCFSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000246327230 1433595580 /nfs/dbraw/zinc/59/55/80/1433595580.db2.gz HPQYKVVMDPSWCF-MOPGFXCFSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCC(=O)NC(=O)Nc2ccccc2)C1 ZINC000246327230 1433595583 /nfs/dbraw/zinc/59/55/83/1433595583.db2.gz HPQYKVVMDPSWCF-MOPGFXCFSA-N 2 1 386.540 3.311 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000246340314 1433597482 /nfs/dbraw/zinc/59/74/82/1433597482.db2.gz HXFDJXJRQFATKN-PABCKOPISA-N 2 1 398.595 3.413 20 0 GGADMP CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000246362977 1433600646 /nfs/dbraw/zinc/60/06/46/1433600646.db2.gz PWJICHCDRKNZFZ-MSOLQXFVSA-N 2 1 385.487 3.088 20 0 GGADMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000246362977 1433600650 /nfs/dbraw/zinc/60/06/50/1433600650.db2.gz PWJICHCDRKNZFZ-MSOLQXFVSA-N 2 1 385.487 3.088 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NC2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000246364050 1433601059 /nfs/dbraw/zinc/60/10/59/1433601059.db2.gz KNEUPJHIHQLRQB-ZJOUEHCJSA-N 2 1 386.584 3.126 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000246372415 1433602321 /nfs/dbraw/zinc/60/23/21/1433602321.db2.gz HRGQRJRNNBWUMG-YLJYHZDGSA-N 2 1 378.536 3.096 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1S(C)(=O)=O ZINC000246374064 1433603005 /nfs/dbraw/zinc/60/30/05/1433603005.db2.gz JOSXMMDPNIVJOP-SJORKVTESA-N 2 1 382.570 3.117 20 0 GGADMP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)ccc1S(C)(=O)=O ZINC000246374064 1433603006 /nfs/dbraw/zinc/60/30/06/1433603006.db2.gz JOSXMMDPNIVJOP-SJORKVTESA-N 2 1 382.570 3.117 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000246393121 1433605764 /nfs/dbraw/zinc/60/57/64/1433605764.db2.gz CLQPLYGOMNDZOB-HJNYFJLDSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000246393121 1433605768 /nfs/dbraw/zinc/60/57/68/1433605768.db2.gz CLQPLYGOMNDZOB-HJNYFJLDSA-N 2 1 386.584 3.413 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000246393121 1433605773 /nfs/dbraw/zinc/60/57/73/1433605773.db2.gz CLQPLYGOMNDZOB-HJNYFJLDSA-N 2 1 386.584 3.413 20 0 GGADMP O=C([C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246398606 1433606950 /nfs/dbraw/zinc/60/69/50/1433606950.db2.gz JXSCVAJKBJFJQT-XJUOHMSHSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[NH+](Cc2ccccc2)C1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246398606 1433606956 /nfs/dbraw/zinc/60/69/56/1433606956.db2.gz JXSCVAJKBJFJQT-XJUOHMSHSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[NH+](Cc2ccccc2)C1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246398606 1433606962 /nfs/dbraw/zinc/60/69/62/1433606962.db2.gz JXSCVAJKBJFJQT-XJUOHMSHSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246398595 1433607025 /nfs/dbraw/zinc/60/70/25/1433607025.db2.gz JXSCVAJKBJFJQT-QZNHQXDQSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[NH+](Cc2ccccc2)C1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246398595 1433607026 /nfs/dbraw/zinc/60/70/26/1433607026.db2.gz JXSCVAJKBJFJQT-QZNHQXDQSA-N 2 1 381.564 3.374 20 0 GGADMP O=C([C@@H]1CCC[NH+](Cc2ccccc2)C1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246398595 1433607027 /nfs/dbraw/zinc/60/70/27/1433607027.db2.gz JXSCVAJKBJFJQT-QZNHQXDQSA-N 2 1 381.564 3.374 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246400289 1433607425 /nfs/dbraw/zinc/60/74/25/1433607425.db2.gz PXXJQCUFDSKHGW-SVFBPWRDSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246400289 1433607427 /nfs/dbraw/zinc/60/74/27/1433607427.db2.gz PXXJQCUFDSKHGW-SVFBPWRDSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246400289 1433607431 /nfs/dbraw/zinc/60/74/31/1433607431.db2.gz PXXJQCUFDSKHGW-SVFBPWRDSA-N 2 1 376.589 3.157 20 0 GGADMP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+][C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000246402954 1433607566 /nfs/dbraw/zinc/60/75/66/1433607566.db2.gz LWLNBCJXNNEANW-BBTUJRGHSA-N 2 1 375.557 3.363 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000246403791 1433608042 /nfs/dbraw/zinc/60/80/42/1433608042.db2.gz LMZNQBXFSGYLTO-NJDAHSKKSA-N 2 1 378.605 3.260 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)C1 ZINC000246403791 1433608045 /nfs/dbraw/zinc/60/80/45/1433608045.db2.gz LMZNQBXFSGYLTO-NJDAHSKKSA-N 2 1 378.605 3.260 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)C1 ZINC000246403791 1433608047 /nfs/dbraw/zinc/60/80/47/1433608047.db2.gz LMZNQBXFSGYLTO-NJDAHSKKSA-N 2 1 378.605 3.260 20 0 GGADMP Cc1ccc(CN(C(=O)CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C2CC2)cc1 ZINC000246433028 1433612127 /nfs/dbraw/zinc/61/21/27/1433612127.db2.gz CSEVMELWRZTZSF-NZQKXSOJSA-N 2 1 381.564 3.435 20 0 GGADMP c1ccc(-c2nnn(CCCCC[N@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)n2)cc1 ZINC000246441757 1433613656 /nfs/dbraw/zinc/61/36/56/1433613656.db2.gz DGAGIQABMHPXAM-UNMCSNQZSA-N 2 1 394.567 3.459 20 0 GGADMP c1ccc(-c2nnn(CCCCC[NH+]3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)n2)cc1 ZINC000246441757 1433613657 /nfs/dbraw/zinc/61/36/57/1433613657.db2.gz DGAGIQABMHPXAM-UNMCSNQZSA-N 2 1 394.567 3.459 20 0 GGADMP c1ccc(-c2nnn(CCCCC[NH+]3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)n2)cc1 ZINC000246441757 1433613658 /nfs/dbraw/zinc/61/36/58/1433613658.db2.gz DGAGIQABMHPXAM-UNMCSNQZSA-N 2 1 394.567 3.459 20 0 GGADMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000246463990 1433616528 /nfs/dbraw/zinc/61/65/28/1433616528.db2.gz PLOXKBGGDZDHIP-UNMCSNQZSA-N 2 1 384.568 3.297 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000246463990 1433616532 /nfs/dbraw/zinc/61/65/32/1433616532.db2.gz PLOXKBGGDZDHIP-UNMCSNQZSA-N 2 1 384.568 3.297 20 0 GGADMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246463990 1433616536 /nfs/dbraw/zinc/61/65/36/1433616536.db2.gz PLOXKBGGDZDHIP-UNMCSNQZSA-N 2 1 384.568 3.297 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246513386 1433623815 /nfs/dbraw/zinc/62/38/15/1433623815.db2.gz UFJIKSGWEUCPGP-SVFBPWRDSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246513386 1433623816 /nfs/dbraw/zinc/62/38/16/1433623816.db2.gz UFJIKSGWEUCPGP-SVFBPWRDSA-N 2 1 376.589 3.013 20 0 GGADMP CC(C)C[NH+]1CCC[C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246513386 1433623817 /nfs/dbraw/zinc/62/38/17/1433623817.db2.gz UFJIKSGWEUCPGP-SVFBPWRDSA-N 2 1 376.589 3.013 20 0 GGADMP C[C@H](NC1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000246531563 1433626219 /nfs/dbraw/zinc/62/62/19/1433626219.db2.gz VIXWHEDKERUVPB-OFAXGOBFSA-N 2 1 389.584 3.046 20 0 GGADMP CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000246542317 1433627893 /nfs/dbraw/zinc/62/78/93/1433627893.db2.gz WNKWDMDQQGUSND-VQTJNVASSA-N 2 1 390.572 3.474 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246542582 1433628654 /nfs/dbraw/zinc/62/86/54/1433628654.db2.gz JYCPHTHWAFMFGY-NAMDQGSHSA-N 2 1 384.564 3.390 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246542582 1433628659 /nfs/dbraw/zinc/62/86/59/1433628659.db2.gz JYCPHTHWAFMFGY-NAMDQGSHSA-N 2 1 384.564 3.390 20 0 GGADMP O[C@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246542582 1433628663 /nfs/dbraw/zinc/62/86/63/1433628663.db2.gz JYCPHTHWAFMFGY-NAMDQGSHSA-N 2 1 384.564 3.390 20 0 GGADMP CS[C@@H]1CCCC[N@H+]([C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000246546065 1433628841 /nfs/dbraw/zinc/62/88/41/1433628841.db2.gz KEDPHPVZERCBKK-WIYYLYMNSA-N 2 1 389.609 3.373 20 0 GGADMP CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)C1 ZINC000246553294 1433630449 /nfs/dbraw/zinc/63/04/49/1433630449.db2.gz WEGSIBXAGAFVFP-SFHLNBCPSA-N 2 1 387.568 3.004 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)C1 ZINC000246553294 1433630451 /nfs/dbraw/zinc/63/04/51/1433630451.db2.gz WEGSIBXAGAFVFP-SFHLNBCPSA-N 2 1 387.568 3.004 20 0 GGADMP C[C@@H]1C[C@H](NC(=O)N2CC[C@@H](C[NH+]3CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000246572781 1433633370 /nfs/dbraw/zinc/63/33/70/1433633370.db2.gz STNZSXQEGHTJMS-BAGYTPMASA-N 2 1 384.568 3.167 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CC[C@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000246579689 1433634452 /nfs/dbraw/zinc/63/44/52/1433634452.db2.gz ZSEVEIKWXIPEFS-RBBKRZOGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000246579689 1433634457 /nfs/dbraw/zinc/63/44/57/1433634457.db2.gz ZSEVEIKWXIPEFS-RBBKRZOGSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)C1 ZINC000246579689 1433634465 /nfs/dbraw/zinc/63/44/65/1433634465.db2.gz ZSEVEIKWXIPEFS-RBBKRZOGSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589450 1433635547 /nfs/dbraw/zinc/63/55/47/1433635547.db2.gz AZXMUHMGMBBZDO-VAMGGRTRSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589450 1433635551 /nfs/dbraw/zinc/63/55/51/1433635551.db2.gz AZXMUHMGMBBZDO-VAMGGRTRSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589450 1433635557 /nfs/dbraw/zinc/63/55/57/1433635557.db2.gz AZXMUHMGMBBZDO-VAMGGRTRSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc3[nH]ccc32)C1 ZINC000246589450 1433635560 /nfs/dbraw/zinc/63/55/60/1433635560.db2.gz AZXMUHMGMBBZDO-VAMGGRTRSA-N 2 1 385.552 3.494 20 0 GGADMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[C@@H]([NH+]4CCCC4)CC3)cc2)C[C@@H](C)O1 ZINC000246613932 1433639380 /nfs/dbraw/zinc/63/93/80/1433639380.db2.gz COXUXSOREQIGTG-TXTKFYIRSA-N 2 1 399.579 3.386 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)C[N@H+]1C1CC1 ZINC000246639237 1433643616 /nfs/dbraw/zinc/64/36/16/1433643616.db2.gz YBRQWPFDPFOMPD-AFULGHPHSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)C[NH+]1C1CC1 ZINC000246639237 1433643618 /nfs/dbraw/zinc/64/36/18/1433643618.db2.gz YBRQWPFDPFOMPD-AFULGHPHSA-N 2 1 384.568 3.067 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)C[NH+]1C1CC1 ZINC000246639237 1433643620 /nfs/dbraw/zinc/64/36/20/1433643620.db2.gz YBRQWPFDPFOMPD-AFULGHPHSA-N 2 1 384.568 3.067 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NC[C@H](c3cccs3)[NH+]3CCCC3)CC[C@@H]21 ZINC000246710679 1433653693 /nfs/dbraw/zinc/65/36/93/1433653693.db2.gz FFDYWEHTGVGFNE-FGTMMUONSA-N 2 1 376.570 3.011 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000246719528 1433655028 /nfs/dbraw/zinc/65/50/28/1433655028.db2.gz UZEYEZJZCSSYAY-YOUFYPILSA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000246719528 1433655030 /nfs/dbraw/zinc/65/50/30/1433655030.db2.gz UZEYEZJZCSSYAY-YOUFYPILSA-N 2 1 376.589 3.013 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000246719528 1433655033 /nfs/dbraw/zinc/65/50/33/1433655033.db2.gz UZEYEZJZCSSYAY-YOUFYPILSA-N 2 1 376.589 3.013 20 0 GGADMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H](C)C[NH+]2C[C@H](C)C[C@@H](C)C2)C1 ZINC000246721095 1433655411 /nfs/dbraw/zinc/65/54/11/1433655411.db2.gz IFFQHPGEDGPKHS-NCXUSEDFSA-N 2 1 375.561 3.158 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccc(F)cc1 ZINC000246757466 1433661375 /nfs/dbraw/zinc/66/13/75/1433661375.db2.gz XWKUUIDGOHPDMG-IOMROCGXSA-N 2 1 388.531 3.087 20 0 GGADMP CC[N@@H+](C)[C@H](C(=O)NC1CC[NH+]([C@H](C)c2ccncc2)CC1)c1ccccc1 ZINC000246803240 1433669709 /nfs/dbraw/zinc/66/97/09/1433669709.db2.gz MYCJKPSOONNQGZ-GCJKJVERSA-N 2 1 380.536 3.416 20 0 GGADMP CC[N@@H+](C)[C@@H](C(=O)NC1CC[NH+]([C@H](C)c2ccncc2)CC1)c1ccccc1 ZINC000246803250 1433669835 /nfs/dbraw/zinc/66/98/35/1433669835.db2.gz MYCJKPSOONNQGZ-XMSQKQJNSA-N 2 1 380.536 3.416 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](N[C@@H]2CCCN(c3ccc(C)cc3)C2=O)[C@@H](C)C1 ZINC000246823747 1433674238 /nfs/dbraw/zinc/67/42/38/1433674238.db2.gz ATERRRXOIBYULA-ILWGZMRPSA-N 2 1 387.568 3.217 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccc(C)cc3)C2=O)[C@@H](C)C1 ZINC000246823747 1433674243 /nfs/dbraw/zinc/67/42/43/1433674243.db2.gz ATERRRXOIBYULA-ILWGZMRPSA-N 2 1 387.568 3.217 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccc(C)cc3)C2=O)[C@@H](C)C1 ZINC000246823747 1433674251 /nfs/dbraw/zinc/67/42/51/1433674251.db2.gz ATERRRXOIBYULA-ILWGZMRPSA-N 2 1 387.568 3.217 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)c1 ZINC000246835634 1433676222 /nfs/dbraw/zinc/67/62/22/1433676222.db2.gz BWSBKKBHOKGYGK-IXDOHACOSA-N 2 1 377.529 3.131 20 0 GGADMP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC000246835634 1433676225 /nfs/dbraw/zinc/67/62/25/1433676225.db2.gz BWSBKKBHOKGYGK-IXDOHACOSA-N 2 1 377.529 3.131 20 0 GGADMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000246872704 1433680900 /nfs/dbraw/zinc/68/09/00/1433680900.db2.gz DARYLRMTUZYZGI-QXAKKESOSA-N 2 1 381.586 3.241 20 0 GGADMP C[N@H+]1CCC[C@@H]2CN(C(=O)NC[C@@H]3CCC[NH+](Cc4cccs4)C3)CC[C@H]21 ZINC000246894979 1433684063 /nfs/dbraw/zinc/68/40/63/1433684063.db2.gz MDJNCUSCWVZLBW-NLWGTHIKSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CCC[C@@H]2CN(C(=O)NC[C@@H]3CCC[N@H+](Cc4cccs4)C3)CC[C@H]21 ZINC000246894979 1433684066 /nfs/dbraw/zinc/68/40/66/1433684066.db2.gz MDJNCUSCWVZLBW-NLWGTHIKSA-N 2 1 390.597 3.086 20 0 GGADMP C[NH+]1CCC[C@@H]2CN(C(=O)NC[C@@H]3CCC[N@@H+](Cc4cccs4)C3)CC[C@H]21 ZINC000246894979 1433684070 /nfs/dbraw/zinc/68/40/70/1433684070.db2.gz MDJNCUSCWVZLBW-NLWGTHIKSA-N 2 1 390.597 3.086 20 0 GGADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N2CCOC2=O)cc1 ZINC000246910026 1433686520 /nfs/dbraw/zinc/68/65/20/1433686520.db2.gz FVLSHXWQUBBSSB-FGTMMUONSA-N 2 1 375.513 3.183 20 0 GGADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)C1 ZINC000247210449 1433691480 /nfs/dbraw/zinc/69/14/80/1433691480.db2.gz WXBQYRNEVNYWCF-MSOLQXFVSA-N 2 1 381.586 3.100 20 0 GGADMP C[C@H]([NH2+]CCCN1CC[N@@H+](C)C[C@H]1c1ccccc1)c1ccc([S@@](C)=O)cc1 ZINC000247227993 1433692916 /nfs/dbraw/zinc/69/29/16/1433692916.db2.gz YBIOCPUUIMHXOY-ZZLYJBIYSA-N 2 1 399.604 3.453 20 0 GGADMP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1)c1ccsc1 ZINC000247260025 1433697462 /nfs/dbraw/zinc/69/74/62/1433697462.db2.gz RPIGETCCQNBPMJ-YTQUADARSA-N 2 1 378.586 3.257 20 0 GGADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@H]2CCC[N@@H+](C)C2)C1 ZINC000247261915 1433697967 /nfs/dbraw/zinc/69/79/67/1433697967.db2.gz XDFKEFGJDTUSDQ-VAMGGRTRSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)NC[C@H]2CCC[NH+](C)C2)C1 ZINC000247261905 1433698191 /nfs/dbraw/zinc/69/81/91/1433698191.db2.gz XDFKEFGJDTUSDQ-HSALFYBXSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@H]2CCC[N@H+](C)C2)C1 ZINC000247261905 1433698196 /nfs/dbraw/zinc/69/81/96/1433698196.db2.gz XDFKEFGJDTUSDQ-HSALFYBXSA-N 2 1 386.584 3.306 20 0 GGADMP C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC[C@H]2CCC[N@@H+](C)C2)C1 ZINC000247261905 1433698199 /nfs/dbraw/zinc/69/81/99/1433698199.db2.gz XDFKEFGJDTUSDQ-HSALFYBXSA-N 2 1 386.584 3.306 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H](NC(=O)Nc2cccc(C[NH+](C)C)c2)[C@@H](C)C1 ZINC000247271978 1433698518 /nfs/dbraw/zinc/69/85/18/1433698518.db2.gz RGZAAEOFNNGMJX-FXAWDEMLSA-N 2 1 376.545 3.007 20 0 GGADMP CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000247292507 1433701181 /nfs/dbraw/zinc/70/11/81/1433701181.db2.gz UNAPDHMOCNOJBK-IFMALSPDSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000247292507 1433701186 /nfs/dbraw/zinc/70/11/86/1433701186.db2.gz UNAPDHMOCNOJBK-IFMALSPDSA-N 2 1 386.584 3.413 20 0 GGADMP CC(C)[NH+]1CCC[C@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000247292507 1433701192 /nfs/dbraw/zinc/70/11/92/1433701192.db2.gz UNAPDHMOCNOJBK-IFMALSPDSA-N 2 1 386.584 3.413 20 0 GGADMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCC(C)CC2)C1 ZINC000247328384 1433707049 /nfs/dbraw/zinc/70/70/49/1433707049.db2.gz MFWNNXADTDSKAD-RBBKRZOGSA-N 2 1 386.584 3.443 20 0 GGADMP C[NH+]1CCC[C@H]2C[NH+](CCCCCC[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C)C3)CC[C@H]21 ZINC000247348771 1433711030 /nfs/dbraw/zinc/71/10/30/1433711030.db2.gz YAFGOAGETMJLIC-NVPYSNMXSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@H]2C[NH+](CCCCCC[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C)C3)CC[C@H]21 ZINC000247348771 1433711037 /nfs/dbraw/zinc/71/10/37/1433711037.db2.gz YAFGOAGETMJLIC-NVPYSNMXSA-N 4 1 390.660 3.379 20 0 GGADMP C[NH+]1CCC[C@H]2C[NH+](CCCCCC[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C)C3)CC[C@H]21 ZINC000247348771 1433711048 /nfs/dbraw/zinc/71/10/48/1433711048.db2.gz YAFGOAGETMJLIC-NVPYSNMXSA-N 4 1 390.660 3.379 20 0 GGADMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000247496575 1433730069 /nfs/dbraw/zinc/73/00/69/1433730069.db2.gz WTRGGQBTJAJDIX-FGZHOGPDSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@@H]1CCCC[NH+]1CCNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000247496575 1433730074 /nfs/dbraw/zinc/73/00/74/1433730074.db2.gz WTRGGQBTJAJDIX-FGZHOGPDSA-N 2 1 386.584 3.414 20 0 GGADMP CC[C@@H]1CCCC[NH+]1CCNC(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000247496575 1433730077 /nfs/dbraw/zinc/73/00/77/1433730077.db2.gz WTRGGQBTJAJDIX-FGZHOGPDSA-N 2 1 386.584 3.414 20 0 GGADMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@H](C)[NH+]3[C@H](C)CC[C@H]3C)CC2)cs1 ZINC000247508639 1433731132 /nfs/dbraw/zinc/73/11/32/1433731132.db2.gz PAOCPDIQIDRNLQ-ZACQAIPSSA-N 2 1 392.613 3.295 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCCN(c2ccn(C)n2)C1=O ZINC000247519388 1433732433 /nfs/dbraw/zinc/73/24/33/1433732433.db2.gz ZYZSIBKXAHZHKZ-NQIIRXRSSA-N 2 1 395.551 3.080 20 0 GGADMP Cc1ccc([C@H](OC[C@H](O)C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c2ccccc2)cc1 ZINC000247516357 1433732622 /nfs/dbraw/zinc/73/26/22/1433732622.db2.gz WIFRYPABMYXVDI-TUACAJSNSA-N 2 1 382.548 3.345 20 0 GGADMP CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CC[C@@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000247523706 1433732925 /nfs/dbraw/zinc/73/29/25/1433732925.db2.gz ZHBRPRWXHFPQSG-IFMALSPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000247523706 1433732934 /nfs/dbraw/zinc/73/29/34/1433732934.db2.gz ZHBRPRWXHFPQSG-IFMALSPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[NH+]1CC[C@H](CNC(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)C1 ZINC000247523706 1433732942 /nfs/dbraw/zinc/73/29/42/1433732942.db2.gz ZHBRPRWXHFPQSG-IFMALSPDSA-N 2 1 386.584 3.270 20 0 GGADMP CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000247525813 1433733420 /nfs/dbraw/zinc/73/34/20/1433733420.db2.gz ZKOIXJCUXXMRDI-FCHUYYIVSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000247525813 1433733430 /nfs/dbraw/zinc/73/34/30/1433733430.db2.gz ZKOIXJCUXXMRDI-FCHUYYIVSA-N 2 1 386.584 3.128 20 0 GGADMP CC(C)C[NH+]1CC[C@@H](CNC(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000247525813 1433733440 /nfs/dbraw/zinc/73/34/40/1433733440.db2.gz ZKOIXJCUXXMRDI-FCHUYYIVSA-N 2 1 386.584 3.128 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000247621631 1433740787 /nfs/dbraw/zinc/74/07/87/1433740787.db2.gz TWNNQMKIXRTURE-IWQHBPENSA-N 2 1 397.567 3.283 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000247621631 1433740791 /nfs/dbraw/zinc/74/07/91/1433740791.db2.gz TWNNQMKIXRTURE-IWQHBPENSA-N 2 1 397.567 3.283 20 0 GGADMP C[N@@H+](C[C@@H](O)COc1cccc2[nH]ccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000247645316 1433742633 /nfs/dbraw/zinc/74/26/33/1433742633.db2.gz WAPPYKSCFQVZSH-NHCUHLMSSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C[C@@H](O)COc1cccc2[nH]ccc21)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000247645316 1433742634 /nfs/dbraw/zinc/74/26/34/1433742634.db2.gz WAPPYKSCFQVZSH-NHCUHLMSSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C[C@@H](O)COc1cccc2[nH]ccc21)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000247645316 1433742635 /nfs/dbraw/zinc/74/26/35/1433742635.db2.gz WAPPYKSCFQVZSH-NHCUHLMSSA-N 2 1 393.531 3.362 20 0 GGADMP C[NH+](C)C1(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCN2C(=O)OC(C)(C)C)CCOCC1 ZINC000247878286 1433754676 /nfs/dbraw/zinc/75/46/76/1433754676.db2.gz ZGGWOGTVWTWSDM-OTWHNJEPSA-N 2 1 395.588 3.255 20 0 GGADMP C[NH+](C)C1(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCN2C(=O)OC(C)(C)C)CCOCC1 ZINC000247878285 1433754754 /nfs/dbraw/zinc/75/47/54/1433754754.db2.gz ZGGWOGTVWTWSDM-IPMKNSEASA-N 2 1 395.588 3.255 20 0 GGADMP C[C@@H](CNC(=O)N1CCC(CC[N@H+]2CCCC[C@H]2C)CC1)C[NH+]1CCCC1 ZINC000247883444 1433755093 /nfs/dbraw/zinc/75/50/93/1433755093.db2.gz CGVKUTLCZZJFJX-VQTJNVASSA-N 2 1 378.605 3.404 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)NC[C@H]2CC[NH+](C3CC3)C2)CC1 ZINC000247891890 1433755436 /nfs/dbraw/zinc/75/54/36/1433755436.db2.gz FODIKUCJCJSHEE-UYAOXDASSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000247891890 1433755442 /nfs/dbraw/zinc/75/54/42/1433755442.db2.gz FODIKUCJCJSHEE-UYAOXDASSA-N 2 1 376.589 3.157 20 0 GGADMP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)CC1 ZINC000247891890 1433755446 /nfs/dbraw/zinc/75/54/46/1433755446.db2.gz FODIKUCJCJSHEE-UYAOXDASSA-N 2 1 376.589 3.157 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000247929064 1433757114 /nfs/dbraw/zinc/75/71/14/1433757114.db2.gz BWBZWDGXLVGXRQ-VSKRKVRLSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000247929064 1433757120 /nfs/dbraw/zinc/75/71/20/1433757120.db2.gz BWBZWDGXLVGXRQ-VSKRKVRLSA-N 2 1 384.568 3.024 20 0 GGADMP C[NH+]1CCC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000247929064 1433757126 /nfs/dbraw/zinc/75/71/26/1433757126.db2.gz BWBZWDGXLVGXRQ-VSKRKVRLSA-N 2 1 384.568 3.024 20 0 GGADMP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H]2CO)nnn1-c1ccc(Cl)cc1 ZINC000247968037 1433759896 /nfs/dbraw/zinc/75/98/96/1433759896.db2.gz HAJXSZQTXPGALU-KXBFYZLASA-N 2 1 391.947 3.117 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+][C@H]3CCc4ccccc4C3)c2)C1 ZINC000247974830 1433760406 /nfs/dbraw/zinc/76/04/06/1433760406.db2.gz HSCVGEZPDFUTKZ-PKTZIBPZSA-N 2 1 377.532 3.031 20 0 GGADMP COc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c1)CC2 ZINC000248010063 1433763010 /nfs/dbraw/zinc/76/30/10/1433763010.db2.gz LEXPZHGVMGDJJZ-NFBKMPQASA-N 2 1 393.531 3.170 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC(CC[NH+]3CCCC[C@H]3C)CC2)C[N@H+]1C1CC1 ZINC000248035655 1433765005 /nfs/dbraw/zinc/76/50/05/1433765005.db2.gz RLRFSHKJOPMZBW-HBFSDRIKSA-N 2 1 376.589 3.298 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C[NH+]1C1CC1 ZINC000248035655 1433765010 /nfs/dbraw/zinc/76/50/10/1433765010.db2.gz RLRFSHKJOPMZBW-HBFSDRIKSA-N 2 1 376.589 3.298 20 0 GGADMP C[C@H]1C[C@H](NC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C[NH+]1C1CC1 ZINC000248035655 1433765015 /nfs/dbraw/zinc/76/50/15/1433765015.db2.gz RLRFSHKJOPMZBW-HBFSDRIKSA-N 2 1 376.589 3.298 20 0 GGADMP C[N@@H+]1CCC[C@H]2C[NH+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@@H]21 ZINC000248070129 1433767293 /nfs/dbraw/zinc/76/72/93/1433767293.db2.gz MNRQHQKEMLIPTP-ICSRJNTNSA-N 2 1 375.532 3.369 20 0 GGADMP C[N@H+]1CCC[C@H]2C[NH+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@@H]21 ZINC000248070129 1433767296 /nfs/dbraw/zinc/76/72/96/1433767296.db2.gz MNRQHQKEMLIPTP-ICSRJNTNSA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@H+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@@H]21 ZINC000248070129 1433767301 /nfs/dbraw/zinc/76/73/01/1433767301.db2.gz MNRQHQKEMLIPTP-ICSRJNTNSA-N 2 1 375.532 3.369 20 0 GGADMP C[NH+]1CCC[C@H]2C[N@@H+](CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC[C@@H]21 ZINC000248070129 1433767304 /nfs/dbraw/zinc/76/73/04/1433767304.db2.gz MNRQHQKEMLIPTP-ICSRJNTNSA-N 2 1 375.532 3.369 20 0 GGADMP CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)N1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000248065400 1433767406 /nfs/dbraw/zinc/76/74/06/1433767406.db2.gz ZJPFYOWEFPCILA-UGKGYDQZSA-N 2 1 393.616 3.283 20 0 GGADMP O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000248134545 1433772552 /nfs/dbraw/zinc/77/25/52/1433772552.db2.gz OWUPRJLWGSVILJ-QNWVGRARSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248134545 1433772553 /nfs/dbraw/zinc/77/25/53/1433772553.db2.gz OWUPRJLWGSVILJ-QNWVGRARSA-N 2 1 396.579 3.167 20 0 GGADMP O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000248134545 1433772554 /nfs/dbraw/zinc/77/25/54/1433772554.db2.gz OWUPRJLWGSVILJ-QNWVGRARSA-N 2 1 396.579 3.167 20 0 GGADMP Cc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c1)CC2 ZINC000248137791 1433773232 /nfs/dbraw/zinc/77/32/32/1433773232.db2.gz PFYBIDBZJXSQDT-FYYLOGMGSA-N 2 1 377.532 3.469 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000248175071 1433777918 /nfs/dbraw/zinc/77/79/18/1433777918.db2.gz VLZGKGXVUUMCKF-ZLNRFVROSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000248175071 1433777919 /nfs/dbraw/zinc/77/79/19/1433777919.db2.gz VLZGKGXVUUMCKF-ZLNRFVROSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000248175071 1433777920 /nfs/dbraw/zinc/77/79/20/1433777920.db2.gz VLZGKGXVUUMCKF-ZLNRFVROSA-N 2 1 398.595 3.414 20 0 GGADMP CCC[N@H+]1CCCC[C@@H]1C(=O)NC[C@H](c1cccc(OC)c1)[NH+](CC)CC ZINC000248179724 1433778127 /nfs/dbraw/zinc/77/81/27/1433778127.db2.gz XTEZLAOGMPMVBA-NHCUHLMSSA-N 2 1 375.557 3.459 20 0 GGADMP CC(C)[C@H](C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000248255272 1433783243 /nfs/dbraw/zinc/78/32/43/1433783243.db2.gz ULEIKGJILBUAPR-WOIUINJBSA-N 2 1 387.568 3.032 20 0 GGADMP C[N@H+]1CCCN(c2ccc(NC(=O)[C@H]3CC[NH+](C4CCCCC4)C3)cc2)CC1 ZINC000248331796 1433786513 /nfs/dbraw/zinc/78/65/13/1433786513.db2.gz FBMNFEZSMKMBIX-IBGZPJMESA-N 2 1 384.568 3.422 20 0 GGADMP C[NH+]1CCCN(c2ccc(NC(=O)[C@H]3CC[N@@H+](C4CCCCC4)C3)cc2)CC1 ZINC000248331796 1433786517 /nfs/dbraw/zinc/78/65/17/1433786517.db2.gz FBMNFEZSMKMBIX-IBGZPJMESA-N 2 1 384.568 3.422 20 0 GGADMP C[NH+]1CCCN(c2ccc(NC(=O)[C@H]3CC[N@H+](C4CCCCC4)C3)cc2)CC1 ZINC000248331796 1433786521 /nfs/dbraw/zinc/78/65/21/1433786521.db2.gz FBMNFEZSMKMBIX-IBGZPJMESA-N 2 1 384.568 3.422 20 0 GGADMP C[C@H](NC(=O)NC[C@H](c1cccc(F)c1)[NH+](C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248390695 1433793863 /nfs/dbraw/zinc/79/38/63/1433793863.db2.gz BRESNHLXKXOMQT-DJPFJPOOSA-N 2 1 390.547 3.381 20 0 GGADMP COC(=O)c1cccc(NC(=O)C[C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000248392129 1433793959 /nfs/dbraw/zinc/79/39/59/1433793959.db2.gz VQOWABWEHKAOTM-MSOLQXFVSA-N 2 1 389.540 3.148 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N1CCc2ccccc21 ZINC000248394008 1433794479 /nfs/dbraw/zinc/79/44/79/1433794479.db2.gz HFFMXMROKXMLRO-HROJSSOGSA-N 2 1 377.532 3.322 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N1CCc2ccccc21 ZINC000248394008 1433794485 /nfs/dbraw/zinc/79/44/85/1433794485.db2.gz HFFMXMROKXMLRO-HROJSSOGSA-N 2 1 377.532 3.322 20 0 GGADMP C[C@H](NC(=O)N1CCC[C@H]1C[NH+]1CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248396082 1433795315 /nfs/dbraw/zinc/79/53/15/1433795315.db2.gz GVTVUHWCONFDNA-ZJOUEHCJSA-N 2 1 376.589 3.299 20 0 GGADMP C[C@@H](NC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000248397555 1433796189 /nfs/dbraw/zinc/79/61/89/1433796189.db2.gz IAAHUWHAGNLQBV-VAMGGRTRSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@@H](NC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248397555 1433796195 /nfs/dbraw/zinc/79/61/95/1433796195.db2.gz IAAHUWHAGNLQBV-VAMGGRTRSA-N 2 1 378.605 3.451 20 0 GGADMP C[C@@H](NC(=O)NCCCC[NH+]1CCC[C@@H](C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248397555 1433796202 /nfs/dbraw/zinc/79/62/02/1433796202.db2.gz IAAHUWHAGNLQBV-VAMGGRTRSA-N 2 1 378.605 3.451 20 0 GGADMP Cc1cccc(CNC(=O)C[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000248398563 1433796343 /nfs/dbraw/zinc/79/63/43/1433796343.db2.gz NKUHECCRIWCFDE-GZOXUSKESA-N 2 1 379.548 3.357 20 0 GGADMP Cc1cccc(CNC(=O)C[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000248398563 1433796350 /nfs/dbraw/zinc/79/63/50/1433796350.db2.gz NKUHECCRIWCFDE-GZOXUSKESA-N 2 1 379.548 3.357 20 0 GGADMP CC(C)(C)S(=O)(=O)CC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248400194 1433797233 /nfs/dbraw/zinc/79/72/33/1433797233.db2.gz KQXKHXUEZVZUAB-VAMGGRTRSA-N 2 1 378.582 3.090 20 0 GGADMP CC(C)(C)S(=O)(=O)CC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248400194 1433797237 /nfs/dbraw/zinc/79/72/37/1433797237.db2.gz KQXKHXUEZVZUAB-VAMGGRTRSA-N 2 1 378.582 3.090 20 0 GGADMP Cc1csc2nc(C[NH2+][C@H]3[C@H](C)C[N@@H+](Cc4ccccc4)C[C@@H]3C)cc(=O)n12 ZINC000248402708 1433798439 /nfs/dbraw/zinc/79/84/39/1433798439.db2.gz VYQRVXYXUNMJPK-JIPZTSHUSA-N 2 1 396.560 3.311 20 0 GGADMP Cc1csc2nc(C[NH2+][C@H]3[C@H](C)C[N@H+](Cc4ccccc4)C[C@@H]3C)cc(=O)n12 ZINC000248402708 1433798446 /nfs/dbraw/zinc/79/84/46/1433798446.db2.gz VYQRVXYXUNMJPK-JIPZTSHUSA-N 2 1 396.560 3.311 20 0 GGADMP OCCOc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000248408324 1433800124 /nfs/dbraw/zinc/80/01/24/1433800124.db2.gz VKBXVYYEZYCPIP-XPWALMASSA-N 2 1 380.532 3.448 20 0 GGADMP CS(=O)(=O)C1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248408891 1433800136 /nfs/dbraw/zinc/80/01/36/1433800136.db2.gz VYSNOKXFUBBUGS-QKQBLWMGSA-N 2 1 390.593 3.233 20 0 GGADMP CS(=O)(=O)C1CCC([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248408891 1433800137 /nfs/dbraw/zinc/80/01/37/1433800137.db2.gz VYSNOKXFUBBUGS-QKQBLWMGSA-N 2 1 390.593 3.233 20 0 GGADMP O=C(NCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccccc1F ZINC000248409065 1433800153 /nfs/dbraw/zinc/80/01/53/1433800153.db2.gz WHOLOVCTEIMLEQ-IEIRFRATSA-N 2 1 395.522 3.446 20 0 GGADMP OCCOc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248408326 1433800213 /nfs/dbraw/zinc/80/02/13/1433800213.db2.gz VKBXVYYEZYCPIP-YTFSRNRJSA-N 2 1 380.532 3.448 20 0 GGADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]23)C[C@H](C)O1 ZINC000248410731 1433800450 /nfs/dbraw/zinc/80/04/50/1433800450.db2.gz HKUTYWOWULCPFN-LXCVFVNYSA-N 3 1 385.596 3.376 20 0 GGADMP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)C[C@H](C)O1 ZINC000248410731 1433800451 /nfs/dbraw/zinc/80/04/51/1433800451.db2.gz HKUTYWOWULCPFN-LXCVFVNYSA-N 3 1 385.596 3.376 20 0 GGADMP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)C[C@H](C)O1 ZINC000248410731 1433800452 /nfs/dbraw/zinc/80/04/52/1433800452.db2.gz HKUTYWOWULCPFN-LXCVFVNYSA-N 3 1 385.596 3.376 20 0 GGADMP CO[C@]1(C)C[C@H]([NH+](C)CC2(C[N@H+](C)[C@H]3C[C@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000248417682 1433801068 /nfs/dbraw/zinc/80/10/68/1433801068.db2.gz JSMLUQMHMHVNHK-YHDSQAASSA-N 2 1 396.616 3.274 20 0 GGADMP CO[C@]1(C)C[C@H]([N@@H+](C)CC2(C[NH+](C)[C@H]3C[C@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000248417682 1433801069 /nfs/dbraw/zinc/80/10/69/1433801069.db2.gz JSMLUQMHMHVNHK-YHDSQAASSA-N 2 1 396.616 3.274 20 0 GGADMP CO[C@]1(C)C[C@H]([N@H+](C)CC2(C[NH+](C)[C@H]3C[C@](C)(OC)C3(C)C)COC2)C1(C)C ZINC000248417682 1433801070 /nfs/dbraw/zinc/80/10/70/1433801070.db2.gz JSMLUQMHMHVNHK-YHDSQAASSA-N 2 1 396.616 3.274 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc2c(c1)OCCCO2 ZINC000248430239 1433802011 /nfs/dbraw/zinc/80/20/11/1433802011.db2.gz BNJZKCNXLAWCRQ-LAUBAEHRSA-N 2 1 382.504 3.265 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)c1ccc([S@@](C)=O)cc1 ZINC000248430383 1433802057 /nfs/dbraw/zinc/80/20/57/1433802057.db2.gz BRWLWVHTOQOPDS-SJQPRBQBSA-N 2 1 386.561 3.232 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000248434746 1433802459 /nfs/dbraw/zinc/80/24/59/1433802459.db2.gz FABYBWMPPPVITK-AUSIDOKSSA-N 3 1 397.563 3.044 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cccc(N2CCCC2=O)c1 ZINC000248457832 1433804217 /nfs/dbraw/zinc/80/42/17/1433804217.db2.gz UFVXPSDFHMNDCV-WZONZLPQSA-N 2 1 393.531 3.231 20 0 GGADMP CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)cc1 ZINC000248456665 1433804283 /nfs/dbraw/zinc/80/42/83/1433804283.db2.gz SKJFNDSGNOFIDQ-SBUREZEXSA-N 2 1 381.520 3.453 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cccc(N2CCCC2=O)c1 ZINC000248457830 1433804329 /nfs/dbraw/zinc/80/43/29/1433804329.db2.gz UFVXPSDFHMNDCV-FDDCHVKYSA-N 2 1 393.531 3.231 20 0 GGADMP O[C@@H](COc1ccccc1C(F)(F)F)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000248460136 1433804703 /nfs/dbraw/zinc/80/47/03/1433804703.db2.gz ODDSAYODEDGUBO-DLBZAZTESA-N 2 1 386.458 3.253 20 0 GGADMP O[C@@H](COc1ccccc1C(F)(F)F)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000248460136 1433804704 /nfs/dbraw/zinc/80/47/04/1433804704.db2.gz ODDSAYODEDGUBO-DLBZAZTESA-N 2 1 386.458 3.253 20 0 GGADMP C[C@@H](NCc1ccccc1C[N@H+]1CCC[C@H]1CO)c1nc2ccccc2n1C ZINC000248462746 1433804922 /nfs/dbraw/zinc/80/49/22/1433804922.db2.gz YMAJKVLTQUTUBB-XLIONFOSSA-N 2 1 378.520 3.381 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1nc2ccccc2n1C ZINC000248462746 1433804924 /nfs/dbraw/zinc/80/49/24/1433804924.db2.gz YMAJKVLTQUTUBB-XLIONFOSSA-N 2 1 378.520 3.381 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)c1nc2ccccc2n1C ZINC000248462746 1433804926 /nfs/dbraw/zinc/80/49/26/1433804926.db2.gz YMAJKVLTQUTUBB-XLIONFOSSA-N 2 1 378.520 3.381 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000248471015 1433805243 /nfs/dbraw/zinc/80/52/43/1433805243.db2.gz VMQMKTVBIYIECV-VDZJLULYSA-N 2 1 398.469 3.394 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000248471015 1433805246 /nfs/dbraw/zinc/80/52/46/1433805246.db2.gz VMQMKTVBIYIECV-VDZJLULYSA-N 2 1 398.469 3.394 20 0 GGADMP O[C@H](COc1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000248471015 1433805247 /nfs/dbraw/zinc/80/52/47/1433805247.db2.gz VMQMKTVBIYIECV-VDZJLULYSA-N 2 1 398.469 3.394 20 0 GGADMP Cc1cc2ncn(C[C@H](O)C[NH2+][C@@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)c2cc1C ZINC000248549405 1433807836 /nfs/dbraw/zinc/80/78/36/1433807836.db2.gz FYDFOTOHFTWOOG-IRFCIJBXSA-N 2 1 384.568 3.257 20 0 GGADMP CCOc1ccc(OC[C@H](O)C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248568691 1433808852 /nfs/dbraw/zinc/80/88/52/1433808852.db2.gz LNUBQHIOKIPYPD-CMKODMSKSA-N 2 1 376.541 3.068 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248595490 1433810189 /nfs/dbraw/zinc/81/01/89/1433810189.db2.gz SQLBZNULBPBDNJ-UFYCRDLUSA-N 2 1 387.568 3.121 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000248595490 1433810190 /nfs/dbraw/zinc/81/01/90/1433810190.db2.gz SQLBZNULBPBDNJ-UFYCRDLUSA-N 2 1 387.568 3.121 20 0 GGADMP Cc1cccc(OCCNC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248595490 1433810191 /nfs/dbraw/zinc/81/01/91/1433810191.db2.gz SQLBZNULBPBDNJ-UFYCRDLUSA-N 2 1 387.568 3.121 20 0 GGADMP CC[C@H]([NH2+]CC(=O)NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)[C@H]1CCCO1 ZINC000248595287 1433810276 /nfs/dbraw/zinc/81/02/76/1433810276.db2.gz MFUZYUMLCMTTRT-XUVXKRRUSA-N 2 1 393.959 3.140 20 0 GGADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)C[C@H]2COCCN2C(=O)OC(C)(C)C)C1 ZINC000248690633 1433815555 /nfs/dbraw/zinc/81/55/55/1433815555.db2.gz AULGVFAICONKBE-AQNXPRMDSA-N 2 1 397.604 3.359 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCCN1Cc1ccc(F)cc1 ZINC000248709872 1433816591 /nfs/dbraw/zinc/81/65/91/1433816591.db2.gz BXUYCDCTXWAXQZ-FYYLOGMGSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000248709872 1433816592 /nfs/dbraw/zinc/81/65/92/1433816592.db2.gz BXUYCDCTXWAXQZ-FYYLOGMGSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000248709872 1433816594 /nfs/dbraw/zinc/81/65/94/1433816594.db2.gz BXUYCDCTXWAXQZ-FYYLOGMGSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+]1Cc1ccc(F)cc1 ZINC000248709872 1433816595 /nfs/dbraw/zinc/81/65/95/1433816595.db2.gz BXUYCDCTXWAXQZ-FYYLOGMGSA-N 2 1 395.522 3.428 20 0 GGADMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCC[NH+]1Cc1ccc(F)cc1 ZINC000248709872 1433816597 /nfs/dbraw/zinc/81/65/97/1433816597.db2.gz BXUYCDCTXWAXQZ-FYYLOGMGSA-N 2 1 395.522 3.428 20 0 GGADMP C[C@@H]1C[C@H](N[C@H](Cc2ccc(Cl)cc2)C(N)=O)CC[N@H+]1Cc1ccccc1 ZINC000248727703 1433818153 /nfs/dbraw/zinc/81/81/53/1433818153.db2.gz LKSDCMGEQHNVEI-MAODMQOUSA-N 2 1 385.939 3.379 20 0 GGADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)[C@@H](C)C1 ZINC000248734424 1433818477 /nfs/dbraw/zinc/81/84/77/1433818477.db2.gz PLONXNJIZJWFJR-ZVZYQTTQSA-N 2 1 383.458 3.126 20 0 GGADMP C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000248737558 1433818730 /nfs/dbraw/zinc/81/87/30/1433818730.db2.gz LFOYFOSPHLWISN-IFMALSPDSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000248737558 1433818732 /nfs/dbraw/zinc/81/87/32/1433818732.db2.gz LFOYFOSPHLWISN-IFMALSPDSA-N 2 1 386.584 3.320 20 0 GGADMP C[C@@H]1CCC[NH+](CCCCNC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000248737558 1433818734 /nfs/dbraw/zinc/81/87/34/1433818734.db2.gz LFOYFOSPHLWISN-IFMALSPDSA-N 2 1 386.584 3.320 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000248742433 1433819380 /nfs/dbraw/zinc/81/93/80/1433819380.db2.gz RJPVOMSOMYBZJA-CDHQVMDDSA-N 2 1 376.932 3.143 20 0 GGADMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000248750036 1433819972 /nfs/dbraw/zinc/81/99/72/1433819972.db2.gz OKDKZKJFRLAZDV-FCHUYYIVSA-N 2 1 384.568 3.168 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)C[C@H]2COCCN2C(=O)OC(C)(C)C)C1 ZINC000248770477 1433821597 /nfs/dbraw/zinc/82/15/97/1433821597.db2.gz XZHFBWIJJYYLOB-QYZOEREBSA-N 2 1 383.577 3.111 20 0 GGADMP O=C1C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)CN1Cc1ccccc1C(F)(F)F ZINC000248773568 1433821751 /nfs/dbraw/zinc/82/17/51/1433821751.db2.gz YKSNBGJCLBUYRV-ULQDDVLXSA-N 2 1 381.442 3.023 20 0 GGADMP COCCN(C)c1ccc(CN(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000248819930 1433823909 /nfs/dbraw/zinc/82/39/09/1433823909.db2.gz FLOIQZLXHSTADZ-JOCHJYFZSA-N 2 1 382.552 3.118 20 0 GGADMP COCCN(C)c1ccc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cn1 ZINC000248819930 1433823910 /nfs/dbraw/zinc/82/39/10/1433823910.db2.gz FLOIQZLXHSTADZ-JOCHJYFZSA-N 2 1 382.552 3.118 20 0 GGADMP COCCN(C)c1ccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cn1 ZINC000248819930 1433823911 /nfs/dbraw/zinc/82/39/11/1433823911.db2.gz FLOIQZLXHSTADZ-JOCHJYFZSA-N 2 1 382.552 3.118 20 0 GGADMP COCCN(C)c1ccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cn1 ZINC000248819930 1433823912 /nfs/dbraw/zinc/82/39/12/1433823912.db2.gz FLOIQZLXHSTADZ-JOCHJYFZSA-N 2 1 382.552 3.118 20 0 GGADMP COCCN(C)c1ccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000248819930 1433823913 /nfs/dbraw/zinc/82/39/13/1433823913.db2.gz FLOIQZLXHSTADZ-JOCHJYFZSA-N 2 1 382.552 3.118 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CCCO2)C[C@H]1C ZINC000248831120 1433824513 /nfs/dbraw/zinc/82/45/13/1433824513.db2.gz LWFXKKXUBHKMEK-FVTFTPSCSA-N 2 1 388.552 3.235 20 0 GGADMP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)C[C@H]1C ZINC000248831120 1433824514 /nfs/dbraw/zinc/82/45/14/1433824514.db2.gz LWFXKKXUBHKMEK-FVTFTPSCSA-N 2 1 388.552 3.235 20 0 GGADMP O=C1c2ccccc2CCN1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248884410 1433827648 /nfs/dbraw/zinc/82/76/48/1433827648.db2.gz LQEYWDICFKEMTK-NUNAXRQHSA-N 2 1 389.543 3.470 20 0 GGADMP COc1ccc(C[C@@H](C)C[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1F ZINC000248896598 1433828477 /nfs/dbraw/zinc/82/84/77/1433828477.db2.gz VKMHNCGGWSUGEH-DYESRHJHSA-N 2 1 386.511 3.369 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[C@H](C)C1 ZINC000248944974 1433830114 /nfs/dbraw/zinc/83/01/14/1433830114.db2.gz DHDHMFYNKQJYMP-XCJLJZCSSA-N 2 1 387.568 3.079 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[C@H](C)C1 ZINC000248944974 1433830115 /nfs/dbraw/zinc/83/01/15/1433830115.db2.gz DHDHMFYNKQJYMP-XCJLJZCSSA-N 2 1 387.568 3.079 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000248945948 1433830148 /nfs/dbraw/zinc/83/01/48/1433830148.db2.gz DLAKMBDRHVTVPS-XQTRSNPVSA-N 2 1 383.492 3.374 20 0 GGADMP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000249013740 1433832171 /nfs/dbraw/zinc/83/21/71/1433832171.db2.gz PCLYHVPACWTUNX-FDFHNCONSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000249013740 1433832172 /nfs/dbraw/zinc/83/21/72/1433832172.db2.gz PCLYHVPACWTUNX-FDFHNCONSA-N 2 1 386.584 3.269 20 0 GGADMP CC(C)[C@H](C[NH+](C)Cc1ccccc1)NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000249013740 1433832173 /nfs/dbraw/zinc/83/21/73/1433832173.db2.gz PCLYHVPACWTUNX-FDFHNCONSA-N 2 1 386.584 3.269 20 0 GGADMP Cc1cc(C)c(N2CC[C@H]([N@@H+]3CCC[C@@H](Cc4[nH+]ccn4C)C3)C2=O)c(C)c1 ZINC000249059121 1433833345 /nfs/dbraw/zinc/83/33/45/1433833345.db2.gz JGNOSLMWTSWSJE-PMACEKPBSA-N 2 1 380.536 3.405 20 0 GGADMP Cc1cc(C)c(N2CC[C@H]([N@H+]3CCC[C@@H](Cc4[nH+]ccn4C)C3)C2=O)c(C)c1 ZINC000249059121 1433833346 /nfs/dbraw/zinc/83/33/46/1433833346.db2.gz JGNOSLMWTSWSJE-PMACEKPBSA-N 2 1 380.536 3.405 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)CC1 ZINC000249278072 1433840138 /nfs/dbraw/zinc/84/01/38/1433840138.db2.gz LSFVLWSROATTSI-PMACEKPBSA-N 2 1 396.620 3.028 20 0 GGADMP CC(C)[NH+]1CCN(CCC[N@H+]2CCC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)CC1 ZINC000249278076 1433840183 /nfs/dbraw/zinc/84/01/83/1433840183.db2.gz LSFVLWSROATTSI-VQTJNVASSA-N 2 1 396.620 3.028 20 0 GGADMP COc1ccccc1[C@@H]1CCC[N@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000249284032 1433840431 /nfs/dbraw/zinc/84/04/31/1433840431.db2.gz HPDUNJFCNPXWHT-SFTDATJTSA-N 2 1 381.520 3.251 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000249406988 1433843010 /nfs/dbraw/zinc/84/30/10/1433843010.db2.gz DJOBNRZJBGPCNU-ONTIZHBOSA-N 2 1 389.584 3.207 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000249406988 1433843011 /nfs/dbraw/zinc/84/30/11/1433843011.db2.gz DJOBNRZJBGPCNU-ONTIZHBOSA-N 2 1 389.584 3.207 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)[C@@H](C)C1 ZINC000249412815 1433843128 /nfs/dbraw/zinc/84/31/28/1433843128.db2.gz FOCWKZKJJRUUIF-UGNRZPKXSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)[C@@H](C)C1 ZINC000249412815 1433843130 /nfs/dbraw/zinc/84/31/30/1433843130.db2.gz FOCWKZKJJRUUIF-UGNRZPKXSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000249412810 1433843169 /nfs/dbraw/zinc/84/31/69/1433843169.db2.gz FOCWKZKJJRUUIF-IKVWTGGYSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)[C@H](C)C1 ZINC000249412810 1433843171 /nfs/dbraw/zinc/84/31/71/1433843171.db2.gz FOCWKZKJJRUUIF-IKVWTGGYSA-N 2 1 393.547 3.118 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NCc2ccccc2Cl)[C@@H](C)C1 ZINC000249416510 1433843348 /nfs/dbraw/zinc/84/33/48/1433843348.db2.gz GOWQWCDNCJZXRE-QKLQHJQFSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NCc2ccccc2Cl)[C@@H](C)C1 ZINC000249416510 1433843350 /nfs/dbraw/zinc/84/33/50/1433843350.db2.gz GOWQWCDNCJZXRE-QKLQHJQFSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc3oc(C(=O)OC)cc3c2)[C@@H](C)C1 ZINC000249437354 1433843920 /nfs/dbraw/zinc/84/39/20/1433843920.db2.gz SKXVMCUTQCSJMB-QFBILLFUSA-N 2 1 388.508 3.446 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NCc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249442487 1433843933 /nfs/dbraw/zinc/84/39/33/1433843933.db2.gz MMMZMEPGJQABJV-QKLQHJQFSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)NCc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000249442487 1433843934 /nfs/dbraw/zinc/84/39/34/1433843934.db2.gz MMMZMEPGJQABJV-QKLQHJQFSA-N 2 1 395.975 3.071 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)c(C)c2)[C@H](C)C1 ZINC000249437431 1433843941 /nfs/dbraw/zinc/84/39/41/1433843941.db2.gz SLUGCQBBIILVJX-SBHAEUEKSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)c(C)c2)[C@H](C)C1 ZINC000249437431 1433843942 /nfs/dbraw/zinc/84/39/42/1433843942.db2.gz SLUGCQBBIILVJX-SBHAEUEKSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000249437437 1433843990 /nfs/dbraw/zinc/84/39/90/1433843990.db2.gz SLUGCQBBIILVJX-ZVDOUQERSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000249437437 1433843991 /nfs/dbraw/zinc/84/39/91/1433843991.db2.gz SLUGCQBBIILVJX-ZVDOUQERSA-N 2 1 375.557 3.357 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)c(F)c2)[C@H](C)C1 ZINC000249458241 1433844311 /nfs/dbraw/zinc/84/43/11/1433844311.db2.gz QEEFNRNNUIUDEC-HLIPFELVSA-N 2 1 379.520 3.188 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)Nc2ccc(C)c(F)c2)[C@H](C)C1 ZINC000249458241 1433844312 /nfs/dbraw/zinc/84/43/12/1433844312.db2.gz QEEFNRNNUIUDEC-HLIPFELVSA-N 2 1 379.520 3.188 20 0 GGADMP CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)C1 ZINC000249746547 1433850857 /nfs/dbraw/zinc/85/08/57/1433850857.db2.gz MWYCOEUZXJHUOX-DENIHFKCSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000249746547 1433850859 /nfs/dbraw/zinc/85/08/59/1433850859.db2.gz MWYCOEUZXJHUOX-DENIHFKCSA-N 2 1 386.584 3.450 20 0 GGADMP CCC[NH+]1CC[C@H](CNC(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000249746547 1433850860 /nfs/dbraw/zinc/85/08/60/1433850860.db2.gz MWYCOEUZXJHUOX-DENIHFKCSA-N 2 1 386.584 3.450 20 0 GGADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCc1ccnc(N2CCCCC2)c1 ZINC000249755281 1433851172 /nfs/dbraw/zinc/85/11/72/1433851172.db2.gz CQOHNASOWIFBEP-OTWHNJEPSA-N 2 1 387.572 3.238 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)C1CCS(=O)(=O)CC1 ZINC000250067444 1433854152 /nfs/dbraw/zinc/85/41/52/1433854152.db2.gz NQJMXZRYXZIVTN-ZWKOTPCHSA-N 2 1 378.582 3.364 20 0 GGADMP COc1cccc(COC[C@H](O)C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000250286167 1433855671 /nfs/dbraw/zinc/85/56/71/1433855671.db2.gz KZJOGOLZKWKSDQ-FGZHOGPDSA-N 2 1 390.568 3.017 20 0 GGADMP CC(C)[N@H+]1CCC[C@@H](CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000250479954 1433856282 /nfs/dbraw/zinc/85/62/82/1433856282.db2.gz BREFJFJZYVWGHK-ZWKOTPCHSA-N 2 1 378.586 3.305 20 0 GGADMP C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000250575772 1433856960 /nfs/dbraw/zinc/85/69/60/1433856960.db2.gz ZOZMBRINATUNOF-ROUUACIJSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000250575772 1433856962 /nfs/dbraw/zinc/85/69/62/1433856962.db2.gz ZOZMBRINATUNOF-ROUUACIJSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000250575771 1433857022 /nfs/dbraw/zinc/85/70/22/1433857022.db2.gz ZOZMBRINATUNOF-MSOLQXFVSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000250575771 1433857023 /nfs/dbraw/zinc/85/70/23/1433857023.db2.gz ZOZMBRINATUNOF-MSOLQXFVSA-N 2 1 390.597 3.477 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N(C)[C@H]3CC[NH+](C)C[C@@H]3C)cc2)C1 ZINC000252651976 1433863795 /nfs/dbraw/zinc/86/37/95/1433863795.db2.gz WTYCWUTVORDHEO-DXIQSLLYSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N(C)[C@H]3CC[N@H+](C)C[C@@H]3C)cc2)C1 ZINC000252651976 1433863796 /nfs/dbraw/zinc/86/37/96/1433863796.db2.gz WTYCWUTVORDHEO-DXIQSLLYSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N(C)[C@H]3CC[N@@H+](C)C[C@@H]3C)cc2)C1 ZINC000252651976 1433863797 /nfs/dbraw/zinc/86/37/97/1433863797.db2.gz WTYCWUTVORDHEO-DXIQSLLYSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)N(C)[C@H]3CC[NH+](C)C[C@H]3C)cc2)C1 ZINC000252651977 1433863889 /nfs/dbraw/zinc/86/38/89/1433863889.db2.gz WTYCWUTVORDHEO-KNKQGSTJSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N(C)[C@H]3CC[N@H+](C)C[C@H]3C)cc2)C1 ZINC000252651977 1433863890 /nfs/dbraw/zinc/86/38/90/1433863890.db2.gz WTYCWUTVORDHEO-KNKQGSTJSA-N 2 1 386.584 3.400 20 0 GGADMP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)N(C)[C@H]3CC[N@@H+](C)C[C@H]3C)cc2)C1 ZINC000252651977 1433863891 /nfs/dbraw/zinc/86/38/91/1433863891.db2.gz WTYCWUTVORDHEO-KNKQGSTJSA-N 2 1 386.584 3.400 20 0 GGADMP COc1ccc([C@H](NC(=O)CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C(C)C)cc1 ZINC000252692406 1433864231 /nfs/dbraw/zinc/86/42/31/1433864231.db2.gz BHHANLJUAWWODG-WNOPAQSVSA-N 2 1 399.579 3.457 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1F ZINC000253357708 1433865984 /nfs/dbraw/zinc/86/59/84/1433865984.db2.gz DZRUTGZRFHMXCE-CVEARBPZSA-N 2 1 387.503 3.239 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1F ZINC000253357708 1433865986 /nfs/dbraw/zinc/86/59/86/1433865986.db2.gz DZRUTGZRFHMXCE-CVEARBPZSA-N 2 1 387.503 3.239 20 0 GGADMP C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)NC[C@H](Cc2ccccc2)[NH+](C)C)C1 ZINC000255504854 1433883832 /nfs/dbraw/zinc/88/38/32/1433883832.db2.gz AQZSZWMHTZMWCK-VWPQPMDRSA-N 2 1 388.600 3.217 20 0 GGADMP C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000255770485 1433889528 /nfs/dbraw/zinc/88/95/28/1433889528.db2.gz JUSCBGLZEUGMNO-RTBURBONSA-N 2 1 376.545 3.370 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]1CC(=O)NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1 ZINC000261781449 1433903870 /nfs/dbraw/zinc/90/38/70/1433903870.db2.gz PHPXSRUXBJNUEP-DFQSSKMNSA-N 2 1 383.561 3.481 20 0 GGADMP [NH3+][C@@H]1CCC[C@H]1CC(=O)NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000261781449 1433903874 /nfs/dbraw/zinc/90/38/74/1433903874.db2.gz PHPXSRUXBJNUEP-DFQSSKMNSA-N 2 1 383.561 3.481 20 0 GGADMP Cc1cc(NC(=O)C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)ccc1Br ZINC000261825177 1433905621 /nfs/dbraw/zinc/90/56/21/1433905621.db2.gz WZSPEAIVECSYQP-QGZVFWFLSA-N 2 1 380.330 3.160 20 0 GGADMP [NH3+]C[C@@H]1C[N@H+]([C@@H](C(=O)N2CCCCC2)c2ccccc2)C[C@H]1c1ccccc1 ZINC000261850969 1433907216 /nfs/dbraw/zinc/90/72/16/1433907216.db2.gz VJRCCOIQOOUKDY-XPWALMASSA-N 2 1 377.532 3.415 20 0 GGADMP O=C(CC[C@H]1CC[NH2+]C1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000261852543 1433907222 /nfs/dbraw/zinc/90/72/22/1433907222.db2.gz NGQQSUFCDMSWGI-FQEVSTJZSA-N 2 1 377.532 3.310 20 0 GGADMP [NH3+]C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc(Cl)cc2F)C[C@H]1c1ccccc1 ZINC000261868289 1433908419 /nfs/dbraw/zinc/90/84/19/1433908419.db2.gz WZZRKEMSCJEXQQ-WBVHZDCISA-N 2 1 375.875 3.482 20 0 GGADMP Cc1ccc(-c2nc(C[N@@H+]3CCC[C@H](CNC(=O)[C@@H]4CCC[NH2+]4)C3)cs2)cc1 ZINC000261897602 1433910591 /nfs/dbraw/zinc/91/05/91/1433910591.db2.gz REZGFOCDMZESPJ-XLIONFOSSA-N 2 1 398.576 3.199 20 0 GGADMP Cc1ccc(-c2nc(C[N@H+]3CCC[C@H](CNC(=O)[C@@H]4CCC[NH2+]4)C3)cs2)cc1 ZINC000261897602 1433910602 /nfs/dbraw/zinc/91/06/02/1433910602.db2.gz REZGFOCDMZESPJ-XLIONFOSSA-N 2 1 398.576 3.199 20 0 GGADMP O=C(NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1)[C@H]1CC12CC[NH2+]CC2 ZINC000261939330 1433914365 /nfs/dbraw/zinc/91/43/65/1433914365.db2.gz MUZUGUIBEYFYOK-WOJBJXKFSA-N 2 1 395.572 3.353 20 0 GGADMP O=C(NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1)[C@H]1CC12CC[NH2+]CC2 ZINC000261939330 1433914374 /nfs/dbraw/zinc/91/43/74/1433914374.db2.gz MUZUGUIBEYFYOK-WOJBJXKFSA-N 2 1 395.572 3.353 20 0 GGADMP CCOc1c(Br)cc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)cc1OC ZINC000261960177 1433916246 /nfs/dbraw/zinc/91/62/46/1433916246.db2.gz HDKYVQLDDVTBDD-UHFFFAOYSA-N 2 1 383.330 3.432 20 0 GGADMP O=C([C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1)N1CC[NH2+]CC1 ZINC000261959794 1433916526 /nfs/dbraw/zinc/91/65/26/1433916526.db2.gz PCHPWCGUOHIMJH-CQSZACIVSA-N 2 1 389.849 3.003 20 0 GGADMP O=C([C@@H]1CCC[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1)N1CC[NH2+]CC1 ZINC000261959794 1433916536 /nfs/dbraw/zinc/91/65/36/1433916536.db2.gz PCHPWCGUOHIMJH-CQSZACIVSA-N 2 1 389.849 3.003 20 0 GGADMP O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@@H]1CC12CC[NH2+]CC2 ZINC000261965167 1433917163 /nfs/dbraw/zinc/91/71/63/1433917163.db2.gz SOVHNAZZUFBGIJ-INIZCTEOSA-N 2 1 396.362 3.464 20 0 GGADMP O=C(NC[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000261969894 1433918307 /nfs/dbraw/zinc/91/83/07/1433918307.db2.gz UHYNEXRPYJKBIV-OALUTQOASA-N 2 1 375.944 3.200 20 0 GGADMP O=C(NC[C@@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000261969894 1433918308 /nfs/dbraw/zinc/91/83/08/1433918308.db2.gz UHYNEXRPYJKBIV-OALUTQOASA-N 2 1 375.944 3.200 20 0 GGADMP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000261981100 1433919308 /nfs/dbraw/zinc/91/93/08/1433919308.db2.gz RIRWOMXKOBDWFA-CRAIPNDOSA-N 2 1 383.458 3.094 20 0 GGADMP Cc1cc(C[N@H+]2CCCC[C@@H]2CNC(=O)CC[NH3+])ccc1Oc1cccnc1 ZINC000262043245 1433924125 /nfs/dbraw/zinc/92/41/25/1433924125.db2.gz PJPFURHKKWPUPP-LJQANCHMSA-N 2 1 382.508 3.002 20 0 GGADMP c1csc(-c2nn(-c3ccccc3)cc2C[N@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)c1 ZINC000262074358 1433926141 /nfs/dbraw/zinc/92/61/41/1433926141.db2.gz CWCDUFCFJKACBL-HXUWFJFHSA-N 2 1 393.560 3.080 20 0 GGADMP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000262101387 1433926913 /nfs/dbraw/zinc/92/69/13/1433926913.db2.gz ZHSMJLPVAWTFNQ-QFIPXVFZSA-N 2 1 381.495 3.211 20 0 GGADMP Clc1ccccc1COc1cccc(C[N@H+]2CC[C@H](N3CC[NH2+]CC3)C2)c1 ZINC000262102387 1433926924 /nfs/dbraw/zinc/92/69/24/1433926924.db2.gz IWXQHHMRAARAAA-FQEVSTJZSA-N 2 1 385.939 3.399 20 0 GGADMP CCOc1cc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)cc(Br)c1OC ZINC000262112432 1433927673 /nfs/dbraw/zinc/92/76/73/1433927673.db2.gz WOXWBFZSAOUTCA-UHFFFAOYSA-N 2 1 383.330 3.432 20 0 GGADMP COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)CCC(=O)N2CC[NH2+]CC2)cc1 ZINC000262232211 1433931828 /nfs/dbraw/zinc/93/18/28/1433931828.db2.gz VMJNGGWGZPHGRW-GOSISDBHSA-N 2 1 381.520 3.177 20 0 GGADMP C[N@H+]1CCC[C@H](CNC(=O)C2C[C@H]3CCC[C@@H](C2)C3[NH3+])[C@@H]1c1cccs1 ZINC000262278902 1433933440 /nfs/dbraw/zinc/93/34/40/1433933440.db2.gz LKVKYBCCTMAVKH-UADOYNRMSA-N 2 1 375.582 3.401 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)C1C[C@H]2CCC[C@@H](C1)C2[NH3+] ZINC000262320642 1433934982 /nfs/dbraw/zinc/93/49/82/1433934982.db2.gz FFTNTYPRSPJFHT-HURAVPBCSA-N 2 1 383.580 3.413 20 0 GGADMP C[C@H](C(=O)N(Cc1ccccn1)[C@H]1CCC[NH2+]CC1)[N@@H+](C)Cc1ccccc1 ZINC000262438604 1433939215 /nfs/dbraw/zinc/93/92/15/1433939215.db2.gz UQSYHTNFHOHQLE-KNQAVFIVSA-N 2 1 380.536 3.073 20 0 GGADMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)CC3(C[NH3+])CCCCC3)cc2)C[C@H](C)O1 ZINC000262609852 1433946126 /nfs/dbraw/zinc/94/61/26/1433946126.db2.gz ANNGVRZUNDTHDN-KDURUIRLSA-N 2 1 387.568 3.211 20 0 GGADMP C[C@H]([NH3+])[C@@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000262652770 1433948229 /nfs/dbraw/zinc/94/82/29/1433948229.db2.gz YPFYULLFKARISZ-WDYCEAGBSA-N 2 1 383.458 3.027 20 0 GGADMP C[C@@H]1C[N@H+](CCC2CCN(C(=O)CC3(C[NH3+])CCCCC3)CC2)C[C@H](C)O1 ZINC000262697282 1433950511 /nfs/dbraw/zinc/95/05/11/1433950511.db2.gz XXYWVJDPOXBZSS-KDURUIRLSA-N 2 1 379.589 3.024 20 0 GGADMP CCC[C@@](C)([NH3+])C(=O)Nc1ccc(C[NH+]2CCN(Cc3ccccc3)CC2)cc1 ZINC000262705739 1433951168 /nfs/dbraw/zinc/95/11/68/1433951168.db2.gz LXLQMADGAFKYDX-XMMPIXPASA-N 2 1 394.563 3.460 20 0 GGADMP CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2ccn([C@H]3CCC[NH2+]C3)n2)c1 ZINC000262767075 1433954886 /nfs/dbraw/zinc/95/48/86/1433954886.db2.gz LZEWNVNKMGEXOX-NRFANRHFSA-N 2 1 397.567 3.360 20 0 GGADMP CCO[C@H]1C[C@]([NH3+])(C(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1(C)C ZINC000262792588 1433956568 /nfs/dbraw/zinc/95/65/68/1433956568.db2.gz OKZYGIQXIQXHDZ-URXFXBBRSA-N 2 1 395.547 3.017 20 0 GGADMP CCO[C@@H]1C[C@]([NH3+])(C(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1(C)C ZINC000262792584 1433956718 /nfs/dbraw/zinc/95/67/18/1433956718.db2.gz OKZYGIQXIQXHDZ-QPPBQGQZSA-N 2 1 395.547 3.017 20 0 GGADMP CCO[C@@H]1C[C@@]([NH3+])(C(=O)NCc2ccccc2C[N@H+]2CCCC[C@@H]2C)C1(C)C ZINC000262818698 1433958635 /nfs/dbraw/zinc/95/86/35/1433958635.db2.gz XNWDYUHYYWOLLE-XTQVGHSUSA-N 2 1 387.568 3.210 20 0 GGADMP Cc1ccc(NC(=O)[C@](C)([NH3+])c2ccccc2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000262909176 1433966078 /nfs/dbraw/zinc/96/60/78/1433966078.db2.gz QMTSSBSFBLMGKH-HSZRJFAPSA-N 2 1 394.519 3.232 20 0 GGADMP C[C@]1([NH3+])CCCC[C@@H]1C(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000263197046 1433993762 /nfs/dbraw/zinc/99/37/62/1433993762.db2.gz INMAVMJMUQZGFQ-SCTDSRPQSA-N 2 1 383.458 3.304 20 0 GGADMP C[C@]1([NH3+])CCCC[C@H]1C(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000263197044 1433993981 /nfs/dbraw/zinc/99/39/81/1433993981.db2.gz INMAVMJMUQZGFQ-LNLFQRSKSA-N 2 1 383.458 3.304 20 0 GGADMP Cc1ccc(NC(=O)[C@@H]2CCCC[C@@]2(C)[NH3+])cc1NC(=O)C[NH+]1CCCCC1 ZINC000263246698 1433997933 /nfs/dbraw/zinc/99/79/33/1433997933.db2.gz PJZDXAUYRBBELI-PGRDOPGGSA-N 2 1 386.540 3.266 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cs1 ZINC000263741046 1434027547 /nfs/dbraw/zinc/02/75/47/1434027547.db2.gz AERLUBKEECCDOQ-HXUWFJFHSA-N 2 1 398.576 3.054 20 0 GGADMP Cc1nc(C[NH+]2CCC(C(=O)N[C@@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)cs1 ZINC000263741046 1434027550 /nfs/dbraw/zinc/02/75/50/1434027550.db2.gz AERLUBKEECCDOQ-HXUWFJFHSA-N 2 1 398.576 3.054 20 0 GGADMP Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC1CC[NH+](CC2CCCC2)CC1 ZINC000263775658 1434032392 /nfs/dbraw/zinc/03/23/92/1434032392.db2.gz VCFMHBKIMOSMRF-UHFFFAOYSA-N 2 1 396.539 3.030 20 0 GGADMP Cc1ccc(-c2nc(C[NH+]3CCC(C(=O)NCC[NH+](C)C)CC3)cs2)cc1 ZINC000264072493 1434069129 /nfs/dbraw/zinc/06/91/29/1434069129.db2.gz BPBOXXYFPBCYFV-UHFFFAOYSA-N 2 1 386.565 3.008 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc(C[NH+]3CCCC3)cc2)cn1 ZINC000264259601 1434089177 /nfs/dbraw/zinc/08/91/77/1434089177.db2.gz PCVAYPJDATUQMV-UHFFFAOYSA-N 2 1 375.476 3.102 20 0 GGADMP Cc1[nH+]ccn1CCNC(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000264450299 1434114576 /nfs/dbraw/zinc/11/45/76/1434114576.db2.gz YMZQNWDNBLEXJM-UHFFFAOYSA-N 2 1 389.931 3.056 20 0 GGADMP CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc(C[NH+]3CCCC3)cc2)[C@@H](C)C1 ZINC000265253587 1434208037 /nfs/dbraw/zinc/20/80/37/1434208037.db2.gz KSZXVJTYPLRYEY-UGKGYDQZSA-N 2 1 387.568 3.149 20 0 GGADMP C[C@@H](c1ccc(NC(=O)N2CC[C@H]([NH+]3CCCCC3)C2)cc1)[NH+]1CCOCC1 ZINC000265359586 1434224282 /nfs/dbraw/zinc/22/42/82/1434224282.db2.gz FZFALZNZFYTAJV-RXVVDRJESA-N 2 1 386.540 3.172 20 0 GGADMP C[C@H](c1ccc(NC(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)cc1)[NH+]1CCOCC1 ZINC000265359587 1434224411 /nfs/dbraw/zinc/22/44/11/1434224411.db2.gz FZFALZNZFYTAJV-WIYYLYMNSA-N 2 1 386.540 3.172 20 0 GGADMP C[NH+](C)C/C=C/C(=O)N1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000265641059 1434252560 /nfs/dbraw/zinc/25/25/60/1434252560.db2.gz LZKINCYXFYZXTR-VMPITWQZSA-N 2 1 383.458 3.246 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@H+]1CCCC2(CCOCC2)C1 ZINC000266009495 1434295953 /nfs/dbraw/zinc/29/59/53/1434295953.db2.gz LORKQGQBSYTFKI-FQEVSTJZSA-N 2 1 399.579 3.048 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(OCC[NH+](CC)CC)cc2)C1 ZINC000266302994 1434318125 /nfs/dbraw/zinc/31/81/25/1434318125.db2.gz KTOWLCJOMQDEIM-IBGZPJMESA-N 2 1 375.557 3.211 20 0 GGADMP CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(OCC[NH+](CC)CC)cc2)C1 ZINC000266302997 1434318147 /nfs/dbraw/zinc/31/81/47/1434318147.db2.gz KTOWLCJOMQDEIM-LJQANCHMSA-N 2 1 375.557 3.211 20 0 GGADMP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(C(F)(F)F)CC1 ZINC000266597917 1434352902 /nfs/dbraw/zinc/35/29/02/1434352902.db2.gz BVERIAZAEFTNRR-MRXNPFEDSA-N 2 1 397.485 3.430 20 0 GGADMP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(C(F)(F)F)CC1 ZINC000266597915 1434352952 /nfs/dbraw/zinc/35/29/52/1434352952.db2.gz BVERIAZAEFTNRR-INIZCTEOSA-N 2 1 397.485 3.430 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)cc1 ZINC000266668867 1434361518 /nfs/dbraw/zinc/36/15/18/1434361518.db2.gz UTABDJNTCYQIFW-UHFFFAOYSA-N 2 1 382.508 3.281 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1 ZINC000266779037 1434374560 /nfs/dbraw/zinc/37/45/60/1434374560.db2.gz JOUJMPYKKOYKLR-UHFFFAOYSA-N 2 1 391.947 3.399 20 0 GGADMP C[NH+]1CCC(C(=O)N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000266813375 1434377947 /nfs/dbraw/zinc/37/79/47/1434377947.db2.gz IYBGNFWIGXQWGJ-UHFFFAOYSA-N 2 1 383.458 3.082 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N(CC[NH+](C)C)Cc1ccc(F)cc1F ZINC000266868238 1434383431 /nfs/dbraw/zinc/38/34/31/1434383431.db2.gz PJKZPEFVNPGKOO-UHFFFAOYSA-N 2 1 393.482 3.023 20 0 GGADMP O=C(CC[NH+]1CCOCC1)Nc1cccc(C[NH2+][C@H]2CCc3c2cccc3F)c1 ZINC000266998557 1434397505 /nfs/dbraw/zinc/39/75/05/1434397505.db2.gz BQFWODHWBNMWMV-QFIPXVFZSA-N 2 1 397.494 3.264 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)[C@H](c2ccccc2)N2CCOCC2)cn1 ZINC000267285588 1434419136 /nfs/dbraw/zinc/41/91/36/1434419136.db2.gz WJXBILSLBIWAKL-FDDCHVKYSA-N 2 1 391.519 3.127 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000267308596 1434421382 /nfs/dbraw/zinc/42/13/82/1434421382.db2.gz BSPHVOOSTRSVKO-WIYYLYMNSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1CCCCNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000267308596 1434421383 /nfs/dbraw/zinc/42/13/83/1434421383.db2.gz BSPHVOOSTRSVKO-WIYYLYMNSA-N 2 1 383.540 3.182 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000267323134 1434422907 /nfs/dbraw/zinc/42/29/07/1434422907.db2.gz KPIVWLPEPUQRHS-LQWHRVPQSA-N 2 1 383.540 3.037 20 0 GGADMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000267323134 1434422908 /nfs/dbraw/zinc/42/29/08/1434422908.db2.gz KPIVWLPEPUQRHS-LQWHRVPQSA-N 2 1 383.540 3.037 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000267325205 1434423075 /nfs/dbraw/zinc/42/30/75/1434423075.db2.gz DYQVKHSDNHDAIO-UGKGYDQZSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000267359331 1434425543 /nfs/dbraw/zinc/42/55/43/1434425543.db2.gz IZQNSTCFNCKSEZ-HJNYFJLDSA-N 2 1 384.568 3.024 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000267359328 1434425552 /nfs/dbraw/zinc/42/55/52/1434425552.db2.gz IZQNSTCFNCKSEZ-FCEUIQTBSA-N 2 1 384.568 3.024 20 0 GGADMP CCO[C@H](CC[NH+](C)C)C[NH2+]Cc1csc(COc2ccc(OC)cc2)n1 ZINC000267866714 1434472063 /nfs/dbraw/zinc/47/20/63/1434472063.db2.gz KJCYMEXIISCOBI-LJQANCHMSA-N 2 1 393.553 3.177 20 0 GGADMP C[NH+](C)Cc1ccsc1C(=O)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000268066973 1434492440 /nfs/dbraw/zinc/49/24/40/1434492440.db2.gz BFBVHGFFLWKEGZ-UHFFFAOYSA-N 2 1 383.561 3.473 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[N@H+](CC[C@@H]3CCCC[NH+]3C)CC2)cc1 ZINC000268511730 1434528934 /nfs/dbraw/zinc/52/89/34/1434528934.db2.gz CMJQSVIDRPNXDI-NRFANRHFSA-N 2 1 387.568 3.037 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[N@@H+](CC[C@@H]3CCCC[NH+]3C)CC2)cc1 ZINC000268511730 1434528936 /nfs/dbraw/zinc/52/89/36/1434528936.db2.gz CMJQSVIDRPNXDI-NRFANRHFSA-N 2 1 387.568 3.037 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[NH+](CC[C@@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000268511730 1434528939 /nfs/dbraw/zinc/52/89/39/1434528939.db2.gz CMJQSVIDRPNXDI-NRFANRHFSA-N 2 1 387.568 3.037 20 0 GGADMP COc1ccc(CCC(=O)N2CCC[NH+](CC[C@@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000268511730 1434528941 /nfs/dbraw/zinc/52/89/41/1434528941.db2.gz CMJQSVIDRPNXDI-NRFANRHFSA-N 2 1 387.568 3.037 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(N3CCOCC3)nc2)cc1 ZINC000268733107 1434550984 /nfs/dbraw/zinc/55/09/84/1434550984.db2.gz CRRWDAHRFZYYMC-KRWDZBQOSA-N 2 1 377.492 3.263 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)nc2)cc1 ZINC000268733108 1434551218 /nfs/dbraw/zinc/55/12/18/1434551218.db2.gz CRRWDAHRFZYYMC-QGZVFWFLSA-N 2 1 377.492 3.263 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)[C@@H](C)C3)cn2)CCO1 ZINC000268761544 1434554180 /nfs/dbraw/zinc/55/41/80/1434554180.db2.gz HMEDEIIUMSAQMP-MZKRTTBSSA-N 2 1 394.563 3.449 20 0 GGADMP C[C@@H]1CN(c2ccc(C[NH2+][C@H]3CC[N@@H+](Cc4ccccc4)[C@@H](C)C3)cn2)CCO1 ZINC000268761544 1434554185 /nfs/dbraw/zinc/55/41/85/1434554185.db2.gz HMEDEIIUMSAQMP-MZKRTTBSSA-N 2 1 394.563 3.449 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCC(=O)N(C)C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000268766865 1434554594 /nfs/dbraw/zinc/55/45/94/1434554594.db2.gz JPKLLPMSRNUPSG-UGKGYDQZSA-N 2 1 395.547 3.296 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCC(=O)N(C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000268766865 1434554596 /nfs/dbraw/zinc/55/45/96/1434554596.db2.gz JPKLLPMSRNUPSG-UGKGYDQZSA-N 2 1 395.547 3.296 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc(OCC(=O)N(C)C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000268766856 1434554714 /nfs/dbraw/zinc/55/47/14/1434554714.db2.gz JPKLLPMSRNUPSG-DENIHFKCSA-N 2 1 395.547 3.296 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc(OCC(=O)N(C)C)c2)CC[N@H+]1Cc1ccccc1 ZINC000268766856 1434554716 /nfs/dbraw/zinc/55/47/16/1434554716.db2.gz JPKLLPMSRNUPSG-DENIHFKCSA-N 2 1 395.547 3.296 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Cn3cncn3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000268775913 1434555988 /nfs/dbraw/zinc/55/59/88/1434555988.db2.gz VVJFGFBGSGUKAL-AUSIDOKSSA-N 2 1 375.520 3.469 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Cn3cncn3)cc2)CC[N@H+]1Cc1ccccc1 ZINC000268775913 1434555991 /nfs/dbraw/zinc/55/59/91/1434555991.db2.gz VVJFGFBGSGUKAL-AUSIDOKSSA-N 2 1 375.520 3.469 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2ccc(NC(=O)NC(C)C)cc2)CC1 ZINC000268789784 1434557738 /nfs/dbraw/zinc/55/77/38/1434557738.db2.gz CQEZHDDGOWUJQK-LJQANCHMSA-N 2 1 389.588 3.285 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)CC1 ZINC000268789783 1434557760 /nfs/dbraw/zinc/55/77/60/1434557760.db2.gz CQEZHDDGOWUJQK-IBGZPJMESA-N 2 1 389.588 3.285 20 0 GGADMP COc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ccc1OCCO ZINC000268826165 1434561401 /nfs/dbraw/zinc/56/14/01/1434561401.db2.gz YXUDQDSCMVWWDE-WIYYLYMNSA-N 2 1 384.520 3.209 20 0 GGADMP COc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1OCCO ZINC000268826165 1434561403 /nfs/dbraw/zinc/56/14/03/1434561403.db2.gz YXUDQDSCMVWWDE-WIYYLYMNSA-N 2 1 384.520 3.209 20 0 GGADMP COc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ccc1OCCO ZINC000268826163 1434561551 /nfs/dbraw/zinc/56/15/51/1434561551.db2.gz YXUDQDSCMVWWDE-RXVVDRJESA-N 2 1 384.520 3.209 20 0 GGADMP COc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1OCCO ZINC000268826163 1434561555 /nfs/dbraw/zinc/56/15/55/1434561555.db2.gz YXUDQDSCMVWWDE-RXVVDRJESA-N 2 1 384.520 3.209 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCS(=O)(=O)Cc2ccccc2)cc1 ZINC000268828143 1434561848 /nfs/dbraw/zinc/56/18/48/1434561848.db2.gz VBFKJPOSIRKQRV-KRWDZBQOSA-N 2 1 383.517 3.446 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCS(=O)(=O)Cc2ccccc2)cc1 ZINC000268828144 1434561899 /nfs/dbraw/zinc/56/18/99/1434561899.db2.gz VBFKJPOSIRKQRV-QGZVFWFLSA-N 2 1 383.517 3.446 20 0 GGADMP CC[C@H]([NH2+]Cc1ccc(C(=O)N2CC[NH+](C)CC2)cc1)c1ccc2c(c1)CCO2 ZINC000268842311 1434563629 /nfs/dbraw/zinc/56/36/29/1434563629.db2.gz UKGBEYYYXXWZRK-QFIPXVFZSA-N 2 1 393.531 3.250 20 0 GGADMP c1ccc(CC[NH+]2CCC([NH2+]C3CCN(Cc4ccncc4)CC3)CC2)cc1 ZINC000268848295 1434564351 /nfs/dbraw/zinc/56/43/51/1434564351.db2.gz JPULKRAMSOTYTC-UHFFFAOYSA-N 2 1 378.564 3.343 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(CS(C)(=O)=O)c2)CC[N@@H+]1Cc1ccccc1 ZINC000268850757 1434564539 /nfs/dbraw/zinc/56/45/39/1434564539.db2.gz XVWGBTCKFZSICC-GCJKJVERSA-N 2 1 386.561 3.374 20 0 GGADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(CS(C)(=O)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000268850757 1434564541 /nfs/dbraw/zinc/56/45/41/1434564541.db2.gz XVWGBTCKFZSICC-GCJKJVERSA-N 2 1 386.561 3.374 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000268883564 1434567586 /nfs/dbraw/zinc/56/75/86/1434567586.db2.gz IMZZYYPGNYOAQV-HCLVMJGWSA-N 2 1 384.520 3.380 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000268883564 1434567589 /nfs/dbraw/zinc/56/75/89/1434567589.db2.gz IMZZYYPGNYOAQV-HCLVMJGWSA-N 2 1 384.520 3.380 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OCCOC)cc2)[C@@H](C)C1 ZINC000268901633 1434569131 /nfs/dbraw/zinc/56/91/31/1434569131.db2.gz LHYDZEQPRUQNBC-JQVVWYNYSA-N 2 1 378.557 3.499 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(OCCOC)cc2)[C@H](C)C1 ZINC000268901627 1434569155 /nfs/dbraw/zinc/56/91/55/1434569155.db2.gz LHYDZEQPRUQNBC-DXIQSLLYSA-N 2 1 378.557 3.499 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H]2CO)cc1 ZINC000268972104 1434577010 /nfs/dbraw/zinc/57/70/10/1434577010.db2.gz ZPZOLTBBNIZDQF-XLIONFOSSA-N 2 1 376.545 3.104 20 0 GGADMP Cc1ccc(NC(=O)[C@@H](C[NH3+])c2ccccc2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000269265747 1434615517 /nfs/dbraw/zinc/61/55/17/1434615517.db2.gz ZDEGZABCQJOQHG-FQEVSTJZSA-N 2 1 394.519 3.100 20 0 GGADMP C[NH+](C)[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccsc1 ZINC000269482150 1434652139 /nfs/dbraw/zinc/65/21/39/1434652139.db2.gz GESFITAMOROOIS-ZYSHUDEJSA-N 2 1 376.570 3.009 20 0 GGADMP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C1 ZINC000269677213 1434668564 /nfs/dbraw/zinc/66/85/64/1434668564.db2.gz CYQUAWUUHVHNDD-JENIJYKNSA-N 2 1 381.520 3.058 20 0 GGADMP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C1 ZINC000269677220 1434668669 /nfs/dbraw/zinc/66/86/69/1434668669.db2.gz CYQUAWUUHVHNDD-ZIFCJYIRSA-N 2 1 381.520 3.058 20 0 GGADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1 ZINC000269713534 1434671401 /nfs/dbraw/zinc/67/14/01/1434671401.db2.gz QXLJFEKEILEKTH-MSOLQXFVSA-N 2 1 380.492 3.169 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000270218320 1434714069 /nfs/dbraw/zinc/71/40/69/1434714069.db2.gz MILVXRMHOKWMJA-OIBXWCBGSA-N 2 1 398.595 3.270 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000270218342 1434714136 /nfs/dbraw/zinc/71/41/36/1434714136.db2.gz MILVXRMHOKWMJA-WTIAFYNJSA-N 2 1 398.595 3.270 20 0 GGADMP C[C@@H]1C[C@@H](NC(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000270246441 1434716281 /nfs/dbraw/zinc/71/62/81/1434716281.db2.gz PWOVBONSOKNCRI-PTUXOGIPSA-N 2 1 398.595 3.413 20 0 GGADMP C[C@@H](CC[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1)[NH+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271217730 1434808838 /nfs/dbraw/zinc/80/88/38/1434808838.db2.gz JEFXBRUQUOUFRN-CDJZJNNCSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[NH+]1CC[C@@H](C)[C@H](n2ccnc2)C1)[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271217730 1434808839 /nfs/dbraw/zinc/80/88/39/1434808839.db2.gz JEFXBRUQUOUFRN-CDJZJNNCSA-N 2 1 384.572 3.324 20 0 GGADMP C[C@@H](CC[NH+]1CC[C@@H](C)[C@H](n2ccnc2)C1)[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271217730 1434808842 /nfs/dbraw/zinc/80/88/42/1434808842.db2.gz JEFXBRUQUOUFRN-CDJZJNNCSA-N 2 1 384.572 3.324 20 0 GGADMP CC(C[NH+]1CC[C@H](C)[C@H](n2ccnc2)C1)C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271288627 1434813396 /nfs/dbraw/zinc/81/33/96/1434813396.db2.gz MDPNOPJLMFCCMR-FNAHDJPLSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@@H](C[NH+]1CC[C@H](C)[C@H](n2ccnc2)C1)C[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000271288634 1434813414 /nfs/dbraw/zinc/81/34/14/1434813414.db2.gz MDPNOPJLMFCCMR-QGJCJDORSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@H](C[NH+]1CC[C@@H](C)[C@@H](n2ccnc2)C1)C[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271288634 1434813415 /nfs/dbraw/zinc/81/34/15/1434813415.db2.gz MDPNOPJLMFCCMR-QGJCJDORSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@H](C[NH+]1CC[C@@H](C)[C@@H](n2ccnc2)C1)C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271288634 1434813417 /nfs/dbraw/zinc/81/34/17/1434813417.db2.gz MDPNOPJLMFCCMR-QGJCJDORSA-N 2 1 384.572 3.182 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]CCNC(=O)c2c(F)cccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000271470503 1434827429 /nfs/dbraw/zinc/82/74/29/1434827429.db2.gz LUYKONXWGUVUIK-SJLPKXTDSA-N 2 1 387.474 3.337 20 0 GGADMP C[C@@H]1C[C@H]([NH2+]CCNC(=O)c2c(F)cccc2F)CC[N@H+]1Cc1ccccc1 ZINC000271470503 1434827430 /nfs/dbraw/zinc/82/74/30/1434827430.db2.gz LUYKONXWGUVUIK-SJLPKXTDSA-N 2 1 387.474 3.337 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]CCNC(=O)c2c(F)cccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000271470507 1434827442 /nfs/dbraw/zinc/82/74/42/1434827442.db2.gz LUYKONXWGUVUIK-WMZOPIPTSA-N 2 1 387.474 3.337 20 0 GGADMP C[C@H]1C[C@@H]([NH2+]CCNC(=O)c2c(F)cccc2F)CC[N@H+]1Cc1ccccc1 ZINC000271470507 1434827443 /nfs/dbraw/zinc/82/74/43/1434827443.db2.gz LUYKONXWGUVUIK-WMZOPIPTSA-N 2 1 387.474 3.337 20 0 GGADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000271476204 1434828030 /nfs/dbraw/zinc/82/80/30/1434828030.db2.gz MRKGRZAMXLCWPW-PXNSSMCTSA-N 2 1 383.561 3.133 20 0 GGADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(=O)N1CCc2sccc2C1 ZINC000271476204 1434828033 /nfs/dbraw/zinc/82/80/33/1434828033.db2.gz MRKGRZAMXLCWPW-PXNSSMCTSA-N 2 1 383.561 3.133 20 0 GGADMP Fc1ccc(CC[NH+]2CCC([NH2+]C3CCN(CC(F)(F)F)CC3)CC2)cc1 ZINC000271522390 1434831827 /nfs/dbraw/zinc/83/18/27/1434831827.db2.gz VAPAOIHAYBRCLN-UHFFFAOYSA-N 2 1 387.465 3.449 20 0 GGADMP CCOC(=O)c1nn(-c2ccccc2)cc1C[NH2+]CCCCn1cc[nH+]c1C ZINC000271823062 1434852783 /nfs/dbraw/zinc/85/27/83/1434852783.db2.gz NGSLMWQWYBMOFW-UHFFFAOYSA-N 2 1 381.480 3.124 20 0 GGADMP C[C@@H](NC(=O)NC1CC[NH+](CC2CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272208000 1434878116 /nfs/dbraw/zinc/87/81/16/1434878116.db2.gz PRRMXHIEDQYANJ-WIYYLYMNSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@H](NC(=O)NC1CC[NH+](CC2CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272207997 1434878183 /nfs/dbraw/zinc/87/81/83/1434878183.db2.gz PRRMXHIEDQYANJ-RXVVDRJESA-N 2 1 384.568 3.071 20 0 GGADMP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000272277159 1434883593 /nfs/dbraw/zinc/88/35/93/1434883593.db2.gz FBFGRKNXFGFLGI-ILWGZMRPSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000272277159 1434883595 /nfs/dbraw/zinc/88/35/95/1434883595.db2.gz FBFGRKNXFGFLGI-ILWGZMRPSA-N 2 1 386.584 3.270 20 0 GGADMP CCC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000272277159 1434883596 /nfs/dbraw/zinc/88/35/96/1434883596.db2.gz FBFGRKNXFGFLGI-ILWGZMRPSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]([NH+]2CCCCC2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272305636 1434885994 /nfs/dbraw/zinc/88/59/94/1434885994.db2.gz JTFAGWACWDNWID-KSEOMHKRSA-N 2 1 384.568 3.167 20 0 GGADMP COc1c(O)cccc1C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000272332605 1434887794 /nfs/dbraw/zinc/88/77/94/1434887794.db2.gz WVMCOPNOTJSPLF-QFIPXVFZSA-N 2 1 384.520 3.278 20 0 GGADMP C[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272350882 1434889421 /nfs/dbraw/zinc/88/94/21/1434889421.db2.gz YETOJTVCDFYTJV-CEWLAPEOSA-N 2 1 395.551 3.008 20 0 GGADMP C[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272351948 1434889602 /nfs/dbraw/zinc/88/96/02/1434889602.db2.gz YETOJTVCDFYTJV-TYPHKJRUSA-N 2 1 395.551 3.008 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272447586 1434896971 /nfs/dbraw/zinc/89/69/71/1434896971.db2.gz MDERSAGXOVDMSK-IHPCNDPISA-N 2 1 384.524 3.092 20 0 GGADMP C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272447586 1434896972 /nfs/dbraw/zinc/89/69/72/1434896972.db2.gz MDERSAGXOVDMSK-IHPCNDPISA-N 2 1 384.524 3.092 20 0 GGADMP C[N@H+]1CC[C@H]2CCN(C(=O)Nc3ccc(OCC[NH+]4CCCCC4)cc3)[C@@H]2C1 ZINC000272449714 1434897167 /nfs/dbraw/zinc/89/71/67/1434897167.db2.gz PLOGFYPPXJBGNS-GHTZIAJQSA-N 2 1 386.540 3.109 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000272468111 1434898287 /nfs/dbraw/zinc/89/82/87/1434898287.db2.gz HYGUMRCJLBXPML-BDKRGJGYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272468111 1434898288 /nfs/dbraw/zinc/89/82/88/1434898288.db2.gz HYGUMRCJLBXPML-BDKRGJGYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272468111 1434898289 /nfs/dbraw/zinc/89/82/89/1434898289.db2.gz HYGUMRCJLBXPML-BDKRGJGYSA-N 2 1 384.568 3.023 20 0 GGADMP C[C@H](NC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272470381 1434898496 /nfs/dbraw/zinc/89/84/96/1434898496.db2.gz IFPXLWIKYIOWKK-KSEOMHKRSA-N 2 1 384.568 3.024 20 0 GGADMP C[N@H+]1CC[C@@H]2CCN(C(=O)NC3CC[NH+](Cc4ccc(Cl)cc4)CC3)[C@H]2C1 ZINC000272472535 1434898739 /nfs/dbraw/zinc/89/87/39/1434898739.db2.gz QKWHTNRMAPFDQS-XLIONFOSSA-N 2 1 390.959 3.040 20 0 GGADMP COc1ccc(OC)c([C@H](O)C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000272553216 1434907386 /nfs/dbraw/zinc/90/73/86/1434907386.db2.gz SWTQIEULIJWCBK-ZWCUEREDSA-N 2 1 384.520 3.237 20 0 GGADMP CCC[NH+]1CCC(N(C)C(=O)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000272569593 1434908891 /nfs/dbraw/zinc/90/88/91/1434908891.db2.gz SWJJUWZIMRMVHY-TZIWHRDSSA-N 2 1 386.584 3.413 20 0 GGADMP C[C@H](NC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1)C1=CC[NH+](C)CC1 ZINC000272650656 1434919501 /nfs/dbraw/zinc/91/95/01/1434919501.db2.gz AOULGMCKRWWWAB-IBGZPJMESA-N 2 1 384.568 3.190 20 0 GGADMP C[C@H](NC(=O)N1CCC(C[NH+](C)Cc2ccccc2)CC1)C1=CC[N@H+](C)CC1 ZINC000272650656 1434919502 /nfs/dbraw/zinc/91/95/02/1434919502.db2.gz AOULGMCKRWWWAB-IBGZPJMESA-N 2 1 384.568 3.190 20 0 GGADMP C[C@H](NC(=O)N1CCC(C[NH+](C)Cc2ccccc2)CC1)C1=CC[N@@H+](C)CC1 ZINC000272650656 1434919505 /nfs/dbraw/zinc/91/95/05/1434919505.db2.gz AOULGMCKRWWWAB-IBGZPJMESA-N 2 1 384.568 3.190 20 0 GGADMP C[C@H]([NH2+]C1CCN(C(=O)c2ccncc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272659474 1434920584 /nfs/dbraw/zinc/92/05/84/1434920584.db2.gz MPKDFGIKIDMJAL-UGKGYDQZSA-N 2 1 392.547 3.186 20 0 GGADMP C[C@H](C[C@H](C)NC(=O)OC(C)(C)C)[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000272711619 1434925179 /nfs/dbraw/zinc/92/51/79/1434925179.db2.gz BKACLGMSDYPASL-UWVAXJGDSA-N 2 1 391.556 3.035 20 0 GGADMP C[C@H](C[C@H](C)NC(=O)OC(C)(C)C)[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000272711613 1434925182 /nfs/dbraw/zinc/92/51/82/1434925182.db2.gz BKACLGMSDYPASL-FUHIMQAGSA-N 2 1 391.556 3.035 20 0 GGADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCN(CCC(F)(F)F)CC3)c2)CCO1 ZINC000272748402 1434927928 /nfs/dbraw/zinc/92/79/28/1434927928.db2.gz SIHYCJJRWKNFRM-QGZVFWFLSA-N 2 1 399.501 3.414 20 0 GGADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCN(CCC(F)(F)F)CC3)c2)CCO1 ZINC000272748402 1434927929 /nfs/dbraw/zinc/92/79/29/1434927929.db2.gz SIHYCJJRWKNFRM-QGZVFWFLSA-N 2 1 399.501 3.414 20 0 GGADMP CCNC(=O)COc1cccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000272762068 1434929078 /nfs/dbraw/zinc/92/90/78/1434929078.db2.gz LTRDNKFNUNGJGV-DENIHFKCSA-N 2 1 395.547 3.202 20 0 GGADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(-n2cccn2)cc1 ZINC000272794027 1434931498 /nfs/dbraw/zinc/93/14/98/1434931498.db2.gz YAEIIKGCTRRMOR-JPYJTQIMSA-N 2 1 376.504 3.290 20 0 GGADMP CC[NH+](CC)Cc1ccc(C(=O)NCc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1 ZINC000272822300 1434933916 /nfs/dbraw/zinc/93/39/16/1434933916.db2.gz NIIFECLSNOXPIQ-QHCPKHFHSA-N 2 1 395.547 3.025 20 0 GGADMP C[C@@H]([NH2+]CCCc1nnc2n1CCCCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272875634 1434938008 /nfs/dbraw/zinc/93/80/08/1434938008.db2.gz WWZPBDASHHZFQZ-TZIWHRDSSA-N 2 1 381.568 3.437 20 0 GGADMP C[C@H]([NH2+]CCCc1nnc2n1CCCCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272875624 1434938072 /nfs/dbraw/zinc/93/80/72/1434938072.db2.gz WWZPBDASHHZFQZ-PZJWPPBQSA-N 2 1 381.568 3.437 20 0 GGADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@@H](Cc3ccc(F)cc3)C(N)=O)cc2)CC1 ZINC000273058306 1434955913 /nfs/dbraw/zinc/95/59/13/1434955913.db2.gz YDJFCWRJDJSIJU-QFIPXVFZSA-N 2 1 398.526 3.112 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCN(Cc3ccccn3)C2=O)cc1 ZINC000273322975 1434980737 /nfs/dbraw/zinc/98/07/37/1434980737.db2.gz ZPCDAXCAPCYADU-JTSKRJEESA-N 2 1 389.503 3.418 20 0 GGADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCCN(Cc3ccccn3)C2=O)cc1 ZINC000273322984 1434980822 /nfs/dbraw/zinc/98/08/22/1434980822.db2.gz ZPCDAXCAPCYADU-VGSWGCGISA-N 2 1 389.503 3.418 20 0 GGADMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)cc1F ZINC000273341158 1434981969 /nfs/dbraw/zinc/98/19/69/1434981969.db2.gz AKUCWHHWHQSVDB-HNNXBMFYSA-N 2 1 387.503 3.192 20 0 GGADMP C[C@H](NC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000273407907 1434986799 /nfs/dbraw/zinc/98/67/99/1434986799.db2.gz IDTKAEWLYQCSPD-CNNODRBYSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000273418951 1434987635 /nfs/dbraw/zinc/98/76/35/1434987635.db2.gz KKWRSAUCMWYLLG-WOIUINJBSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000273418953 1434987647 /nfs/dbraw/zinc/98/76/47/1434987647.db2.gz KKWRSAUCMWYLLG-XQBPLPMBSA-N 2 1 386.584 3.269 20 0 GGADMP OCC[C@H]([NH2+]Cc1cccc(C[NH2+][C@@H](CCO)c2ccco2)c1)c1ccco1 ZINC000274368892 1435065752 /nfs/dbraw/zinc/06/57/52/1435065752.db2.gz AJDLCJZOXLPDNC-PMACEKPBSA-N 2 1 384.476 3.299 20 0 GGADMP Cc1ccc(NC(=O)[C@@H]2CCC[N@H+]2C2CCCC2)cc1NC(=O)CC[NH+](C)C ZINC000274425729 1435070182 /nfs/dbraw/zinc/07/01/82/1435070182.db2.gz PHRPGJNXOIMZMO-FQEVSTJZSA-N 2 1 386.540 3.231 20 0 GGADMP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cn(C)nc2C(F)F)CC1 ZINC000274441814 1435071340 /nfs/dbraw/zinc/07/13/40/1435071340.db2.gz BZHKMXGJIDMCSC-CQSZACIVSA-N 2 1 395.473 3.490 20 0 GGADMP C[C@@H]([NH2+]C1CCN(C2CC[NH+](C)CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274820767 1435095384 /nfs/dbraw/zinc/09/53/84/1435095384.db2.gz BOLZZOUFCNIXAK-IFMALSPDSA-N 3 1 384.612 3.045 20 0 GGADMP C[C@H]([NH2+]C1CCN(C2CC[NH+](C)CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274820778 1435095496 /nfs/dbraw/zinc/09/54/96/1435095496.db2.gz BOLZZOUFCNIXAK-UNMCSNQZSA-N 3 1 384.612 3.045 20 0 GGADMP COc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1OCCO ZINC000274872520 1435099673 /nfs/dbraw/zinc/09/96/73/1435099673.db2.gz FXUYMQCAJHIJRE-GHTZIAJQSA-N 2 1 384.520 3.067 20 0 GGADMP C[C@@H]([NH2+]Cc1ccc(CS(C)(=O)=O)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274872579 1435100085 /nfs/dbraw/zinc/10/00/85/1435100085.db2.gz GAQFUJFSMGCHGW-XMSQKQJNSA-N 2 1 386.561 3.231 20 0 GGADMP C[C@H]([NH2+]Cc1cccc(OCC(=O)N(C)C)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274892442 1435101516 /nfs/dbraw/zinc/10/15/16/1435101516.db2.gz JPHSBFPRKKCBMV-UGKGYDQZSA-N 2 1 395.547 3.154 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(OCC(=O)N(C)C)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274892433 1435101619 /nfs/dbraw/zinc/10/16/19/1435101619.db2.gz JPHSBFPRKKCBMV-DENIHFKCSA-N 2 1 395.547 3.154 20 0 GGADMP C[C@@H]([NH2+]Cc1cccc(CS(C)(=O)=O)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274903689 1435102454 /nfs/dbraw/zinc/10/24/54/1435102454.db2.gz LSBYODIMVDCEFO-GCJKJVERSA-N 2 1 386.561 3.231 20 0 GGADMP COc1cc(OC)cc([C@H](O)C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000274927832 1435104013 /nfs/dbraw/zinc/10/40/13/1435104013.db2.gz QFMRSGQCVFQHMV-WCAVRKLYSA-N 2 1 384.520 3.237 20 0 GGADMP C[C@@H]([NH2+]CCc1cccc(C(=O)N(C)C)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274955856 1435105702 /nfs/dbraw/zinc/10/57/02/1435105702.db2.gz VXKQDWMWWMVGRQ-AUSIDOKSSA-N 2 1 379.548 3.431 20 0 GGADMP C[C@H]([NH2+]CCc1cccc(C(=O)N(C)C)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274955859 1435105803 /nfs/dbraw/zinc/10/58/03/1435105803.db2.gz VXKQDWMWWMVGRQ-CVDCTZTESA-N 2 1 379.548 3.431 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1CC[NH+](C)C)[N@@H+]1CCc2sccc2C1 ZINC000275666508 1435158127 /nfs/dbraw/zinc/15/81/27/1435158127.db2.gz OMZCFWMVEWTHQP-MRXNPFEDSA-N 2 1 386.565 3.421 20 0 GGADMP C[C@H](CNC(=O)Nc1ccccc1CC[NH+](C)C)[N@H+]1CCc2sccc2C1 ZINC000275666508 1435158129 /nfs/dbraw/zinc/15/81/29/1435158129.db2.gz OMZCFWMVEWTHQP-MRXNPFEDSA-N 2 1 386.565 3.421 20 0 GGADMP Cc1cc(N2CCC([NH2+][C@@H]3CC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]34)CC2)n[nH]1 ZINC000275928005 1435180333 /nfs/dbraw/zinc/18/03/33/1435180333.db2.gz QZZGRNXGGRNHJN-BAGYTPMASA-N 2 1 379.552 3.187 20 0 GGADMP C[C@H](NC(=O)NCc1ccc(CC[NH+](C)C)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000276110582 1435191544 /nfs/dbraw/zinc/19/15/44/1435191544.db2.gz CZGXDEOEVPAUAL-RXVVDRJESA-N 2 1 386.584 3.243 20 0 GGADMP C[C@@H](NC(=O)NCc1ccc(CC[NH+](C)C)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000276110575 1435191562 /nfs/dbraw/zinc/19/15/62/1435191562.db2.gz CZGXDEOEVPAUAL-NQIIRXRSSA-N 2 1 386.584 3.243 20 0 GGADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N(CC)c2ccccc2)[C@@H](C)C1 ZINC000276288452 1435202303 /nfs/dbraw/zinc/20/23/03/1435202303.db2.gz VEWMDPBOWWCEPK-ZVDOUQERSA-N 2 1 375.557 3.155 20 0 GGADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C(=O)N(CC)c2ccccc2)[C@@H](C)C1 ZINC000276288452 1435202305 /nfs/dbraw/zinc/20/23/05/1435202305.db2.gz VEWMDPBOWWCEPK-ZVDOUQERSA-N 2 1 375.557 3.155 20 0 GGADMP CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc2c(c1)CC[NH2+]CC2 ZINC000276530854 1435215851 /nfs/dbraw/zinc/21/58/51/1435215851.db2.gz CRZCIAANPJZTRJ-OAQYLSRUSA-N 2 1 391.559 3.359 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000276658645 1435223187 /nfs/dbraw/zinc/22/31/87/1435223187.db2.gz VPQGOWGAYKPNEF-SIKLNZKXSA-N 2 1 382.552 3.164 20 0 GGADMP COCCN(C)c1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000276658646 1435223252 /nfs/dbraw/zinc/22/32/52/1435223252.db2.gz VPQGOWGAYKPNEF-UGKGYDQZSA-N 2 1 382.552 3.164 20 0 GGADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccn([C@@H]3CCC[NH2+]C3)n2)cc1 ZINC000276737765 1435228966 /nfs/dbraw/zinc/22/89/66/1435228966.db2.gz AKWNZCPJFIKJIR-YLJYHZDGSA-N 2 1 381.524 3.434 20 0 GGADMP COc1cc(NC(=O)CC[N@H+]2CCC[C@H]([NH+](C)C)CC2)c(OC)cc1Cl ZINC000277036056 1435254844 /nfs/dbraw/zinc/25/48/44/1435254844.db2.gz BMRTXGODVROUNO-AWEZNQCLSA-N 2 1 383.920 3.102 20 0 GGADMP COc1cc2c(cc1OC)C[N@H+](Cc1ccccc1NC(=O)[C@@H](C)[C@H](C)[NH3+])CC2 ZINC000277111754 1435263145 /nfs/dbraw/zinc/26/31/45/1435263145.db2.gz VOEIVRAJZKPRTA-HOTGVXAUSA-N 2 1 397.519 3.184 20 0 GGADMP COc1cc2c(cc1OC)C[N@@H+](Cc1ccccc1NC(=O)[C@@H](C)[C@H](C)[NH3+])CC2 ZINC000277111754 1435263149 /nfs/dbraw/zinc/26/31/49/1435263149.db2.gz VOEIVRAJZKPRTA-HOTGVXAUSA-N 2 1 397.519 3.184 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12 ZINC000277135120 1435266542 /nfs/dbraw/zinc/26/65/42/1435266542.db2.gz TVAWKQBJGKIERT-SFHVURJKSA-N 2 1 395.551 3.386 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12 ZINC000277135120 1435266543 /nfs/dbraw/zinc/26/65/43/1435266543.db2.gz TVAWKQBJGKIERT-SFHVURJKSA-N 2 1 395.551 3.386 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)C(=O)N[C@H](C)c1ccccc1OC ZINC000277223926 1435280867 /nfs/dbraw/zinc/28/08/67/1435280867.db2.gz OFEQOQQVUSWKPR-MSOLQXFVSA-N 2 1 386.540 3.432 20 0 GGADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)C(=O)N[C@H](C)c1ccccc1OC ZINC000277223926 1435280872 /nfs/dbraw/zinc/28/08/72/1435280872.db2.gz OFEQOQQVUSWKPR-MSOLQXFVSA-N 2 1 386.540 3.432 20 0 GGADMP C[C@H](c1ccc(NC(=O)NCC2CC[NH+](C3CC3)CC2)cc1)[NH+]1CCOCC1 ZINC000277760535 1435327934 /nfs/dbraw/zinc/32/79/34/1435327934.db2.gz RGHPOOLWVZRQDR-QGZVFWFLSA-N 2 1 386.540 3.076 20 0 GGADMP C[NH+]1CCN(C(=O)c2ccc(C[NH2+][C@H]3CCCNc4ccccc43)cc2)CC1 ZINC000278257682 1435374068 /nfs/dbraw/zinc/37/40/68/1435374068.db2.gz NFSNYIWHSQTSKN-QFIPXVFZSA-N 2 1 378.520 3.111 20 0 GGADMP C[NH+]1CCN(C(=O)c2ccc(C[NH2+][C@@H]3CCCNc4ccccc43)cc2)CC1 ZINC000278257678 1435374085 /nfs/dbraw/zinc/37/40/85/1435374085.db2.gz NFSNYIWHSQTSKN-JOCHJYFZSA-N 2 1 378.520 3.111 20 0 GGADMP Cc1c[nH+]ccc1OC1CCN(C(=O)NC2CC[NH+](C3CCCC3)CC2)CC1 ZINC000278484336 1435394327 /nfs/dbraw/zinc/39/43/27/1435394327.db2.gz JMNJSZFPBFFKDU-UHFFFAOYSA-N 2 1 386.540 3.350 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1 ZINC000278516121 1435396480 /nfs/dbraw/zinc/39/64/80/1435396480.db2.gz MLVHANQLINYVCT-QZTJIDSGSA-N 2 1 376.545 3.368 20 0 GGADMP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1 ZINC000278516121 1435396482 /nfs/dbraw/zinc/39/64/82/1435396482.db2.gz MLVHANQLINYVCT-QZTJIDSGSA-N 2 1 376.545 3.368 20 0 GGADMP O=C1c2ccccc2C(=O)N1CCC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278831993 1435428449 /nfs/dbraw/zinc/42/84/49/1435428449.db2.gz IMHXAFUHXUJKMX-UHFFFAOYSA-N 2 1 392.503 3.085 20 0 GGADMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH+](C3CCOCC3)C[C@@H]2C)cc1)C(C)C ZINC000278859896 1435432303 /nfs/dbraw/zinc/43/23/03/1435432303.db2.gz MYGMJONVXIZHBM-IBGZPJMESA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)cc1)C(C)C ZINC000278859896 1435432306 /nfs/dbraw/zinc/43/23/06/1435432306.db2.gz MYGMJONVXIZHBM-IBGZPJMESA-N 2 1 387.568 3.242 20 0 GGADMP CC[NH+](Cc1ccc(C(=O)N2CC[N@H+](C3CCOCC3)C[C@@H]2C)cc1)C(C)C ZINC000278859896 1435432308 /nfs/dbraw/zinc/43/23/08/1435432308.db2.gz MYGMJONVXIZHBM-IBGZPJMESA-N 2 1 387.568 3.242 20 0 GGADMP Cc1nc[nH]c1CC(=O)N(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000279426836 1435498089 /nfs/dbraw/zinc/49/80/89/1435498089.db2.gz LYRYLNFKMGMQDS-KRWDZBQOSA-N 2 1 394.441 3.174 20 0 GGADMP CN(C)C(=O)COc1ccccc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000279503512 1435506761 /nfs/dbraw/zinc/50/67/61/1435506761.db2.gz WKFUWKFRYHIPNQ-UHFFFAOYSA-N 2 1 396.535 3.066 20 0 GGADMP C[N@H+]1CC[C@H](CNC(=O)[C@@H]2CCC[NH+]2C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000279862193 1435554188 /nfs/dbraw/zinc/55/41/88/1435554188.db2.gz MPNYQNKEGAYMQG-MDASCCDHSA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)[C@@H]2CCC[N@@H+]2C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000279862193 1435554193 /nfs/dbraw/zinc/55/41/93/1435554193.db2.gz MPNYQNKEGAYMQG-MDASCCDHSA-N 2 1 379.907 3.215 20 0 GGADMP C[NH+]1CC[C@H](CNC(=O)[C@@H]2CCC[N@H+]2C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000279862193 1435554196 /nfs/dbraw/zinc/55/41/96/1435554196.db2.gz MPNYQNKEGAYMQG-MDASCCDHSA-N 2 1 379.907 3.215 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)[C@@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000279907310 1435561276 /nfs/dbraw/zinc/56/12/76/1435561276.db2.gz LPLKNVOKYAYWTA-RTBURBONSA-N 2 1 377.573 3.203 20 0 GGADMP COc1cc2c(cc1OC)[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)CC2 ZINC000279961707 1435570027 /nfs/dbraw/zinc/57/00/27/1435570027.db2.gz CIDRXHOIBVXLHC-UNMCSNQZSA-N 2 1 396.531 3.438 20 0 GGADMP Cc1cc(N2CCC([NH2+]Cc3ccc(Cl)cc3-n3cncn3)CC2)nc(C)[nH+]1 ZINC000280266851 1435621654 /nfs/dbraw/zinc/62/16/54/1435621654.db2.gz LPRGGECFHFVAPO-UHFFFAOYSA-N 2 1 397.914 3.086 20 0 GGADMP CO[C@]1(C)CCC[N@H+]([C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000280510825 1435671636 /nfs/dbraw/zinc/67/16/36/1435671636.db2.gz NNWGUUQBMZMQCT-WMZHIEFXSA-N 2 1 387.568 3.047 20 0 GGADMP CO[C@@]1(C)CCC[N@H+]([C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000280510827 1435671754 /nfs/dbraw/zinc/67/17/54/1435671754.db2.gz NNWGUUQBMZMQCT-XXBNENTESA-N 2 1 387.568 3.047 20 0 GGADMP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cn1 ZINC000280626291 1435692205 /nfs/dbraw/zinc/69/22/05/1435692205.db2.gz LMQGDSWAVYQUQF-HXUWFJFHSA-N 2 1 380.536 3.440 20 0 GGADMP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cn1 ZINC000280626289 1435692503 /nfs/dbraw/zinc/69/25/03/1435692503.db2.gz LMQGDSWAVYQUQF-FQEVSTJZSA-N 2 1 380.536 3.440 20 0 GGADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CC2([NH+]3CCCC3)CCOCC2)cc1OC ZINC000280752064 1435714642 /nfs/dbraw/zinc/71/46/42/1435714642.db2.gz CTFFEBHDGDNAGF-MSOLQXFVSA-N 2 1 376.541 3.430 20 0 GGADMP Cc1noc(C2CCC([NH2+]Cc3cccc(C[N@@H+]4CCO[C@H](C)C4)c3)CC2)n1 ZINC000280929244 1435743495 /nfs/dbraw/zinc/74/34/95/1435743495.db2.gz HBHCGCFKFLSBIT-YMTQGWHGSA-N 2 1 384.524 3.415 20 0 GGADMP Cc1noc(C2CCC([NH2+]Cc3cccc(C[N@H+]4CCO[C@H](C)C4)c3)CC2)n1 ZINC000280929244 1435743498 /nfs/dbraw/zinc/74/34/98/1435743498.db2.gz HBHCGCFKFLSBIT-YMTQGWHGSA-N 2 1 384.524 3.415 20 0 GGADMP [NH3+]CC[C@@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000281611020 1435815507 /nfs/dbraw/zinc/81/55/07/1435815507.db2.gz BFFJHSUGVAMFHP-HKUYNNGSSA-N 2 1 383.458 3.028 20 0 GGADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccnn1-c1ccccc1 ZINC000281725892 1435819637 /nfs/dbraw/zinc/81/96/37/1435819637.db2.gz USEISJPSYXGIAS-PGRDOPGGSA-N 2 1 376.504 3.290 20 0 GGADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3cnn(C)c3)s2)[C@@H](C)C1 ZINC000282208004 1435838383 /nfs/dbraw/zinc/83/83/83/1435838383.db2.gz IUZYQEGHDVDYPC-QFBILLFUSA-N 2 1 376.570 3.375 20 0 GGADMP Cn1cc(-c2ccc(C[NH2+]Cc3ccc(C[NH+]4CCN(C)CC4)cc3)s2)cn1 ZINC000282329804 1435843359 /nfs/dbraw/zinc/84/33/59/1435843359.db2.gz UWKUNMQTDVOAKW-UHFFFAOYSA-N 2 1 395.576 3.186 20 0 GGADMP CCC[N@@H+](CC)Cc1ccc(C(=O)N2CCC[C@@H](C[NH+]3CCOCC3)C2)cc1 ZINC000282353524 1435844121 /nfs/dbraw/zinc/84/41/21/1435844121.db2.gz LWGGXMJACHCKCN-NRFANRHFSA-N 2 1 387.568 3.103 20 0 GGADMP O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC000282411994 1435846262 /nfs/dbraw/zinc/84/62/62/1435846262.db2.gz GALFJZPBXDDOBN-JRFVFWCSSA-N 2 1 389.543 3.213 20 0 GGADMP O=C(c1ccccc1)N1CC[C@H](C[NH+]2C[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC000282411994 1435846263 /nfs/dbraw/zinc/84/62/63/1435846263.db2.gz GALFJZPBXDDOBN-JRFVFWCSSA-N 2 1 389.543 3.213 20 0 GGADMP O=C(c1ccccc1)N1CC[C@H](C[NH+]2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC000282411994 1435846264 /nfs/dbraw/zinc/84/62/64/1435846264.db2.gz GALFJZPBXDDOBN-JRFVFWCSSA-N 2 1 389.543 3.213 20 0 GGADMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]C3CCC(C(F)F)CC3)c2)C1 ZINC000282436701 1435847162 /nfs/dbraw/zinc/84/71/62/1435847162.db2.gz UHSVVDIRTDLTBQ-JLAWEPINSA-N 2 1 379.495 3.297 20 0 GGADMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]C3CCC(C(F)F)CC3)c2)C1 ZINC000282436703 1435847211 /nfs/dbraw/zinc/84/72/11/1435847211.db2.gz UHSVVDIRTDLTBQ-XBMUEBEBSA-N 2 1 379.495 3.297 20 0 GGADMP CCS(=O)(=O)CCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000282449509 1435847639 /nfs/dbraw/zinc/84/76/39/1435847639.db2.gz ITMBTPJRWALTHS-HXUWFJFHSA-N 2 1 380.598 3.482 20 0 GGADMP CCS(=O)(=O)CCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282449509 1435847641 /nfs/dbraw/zinc/84/76/41/1435847641.db2.gz ITMBTPJRWALTHS-HXUWFJFHSA-N 2 1 380.598 3.482 20 0 GGADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1CC[NH+](C2CC2)C1 ZINC000282668511 1435855724 /nfs/dbraw/zinc/85/57/24/1435855724.db2.gz GTWPNJIBLSFGQE-CTNGQTDRSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000282668511 1435855725 /nfs/dbraw/zinc/85/57/25/1435855725.db2.gz GTWPNJIBLSFGQE-CTNGQTDRSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[NH+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000282668511 1435855726 /nfs/dbraw/zinc/85/57/26/1435855726.db2.gz GTWPNJIBLSFGQE-CTNGQTDRSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@@H]1CC[NH+](C2CC2)C1 ZINC000282668532 1435855769 /nfs/dbraw/zinc/85/57/69/1435855769.db2.gz GTWPNJIBLSFGQE-PZJWPPBQSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[NH+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000282668532 1435855771 /nfs/dbraw/zinc/85/57/71/1435855771.db2.gz GTWPNJIBLSFGQE-PZJWPPBQSA-N 2 1 384.568 3.071 20 0 GGADMP CC1(C)C[NH+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000282668532 1435855773 /nfs/dbraw/zinc/85/57/73/1435855773.db2.gz GTWPNJIBLSFGQE-PZJWPPBQSA-N 2 1 384.568 3.071 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1=CC[NH+](C)CC1 ZINC000282703441 1435856992 /nfs/dbraw/zinc/85/69/92/1435856992.db2.gz JMGXBFCCQFVFIH-NQIIRXRSSA-N 2 1 384.568 3.237 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1CC[NH+](Cc2ccccc2)CC1(C)C)C1=CC[N@H+](C)CC1 ZINC000282703441 1435856993 /nfs/dbraw/zinc/85/69/93/1435856993.db2.gz JMGXBFCCQFVFIH-NQIIRXRSSA-N 2 1 384.568 3.237 20 0 GGADMP C[C@@H](NC(=O)N[C@H]1CC[NH+](Cc2ccccc2)CC1(C)C)C1=CC[N@@H+](C)CC1 ZINC000282703441 1435856994 /nfs/dbraw/zinc/85/69/94/1435856994.db2.gz JMGXBFCCQFVFIH-NQIIRXRSSA-N 2 1 384.568 3.237 20 0 GGADMP C[C@@H](NC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1=CC[NH+](C)CC1 ZINC000282703457 1435857055 /nfs/dbraw/zinc/85/70/55/1435857055.db2.gz JMGXBFCCQFVFIH-WIYYLYMNSA-N 2 1 384.568 3.237 20 0 GGADMP C[C@@H](NC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)CC1(C)C)C1=CC[N@H+](C)CC1 ZINC000282703457 1435857056 /nfs/dbraw/zinc/85/70/56/1435857056.db2.gz JMGXBFCCQFVFIH-WIYYLYMNSA-N 2 1 384.568 3.237 20 0 GGADMP C[C@@H](NC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)CC1(C)C)C1=CC[N@@H+](C)CC1 ZINC000282703457 1435857057 /nfs/dbraw/zinc/85/70/57/1435857057.db2.gz JMGXBFCCQFVFIH-WIYYLYMNSA-N 2 1 384.568 3.237 20 0 GGADMP CN(CC1CC[NH+](C)CC1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282837360 1435862383 /nfs/dbraw/zinc/86/23/83/1435862383.db2.gz STUOQJBKRSRQTJ-OAQYLSRUSA-N 2 1 386.584 3.270 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)N[C@H]1CC[NH+](Cc2ccccc2)CC1(C)C ZINC000282998235 1435869617 /nfs/dbraw/zinc/86/96/17/1435869617.db2.gz QWYVNRFNBRMGNW-GIVPXCGWSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@@H]1N(C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000282998235 1435869618 /nfs/dbraw/zinc/86/96/18/1435869618.db2.gz QWYVNRFNBRMGNW-GIVPXCGWSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@@H]1N(C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282998235 1435869619 /nfs/dbraw/zinc/86/96/19/1435869619.db2.gz QWYVNRFNBRMGNW-GIVPXCGWSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)CC1(C)C ZINC000282998246 1435869624 /nfs/dbraw/zinc/86/96/24/1435869624.db2.gz QWYVNRFNBRMGNW-HLAWJBBLSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@@H]1N(C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000282998246 1435869625 /nfs/dbraw/zinc/86/96/25/1435869625.db2.gz QWYVNRFNBRMGNW-HLAWJBBLSA-N 2 1 386.584 3.269 20 0 GGADMP C[C@@H]1C[NH+](C)CC[C@@H]1N(C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282998246 1435869626 /nfs/dbraw/zinc/86/96/26/1435869626.db2.gz QWYVNRFNBRMGNW-HLAWJBBLSA-N 2 1 386.584 3.269 20 0 GGADMP CCOC(=O)[C@H]1CC[C@@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)c2ccccc21 ZINC000283189466 1435878531 /nfs/dbraw/zinc/87/85/31/1435878531.db2.gz KLKHDXBMGSRYEZ-LEWJYISDSA-N 2 1 386.536 3.403 20 0 GGADMP CCN1CC[NH+](CCCC[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000284275063 1436009018 /nfs/dbraw/zinc/00/90/18/1436009018.db2.gz XBDYHIFCPRUSEN-UHFFFAOYSA-N 3 1 386.628 3.437 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC000284275063 1436009021 /nfs/dbraw/zinc/00/90/21/1436009021.db2.gz XBDYHIFCPRUSEN-UHFFFAOYSA-N 3 1 386.628 3.437 20 0 GGADMP CC[NH+]1CCN(CCCC[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000284275063 1436009023 /nfs/dbraw/zinc/00/90/23/1436009023.db2.gz XBDYHIFCPRUSEN-UHFFFAOYSA-N 3 1 386.628 3.437 20 0 GGADMP COc1ncc([C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)cc1Cl ZINC000284548216 1436029323 /nfs/dbraw/zinc/02/93/23/1436029323.db2.gz XUSHEWLDTQBMRQ-ZDUSSCGKSA-N 2 1 375.904 3.470 20 0 GGADMP Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)C1CCOCC1 ZINC000284751942 1436046405 /nfs/dbraw/zinc/04/64/05/1436046405.db2.gz FZKUQKVDMDQSRM-KAOXLYBCSA-N 2 1 394.563 3.388 20 0 GGADMP Cn1ccnc1[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)C1CCOCC1 ZINC000284751942 1436046407 /nfs/dbraw/zinc/04/64/07/1436046407.db2.gz FZKUQKVDMDQSRM-KAOXLYBCSA-N 2 1 394.563 3.388 20 0 GGADMP C[NH+]1CCC(Oc2ccnc(N3[C@H](C(F)(F)F)CCC34CC[NH2+]CC4)c2)CC1 ZINC001164413284 718881453 /nfs/dbraw/zinc/88/14/53/718881453.db2.gz GMTANTNRFZWHDB-KRWDZBQOSA-N 2 1 398.473 3.208 20 0 GGADMP C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4C[C@@H]5C[C@]5([NH3+])C4)c23)C1 ZINC001164416583 718888388 /nfs/dbraw/zinc/88/83/88/718888388.db2.gz DJFHDCOQDKSZPO-GTQRCTGISA-N 2 1 397.592 3.339 20 0 GGADMP c1ccc(C[N@@H+]2CCc3c(ncnc3N3CCCC[C@H]3C3CC[NH2+]CC3)C2)cc1 ZINC001164418473 718891756 /nfs/dbraw/zinc/89/17/56/718891756.db2.gz OBFKBLLZBBQYQR-QHCPKHFHSA-N 2 1 391.563 3.393 20 0 GGADMP c1ccc(C[N@H+]2CCc3c(ncnc3N3CCCC[C@H]3C3CC[NH2+]CC3)C2)cc1 ZINC001164418473 718891757 /nfs/dbraw/zinc/89/17/57/718891757.db2.gz OBFKBLLZBBQYQR-QHCPKHFHSA-N 2 1 391.563 3.393 20 0 GGADMP [NH3+][C@@]12C[C@@H]1CCN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164421078 718896302 /nfs/dbraw/zinc/89/63/02/718896302.db2.gz PKUQUEOAANHINH-OYHNWAKOSA-N 2 1 397.592 3.484 20 0 GGADMP Cc1[nH+]cc2n1CCN(C(F)(F)c1cnc(Cl)c(C3=CC[NH2+]CC3)c1)C2 ZINC001164450448 718992961 /nfs/dbraw/zinc/99/29/61/718992961.db2.gz WIDPNAKSAIJVFU-UHFFFAOYSA-N 2 1 379.842 3.182 20 0 GGADMP CC1CC[NH+](Cc2nc3sc4c(c3c(N3CCC[C@@H]5[NH2+]C[C@H]53)n2)CCC4)CC1 ZINC001164448727 719000783 /nfs/dbraw/zinc/00/07/83/719000783.db2.gz IXZJRVUGWREGDU-DLBZAZTESA-N 2 1 397.592 3.353 20 0 GGADMP Cc1sc2nc(C[NH+]3CCCC3)nc(N3CCC(C4C[NH2+]C4)CC3)c2c1C ZINC001164616189 719037019 /nfs/dbraw/zinc/03/70/19/719037019.db2.gz UAVKKWZLSQCKFJ-UHFFFAOYSA-N 2 1 385.581 3.340 20 0 GGADMP c1ccc(C[N@H+]2C[C@H]3CCCN(c4nccc(C5CC[NH2+]CC5)n4)[C@@H]3C2)cc1 ZINC001164628797 719089076 /nfs/dbraw/zinc/08/90/76/719089076.db2.gz OIPOAXXVQQFWJO-IFMALSPDSA-N 2 1 377.536 3.044 20 0 GGADMP [NH3+]C1CCN(c2cccc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)n2)CC1 ZINC001164626713 719092342 /nfs/dbraw/zinc/09/23/42/719092342.db2.gz IOKXGACRBQYETL-IRLDBZIGSA-N 2 1 391.563 3.110 20 0 GGADMP COc1cc(C(F)(F)n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)cc(Cl)n1 ZINC001164684987 719607295 /nfs/dbraw/zinc/60/72/95/719607295.db2.gz PRKSGXTZBAMKMM-UHFFFAOYSA-N 2 1 399.873 3.024 20 0 GGADMP COc1cc(C(F)(F)n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)cc(Cl)n1 ZINC001164684987 719607302 /nfs/dbraw/zinc/60/73/02/719607302.db2.gz PRKSGXTZBAMKMM-UHFFFAOYSA-N 2 1 399.873 3.024 20 0 GGADMP Cc1cc2c(nc(Cl)nc2-n2nc(C[N@@H+](C)C(C)C)c3c2C[NH2+]CC3)s1 ZINC001164686250 719615188 /nfs/dbraw/zinc/61/51/88/719615188.db2.gz ZNHJTANCOSAUKO-UHFFFAOYSA-N 2 1 390.944 3.325 20 0 GGADMP Cc1cc2c(nc(Cl)nc2-n2nc(C[N@H+](C)C(C)C)c3c2C[NH2+]CC3)s1 ZINC001164686250 719615194 /nfs/dbraw/zinc/61/51/94/719615194.db2.gz ZNHJTANCOSAUKO-UHFFFAOYSA-N 2 1 390.944 3.325 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nc(Cl)nc3c(F)cccc32)c2c1CC[NH2+]C2 ZINC001164684698 719618342 /nfs/dbraw/zinc/61/83/42/719618342.db2.gz WRHGIOYABQKYQC-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nc(Cl)nc3c(F)cccc32)c2c1CC[NH2+]C2 ZINC001164684698 719618348 /nfs/dbraw/zinc/61/83/48/719618348.db2.gz WRHGIOYABQKYQC-UHFFFAOYSA-N 2 1 388.878 3.094 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nc(Cl)nc3c2CCCCC3)c2c1CC[NH2+]C2 ZINC001164682022 719618442 /nfs/dbraw/zinc/61/84/42/719618442.db2.gz LEBBPCYTQHKANL-UHFFFAOYSA-N 2 1 388.947 3.071 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nc(Cl)nc3c2CCCCC3)c2c1CC[NH2+]C2 ZINC001164682022 719618446 /nfs/dbraw/zinc/61/84/46/719618446.db2.gz LEBBPCYTQHKANL-UHFFFAOYSA-N 2 1 388.947 3.071 20 0 GGADMP COc1ccc2c(C)cc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)nc2c1 ZINC001164681188 719628801 /nfs/dbraw/zinc/62/88/01/719628801.db2.gz CIDLURYSNULJAX-UHFFFAOYSA-N 2 1 379.508 3.223 20 0 GGADMP COc1ccc2c(C)cc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)nc2c1 ZINC001164681188 719628804 /nfs/dbraw/zinc/62/88/04/719628804.db2.gz CIDLURYSNULJAX-UHFFFAOYSA-N 2 1 379.508 3.223 20 0 GGADMP Cc1cccc2nc(Cl)nc(-n3nc(C[N@@H+](C)C(C)C)c4c3C[NH2+]CC4)c12 ZINC001164682607 719631974 /nfs/dbraw/zinc/63/19/74/719631974.db2.gz OJLBUOVMWNXESM-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP Cc1cccc2nc(Cl)nc(-n3nc(C[N@H+](C)C(C)C)c4c3C[NH2+]CC4)c12 ZINC001164682607 719631986 /nfs/dbraw/zinc/63/19/86/719631986.db2.gz OJLBUOVMWNXESM-UHFFFAOYSA-N 2 1 384.915 3.263 20 0 GGADMP CC(C)[N@H+](C)Cc1nn(-c2nccc(Oc3cccc(F)c3)n2)c2c1CC[NH2+]C2 ZINC001164680135 719634245 /nfs/dbraw/zinc/63/42/45/719634245.db2.gz PKFZERVPYODOPU-UHFFFAOYSA-N 2 1 396.470 3.080 20 0 GGADMP CC(C)[N@@H+](C)Cc1nn(-c2nccc(Oc3cccc(F)c3)n2)c2c1CC[NH2+]C2 ZINC001164680135 719634261 /nfs/dbraw/zinc/63/42/61/719634261.db2.gz PKFZERVPYODOPU-UHFFFAOYSA-N 2 1 396.470 3.080 20 0 GGADMP c1csc(C[N@H+]2CCOC3(CCN(c4cc(-n5ccnc5)cc[nH+]4)CC3)C2)c1 ZINC001164707717 719900124 /nfs/dbraw/zinc/90/01/24/719900124.db2.gz WBYKPPPIJZZPMZ-UHFFFAOYSA-N 2 1 395.532 3.200 20 0 GGADMP C[NH+](C)Cc1ccnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c1 ZINC001164707482 719901807 /nfs/dbraw/zinc/90/18/07/719901807.db2.gz RALHSVVBFQFKJB-UHFFFAOYSA-N 2 1 386.565 3.076 20 0 GGADMP CCc1nc(N2CCC3(C[C@@H](COC)[N@H+](Cc4ccccn4)C3)CC2)cc(C)[nH+]1 ZINC001164713553 720143173 /nfs/dbraw/zinc/14/31/73/720143173.db2.gz RWRKUROJBGXZSH-FQEVSTJZSA-N 2 1 395.551 3.250 20 0 GGADMP CCc1nc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)cc(C)[nH+]1 ZINC001164713553 720143184 /nfs/dbraw/zinc/14/31/84/720143184.db2.gz RWRKUROJBGXZSH-FQEVSTJZSA-N 2 1 395.551 3.250 20 0 GGADMP CC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3nccn3C[C@H](C[NH+](C)C)C2)nc1 ZINC001164736052 720532357 /nfs/dbraw/zinc/53/23/57/720532357.db2.gz UVYYNHPNKORRDZ-ICSRJNTNSA-N 2 1 382.556 3.023 20 0 GGADMP CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cc(N4CCCC4)cc[nH+]3)CC[C@@H]21 ZINC001164842456 720571888 /nfs/dbraw/zinc/57/18/88/720571888.db2.gz XMZSLXHNGPXTIF-HJNYFJLDSA-N 2 1 394.567 3.256 20 0 GGADMP COc1cc(N2CCc3ncc(C[NH+]4CCCC4)n3CC2)[nH+]c2ccccc21 ZINC001164730790 720574132 /nfs/dbraw/zinc/57/41/32/720574132.db2.gz ZRDOBVWNVYRRAB-UHFFFAOYSA-N 2 1 377.492 3.098 20 0 GGADMP Cc1[nH+]c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)cc2[nH]ccc21 ZINC001164841283 720588184 /nfs/dbraw/zinc/58/81/84/720588184.db2.gz RUKQFHGEMVMUAD-LVCYWYKZSA-N 2 1 378.524 3.446 20 0 GGADMP C[NH+](C)Cc1ccnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164840956 720720701 /nfs/dbraw/zinc/72/07/01/720720701.db2.gz SXSFIBYPYRJMJY-QFIPXVFZSA-N 2 1 394.563 3.403 20 0 GGADMP Cc1cc(N2CCCC2)nc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@H]2C)[nH+]1 ZINC001164858333 720917814 /nfs/dbraw/zinc/91/78/14/720917814.db2.gz MQHSGLUEVKCZPT-QGZVFWFLSA-N 2 1 383.544 3.003 20 0 GGADMP CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncccc1C[NH+]1CCCC1)[C@@H]2C ZINC001164864804 721018295 /nfs/dbraw/zinc/01/82/95/721018295.db2.gz ZOIPPXGECIEQIE-GOSISDBHSA-N 2 1 382.556 3.295 20 0 GGADMP Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc4[nH]ccc4c[nH+]3)C2)C1 ZINC001164776709 721337362 /nfs/dbraw/zinc/33/73/62/721337362.db2.gz HXUQMOIVYJRJEJ-JOCHJYFZSA-N 2 1 395.507 3.287 20 0 GGADMP COCC[N@@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc3c([nH+]1)CCC3)CC2 ZINC001164790060 721456709 /nfs/dbraw/zinc/45/67/09/721456709.db2.gz ZIDSLCAWLSGEAD-OAQYLSRUSA-N 2 1 399.579 3.304 20 0 GGADMP COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc3c([nH+]1)CCC3)CC2 ZINC001164790060 721456722 /nfs/dbraw/zinc/45/67/22/721456722.db2.gz ZIDSLCAWLSGEAD-OAQYLSRUSA-N 2 1 399.579 3.304 20 0 GGADMP COCC[N@@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1[nH+]cc(C)cc1C)CC2 ZINC001164789870 721459430 /nfs/dbraw/zinc/45/94/30/721459430.db2.gz YBEWZNBGJHKYNA-NRFANRHFSA-N 2 1 387.568 3.432 20 0 GGADMP COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1[nH+]cc(C)cc1C)CC2 ZINC001164789870 721459432 /nfs/dbraw/zinc/45/94/32/721459432.db2.gz YBEWZNBGJHKYNA-NRFANRHFSA-N 2 1 387.568 3.432 20 0 GGADMP C[NH+](C)Cc1ccnc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)c1 ZINC001164796959 721502037 /nfs/dbraw/zinc/50/20/37/721502037.db2.gz ZYUUNSBQTYXVDD-UHFFFAOYSA-N 2 1 379.552 3.419 20 0 GGADMP Fc1cccc(O[C@@H]2C[C@H]3CN(c4cc(N5CCCC5)cc[nH+]4)CC[N@H+]3C2)c1 ZINC001164906775 721545143 /nfs/dbraw/zinc/54/51/43/721545143.db2.gz LHOVFLXVXYIMRQ-PZJWPPBQSA-N 2 1 382.483 3.163 20 0 GGADMP Fc1cccc(O[C@@H]2C[C@@H]3CN(c4ccc(C[NH+]5CCCC5)cn4)CC[N@H+]3C2)c1 ZINC001164904827 721552795 /nfs/dbraw/zinc/55/27/95/721552795.db2.gz FZJKEXCNBJTOMI-IFMALSPDSA-N 2 1 396.510 3.158 20 0 GGADMP Fc1cccc(O[C@H]2C[C@H]3CN(c4ccc(C[NH+]5CCCC5)cn4)CC[N@H+]3C2)c1 ZINC001164904834 721552849 /nfs/dbraw/zinc/55/28/49/721552849.db2.gz FZJKEXCNBJTOMI-UNMCSNQZSA-N 2 1 396.510 3.158 20 0 GGADMP C[N@@H+](Cc1ccc(N2CC[NH+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1)C1CC1 ZINC001164908721 721557597 /nfs/dbraw/zinc/55/75/97/721557597.db2.gz RTIWCLSPQQSVHJ-UNMCSNQZSA-N 2 1 396.510 3.157 20 0 GGADMP C[NH+](Cc1ccc(N2CC[N@@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1)C1CC1 ZINC001164908721 721557601 /nfs/dbraw/zinc/55/76/01/721557601.db2.gz RTIWCLSPQQSVHJ-UNMCSNQZSA-N 2 1 396.510 3.157 20 0 GGADMP C[NH+](Cc1ccc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1)C1CC1 ZINC001164908721 721557606 /nfs/dbraw/zinc/55/76/06/721557606.db2.gz RTIWCLSPQQSVHJ-UNMCSNQZSA-N 2 1 396.510 3.157 20 0 GGADMP Cc1[nH+]c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)cc2[nH]ccc21 ZINC001164805380 721572245 /nfs/dbraw/zinc/57/22/45/721572245.db2.gz NDKGDDVXSYNOCU-URVUXULASA-N 2 1 377.492 3.135 20 0 GGADMP CN(C)c1cccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)[nH+]1 ZINC001164903722 721586195 /nfs/dbraw/zinc/58/61/95/721586195.db2.gz BXKJVNWNZBGWMH-FQEVSTJZSA-N 2 1 387.478 3.280 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC(F)(F)[C@@]2(CC[N@H+](Cc3ccccn3)C2)C1 ZINC001164904926 721692309 /nfs/dbraw/zinc/69/23/09/721692309.db2.gz HQHFFCDAPADMMF-HXUWFJFHSA-N 2 1 398.461 3.101 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164904926 721692312 /nfs/dbraw/zinc/69/23/12/721692312.db2.gz HQHFFCDAPADMMF-HXUWFJFHSA-N 2 1 398.461 3.101 20 0 GGADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(N4CCCC4)cc[nH+]3)C[C@H]21 ZINC001165028639 721797805 /nfs/dbraw/zinc/79/78/05/721797805.db2.gz ZINSSHNORPSFDD-HMXCVIKNSA-N 2 1 392.551 3.209 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(N4CCCC4)cc[nH+]3)C[C@H]21 ZINC001165028639 721797807 /nfs/dbraw/zinc/79/78/07/721797807.db2.gz ZINSSHNORPSFDD-HMXCVIKNSA-N 2 1 392.551 3.209 20 0 GGADMP CCN(C)c1cc(C)[nH+]c(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165020428 721797909 /nfs/dbraw/zinc/79/79/09/721797909.db2.gz FRPKDGPQBVYFMU-TYPHKJRUSA-N 2 1 394.567 3.373 20 0 GGADMP CCN(C)c1cc[nH+]c(N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165021468 721798074 /nfs/dbraw/zinc/79/80/74/721798074.db2.gz HBXVRBKCYHPHNV-IHPCNDPISA-N 2 1 380.540 3.065 20 0 GGADMP CCN(C)c1cc[nH+]c(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165021468 721798075 /nfs/dbraw/zinc/79/80/75/721798075.db2.gz HBXVRBKCYHPHNV-IHPCNDPISA-N 2 1 380.540 3.065 20 0 GGADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(NC4CC4)cc[nH+]3)C[C@H]21 ZINC001165028008 721798277 /nfs/dbraw/zinc/79/82/77/721798277.db2.gz XVNOMXKFNOLLTE-PWIZWCRZSA-N 2 1 378.524 3.183 20 0 GGADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(NC4CC4)cc[nH+]3)C[C@H]21 ZINC001165028008 721798280 /nfs/dbraw/zinc/79/82/80/721798280.db2.gz XVNOMXKFNOLLTE-PWIZWCRZSA-N 2 1 378.524 3.183 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1C[C@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165017780 721804251 /nfs/dbraw/zinc/80/42/51/721804251.db2.gz APJLCWFPQZLHEV-NSISKUIASA-N 2 1 376.508 3.100 20 0 GGADMP Cn1ccc2c1nc[nH+]c2N1C[C@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165017780 721804252 /nfs/dbraw/zinc/80/42/52/721804252.db2.gz APJLCWFPQZLHEV-NSISKUIASA-N 2 1 376.508 3.100 20 0 GGADMP Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(N(C)C)cc[nH+]4)CC3)C2)cc1 ZINC001164939374 721925851 /nfs/dbraw/zinc/92/58/51/721925851.db2.gz KPEBYZDCDZQZBO-UHFFFAOYSA-N 2 1 380.536 3.327 20 0 GGADMP CCC[N@H+]1CCCC[C@H]1c1ccc(N2C[C@@H]3C[NH+](CC4CC4)C[C@H](C2)O3)nc1 ZINC001164968091 722077509 /nfs/dbraw/zinc/07/75/09/722077509.db2.gz QCAOAUMQXGRQKI-BDTNDASRSA-N 2 1 384.568 3.318 20 0 GGADMP CCC[NH+]1CCCC[C@H]1c1ccc(N2C[C@@H]3C[N@@H+](CC4CC4)C[C@H](C2)O3)nc1 ZINC001164968091 722077511 /nfs/dbraw/zinc/07/75/11/722077511.db2.gz QCAOAUMQXGRQKI-BDTNDASRSA-N 2 1 384.568 3.318 20 0 GGADMP CCC[NH+]1CCCC[C@H]1c1ccc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)nc1 ZINC001164968091 722077512 /nfs/dbraw/zinc/07/75/12/722077512.db2.gz QCAOAUMQXGRQKI-BDTNDASRSA-N 2 1 384.568 3.318 20 0 GGADMP